data_2kay_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2kay _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.242 0.663 0 N-CA-C 106.39 -1.707 . . . . 3.9700000000000002 106.39 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.7 p -71.05 168.07 24.04 Favored Pre-proline 0 N--CA 1.478 0.94 0 C-N-CA 123.379 0.671 . . . . 2.5499999999999998 112.805 -171.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -61.28 -20.82 69.73 Favored 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 122.484 2.123 . . . . 2.02 113.211 165.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.01 -41.59 42.11 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.637 1.175 . . . . 3.2999999999999998 111.327 173.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -61.08 -36.05 78.59 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.642 -1.286 . . . . 3.8599999999999999 110.741 169.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.9 mttp -69.97 -32.61 70.91 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.723 -1.236 . . . . 4.2400000000000002 112.749 172.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.05 -53.07 55.71 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.261 1.025 . . . . 1.6499999999999999 111.091 170.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.4 mt -55.31 -43.18 74.64 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.35 1.46 . . . . 2.3100000000000001 111.729 173.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 95.7 m -59.14 -40.95 87.08 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 117.611 -1.185 . . . . 2.5899999999999999 111.678 173.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 29.0 m -66.13 -39.45 89.89 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.397 1.079 . . . . 1.95 110.756 176.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 61.1 mtp -64.19 -40.42 96.06 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.89 1.276 . . . . 3.98 111.691 174.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.35 -33.19 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 123.493 0.717 . . . . 2.8900000000000001 112.291 167.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 94.0 m -71.15 -58.21 3.77 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 117.677 -1.154 . . . . 2.1099999999999999 110.464 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.3 p -65.09 -31.49 72.73 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 118.164 -0.922 . . . . 2.6200000000000001 110.271 178.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -67.32 -64.56 0.83 Allowed 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 119.288 -0.965 . . . . 2.98 110.508 176.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.47 -39.62 84.3 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 120.12 1.327 . . . . 2.3399999999999999 112.462 -176.243 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -60.1 -51.45 69.55 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.766 -1.209 . . . . 4.6200000000000001 112.345 176.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -78.24 -24.34 47.01 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.002 -1.061 . . . . 3.1899999999999999 112.185 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.6 t -68.67 -19.04 64.38 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 126.466 1.906 . . . . 2.5 112.715 173.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.84 2.47 87.18 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 126.057 1.789 . . . . 1.3600000000000001 115.393 167.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.34 -26.01 61.76 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 120.415 2.108 . . . . 4.8700000000000001 113.192 176.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -167.21 177.94 5.89 Favored 'General case' 0 C--O 1.245 0.848 0 C-N-CA 125.776 1.63 . . . . 4.1299999999999999 111.129 -172.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.77 -141.5 44.73 Favored Glycine 0 N--CA 1.468 0.831 0 C-N-CA 124.216 0.912 . . . . 2.2799999999999998 111.951 170.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.1 t -73.97 157.33 36.38 Favored 'General case' 0 CA--C 1.551 1.013 0 O-C-N 121.558 -0.966 . . . . 3.8199999999999998 111.979 159.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -71.48 -12.81 61.58 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 127.009 2.124 . . . . 5.54 112.952 173.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.8 mt -101.57 -11.5 19.2 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.126 1.37 . . . . 4.4500000000000002 112.96 176.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.483 ' HG1' ' CD ' ' A' ' 66' ' ' GLU . 23.9 p -111.04 144.22 40.5 Favored 'General case' 0 C--O 1.248 1.002 0 C-N-CA 125.089 1.355 . . . . 1.9199999999999999 112.86 176.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.8 mt -95.08 104.94 16.82 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.324 1.05 . . . . 2.5699999999999998 109.396 161.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.6 p -57.33 162.09 2.97 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 120.684 -1.26 . . . . 3.0699999999999998 111.223 168.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -50.55 -25.42 4.07 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 120.133 -1.604 . . . . 3.8399999999999999 114.267 174.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.87 -45.42 18.68 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.105 0.962 . . . . 5.1299999999999999 113.212 171.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -62.48 -41.64 98.93 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.888 0.875 . . . . 1.4299999999999999 110.947 175.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.2 tp -66.14 -46.65 76.74 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.176 0.591 . . . . 2.8799999999999999 110.09 176.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 15.4 ttmt -61.81 -46.14 90.79 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.054 0.843 . . . . 4.54 111.803 178.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -45.05 -59.87 2.38 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 117.406 -1.283 . . . . 3.6299999999999999 111.84 165.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.0 -54.14 49.54 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.974 1.261 . . . . 2.7400000000000002 112.407 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.7 mt -56.25 -42.66 74.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 119.592 1.087 . . . . 1.9099999999999999 109.509 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 26.1 mmmt -64.87 -14.41 59.48 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 113.524 0.935 . . . . 4.3099999999999996 113.524 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 32.2 mmtm -102.22 -38.28 7.74 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.988 1.267 . . . . 4.3600000000000003 113.726 169.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -82.99 -31.62 27.41 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.534 1.534 . . . . 3.6800000000000002 112.472 -166.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -117.34 94.71 4.66 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.574 1.149 . . . . 3.5 109.19 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.4 t -79.11 -6.25 56.02 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 115.048 1.499 . . . . 3.48 115.048 -166.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.31 33.77 0.08 Allowed 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 117.65 2.463 . . . . 4.6399999999999997 117.65 -161.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.78 -46.88 2.69 Favored Glycine 0 N--CA 1.477 1.383 0 C-N-CA 125.469 1.509 . . . . 3.7799999999999998 115.407 166.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.476 ' CD ' ' HZ3' ' A' ' 48' ' ' LYS . 38.0 mm-40 -86.07 7.23 25.5 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.357 1.243 . . . . 5.2400000000000002 114.357 -176.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.7 66.2 0.73 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 124.677 2.179 . . . . 3.1299999999999999 111.001 163.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.476 ' HZ3' ' CD ' ' A' ' 46' ' ' GLU . 60.7 mttp -101.4 165.55 11.2 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 128.363 2.665 . . . . 4.9900000000000002 110.839 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -62.8 -45.47 92.48 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 115.193 1.553 . . . . 3.7400000000000002 115.193 -160.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.3 t -73.83 -28.67 61.73 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 117.91 -1.043 . . . . 3.21 113.3 172.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.77 -38.69 79.04 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.548 1.522 . . . . 3.1699999999999999 110.61 170.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 65.3 mt -81.85 -39.22 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 124.875 1.27 . . . . 2.1699999999999999 112.73 -176.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -76.71 -26.87 55.17 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 118.99 0.814 . . . . 3.3500000000000001 112.787 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -78.6 -38.69 39.39 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.116 0.871 . . . . 2.25 112.208 168.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 39.3 tp -55.03 -54.06 47.91 Favored 'General case' 0 C--N 1.344 0.362 0 O-C-N 121.462 -0.774 . . . . 2.8399999999999999 109.964 168.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 8.9 tpt -48.61 -49.45 36.96 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.706 2.002 . . . . 2.1099999999999999 111.913 176.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.58 -25.6 60.24 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.037 1.335 . . . . 4.6299999999999999 113.66 176.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.7 t -96.3 -25.87 15.6 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.941 1.297 . . . . 2.3799999999999999 113.788 177.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.1 mt -73.37 -41.93 62.8 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.154 0.981 . . . . 3.1099999999999999 111.565 173.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -69.32 149.74 48.11 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.495 0.718 . . . . 1.6899999999999999 112.053 176.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.19 -10.14 19.86 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 120.954 -1.091 . . . . 3.9199999999999999 113.791 -176.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -148.52 -10.84 0.35 Allowed 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.962 1.467 . . . . 3.1200000000000001 114.962 -165.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.0 t 79.66 18.95 0.7 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.625 2.37 . . . . 3.9700000000000002 113.315 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.3 p30 -65.05 -24.3 67.43 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.331 1.452 . . . . 2.2400000000000002 110.928 -178.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 63.84 22.23 12.95 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 130.701 3.6 . . . . 5.0599999999999996 114.211 -172.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.483 ' CD ' ' HG1' ' A' ' 28' ' ' THR . 4.1 mm-40 -115.78 121.35 42.18 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 128.907 2.883 . . . . 2.6099999999999999 107.304 164.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 14.1 mm -93.03 105.02 16.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 124.998 1.319 . . . . 1.95 109.037 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.23 158.13 36.41 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.894 2.078 . . . . 2.52 111.379 167.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -54.82 -34.0 62.27 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.982 -1.074 . . . . 3.0699999999999998 113.704 -175.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm -78.88 -27.31 43.99 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 120.781 -1.199 . . . . 3.4900000000000002 112.347 177.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -64.82 -53.02 53.42 Favored 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 108.307 -0.997 . . . . 1.77 108.307 163.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -55.57 -31.38 62.14 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 119.866 -1.771 . . . . 3.2599999999999998 114.349 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.53 -24.04 63.34 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 119.543 -1.973 . . . . 2.3199999999999998 114.28 172.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 49.0 t -63.81 -41.33 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 CA-C-N 119.067 0.849 . . . . 2.8500000000000001 110.153 172.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -61.26 -51.83 67.29 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.036 0.934 . . . . 3.0600000000000001 111.116 176.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.8 mt -59.3 -38.11 79.42 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.894 1.278 . . . . 3.3300000000000001 112.204 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 83.2 m -59.87 -55.79 29.75 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.803 0.841 . . . . 1.76 110.545 175.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 75.0 mtm -61.44 -40.27 93.85 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 111.951 0.352 . . . . 2.04 111.951 -176.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 89.0 mt -69.15 -37.0 78.02 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.281 0.845 . . . . 2.5 113.281 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 5.7 t -73.94 -31.53 63.09 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.134 0.879 . . . . 2.8500000000000001 112.979 176.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 49.1 mtp -67.65 -42.76 81.72 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.319 0.509 . . . . 2.5800000000000001 111.652 167.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.07 -41.1 91.18 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.071 -1.018 . . . . 2.1200000000000001 112.621 -175.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -68.4 -26.94 65.8 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 113.12 0.785 . . . . 3.6099999999999999 113.12 174.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -67.88 -43.5 79.23 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 120.231 1.378 . . . . 2.3399999999999999 112.734 169.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -71.26 -28.8 64.41 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.731 0.813 . . . . 4.1100000000000003 110.973 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.46 -51.01 70.48 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.855 1.262 . . . . 2.8799999999999999 111.652 164.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 35.3 t80 -60.14 -33.43 72.15 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.104 1.362 . . . . 3.6400000000000001 112.316 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 41.1 mt -68.02 -20.28 64.98 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.859 1.264 . . . . 2.1899999999999999 113.87 173.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -101.11 -9.95 20.9 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.632 1.173 . . . . 2.6400000000000001 114.09 176.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 12.4 t70 . . . . . 0 N--CA 1.472 0.642 0 C-N-CA 125.163 1.385 . . . . 2.7200000000000002 113.079 -173.068 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 59.1 p . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 113.519 0.933 . . . . 2.7000000000000002 113.519 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.69 -21.51 69.72 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.579 2.186 . . . . 1.6499999999999999 112.967 167.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.57 -44.11 36.03 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 119.397 0.999 . . . . 3.3399999999999999 110.842 173.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -58.93 -35.07 72.47 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.398 -0.814 . . . . 3.6299999999999999 111.026 170.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -74.94 -27.95 60.4 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 119.869 -1.769 . . . . 4.6100000000000003 113.72 173.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.8 -50.66 61.93 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.373 1.069 . . . . 1.5600000000000001 110.8 169.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 48.0 mt -56.83 -39.73 74.75 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.282 1.433 . . . . 2.46 111.898 169.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 88.0 m -62.39 -43.27 99.22 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 117.918 -1.039 . . . . 2.5499999999999998 111.033 173.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 62.0 m -57.74 -47.85 81.29 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.583 1.083 . . . . 2.0899999999999999 109.896 173.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 61.9 mtp -59.2 -43.41 92.22 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.086 1.354 . . . . 3.29 112.826 175.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 32.2 t -64.76 -32.59 58.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 O-C-N 121.009 -1.057 . . . . 2.8900000000000001 112.045 173.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 89.3 m -74.49 -45.23 47.37 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.336 1.455 . . . . 1.77 112.16 -178.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 22.4 p -70.64 -37.86 73.8 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.293 0.637 . . . . 2.1800000000000002 109.536 173.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -62.66 -66.59 0.52 Allowed 'General case' 0 C--O 1.219 -0.53 0 CA-C-O 117.383 -1.294 . . . . 3.2200000000000002 109.864 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -59.06 -29.5 67.36 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 121.544 1.975 . . . . 2.46 112.653 -173.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -62.17 -56.52 17.9 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.976 -1.078 . . . . 4.1299999999999999 113.455 173.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -81.24 -34.15 32.32 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.422 -0.799 . . . . 3.5299999999999998 112.979 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.5 t -64.76 -20.61 66.45 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 127.535 2.334 . . . . 2.5899999999999999 112.032 174.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.32 -5.44 79.56 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 127.307 2.384 . . . . 1.8600000000000001 116.133 170.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.52 -4.53 50.89 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-N 119.709 1.754 . . . . 3.9900000000000002 114.596 -163.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -165.35 161.6 19.11 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.393 1.477 . . . . 3.6699999999999999 111.843 174.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.13 -131.42 52.04 Favored Glycine 0 N--CA 1.472 1.082 0 O-C-N 120.985 -1.072 . . . . 2.7799999999999998 111.027 173.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 18.9 m -80.88 159.02 25.13 Favored 'General case' 0 CA--C 1.546 0.793 0 O-C-N 121.699 -0.883 . . . . 4.2000000000000002 111.184 166.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -93.35 -3.3 53.64 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 116.557 2.058 . . . . 6.7300000000000004 116.557 -167.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 22.9 tp -112.28 16.21 20.1 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.503 1.521 . . . . 4.29 110.625 178.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 23.3 p -148.78 133.1 17.48 Favored 'General case' 0 C--O 1.242 0.702 0 C-N-CA 127.029 2.132 . . . . 1.78 109.545 -161.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 5.7 mt -98.57 96.23 7.82 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.058 1.343 . . . . 2.7999999999999998 112.539 179.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 14.9 t -43.25 152.92 0.11 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.867 2.067 . . . . 2.8900000000000001 112.764 160.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.7 ttp85 -43.13 -27.96 0.25 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.779 1.632 . . . . 3.8599999999999999 113.323 171.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.6 -45.21 11.26 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.577 1.325 . . . . 4.9299999999999997 114.577 172.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -58.73 -38.22 77.87 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.686 1.194 . . . . 1.8999999999999999 111.47 174.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 29.4 tp -72.15 -44.57 62.89 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.862 1.265 . . . . 3.0 110.603 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.3 ttmm -67.58 -36.28 80.6 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 120.707 -1.246 . . . . 3.9300000000000002 112.396 -179.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -52.2 -68.01 0.2 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.578 1.551 . . . . 3.4100000000000001 111.619 157.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 tt -52.23 -49.41 64.03 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.67 1.188 . . . . 2.7799999999999998 112.875 -174.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 48.4 mt -58.62 -51.33 73.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 108.461 -0.94 . . . . 1.95 108.461 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -72.14 -9.11 57.98 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 112.841 0.682 . . . . 4.3600000000000003 112.841 -175.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -91.28 -37.22 13.42 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.707 1.603 . . . . 4.3499999999999996 113.664 168.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -88.89 -27.24 21.13 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.219 1.408 . . . . 3.9399999999999999 113.885 -175.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -117.46 108.26 15.32 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.588 1.155 . . . . 3.0600000000000001 110.631 -174.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 8.0 t -79.23 3.92 16.49 Favored 'General case' 0 CA--C 1.555 1.15 0 N-CA-C 115.064 1.505 . . . . 3.6000000000000001 115.064 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -61.88 -42.83 99.53 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.83 2.052 . . . . 3.5600000000000001 115.439 -161.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.23 -23.79 34.13 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 124.672 1.13 . . . . 4.0700000000000003 114.49 -178.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . 0.476 ' CD ' ' HZ3' ' B' ' 48' ' ' LYS . 46.4 mm-40 -86.97 9.44 19.45 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 118.743 1.272 . . . . 5.1299999999999999 113.711 167.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.76 57.91 2.66 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 123.896 1.807 . . . . 2.9199999999999999 111.096 165.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.476 ' HZ3' ' CD ' ' B' ' 46' ' ' GLU . 59.6 mttp -89.56 161.47 16.17 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.733 2.413 . . . . 4.4800000000000004 112.334 -177.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -53.2 -53.17 54.61 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 115.902 1.816 . . . . 3.27 115.902 -166.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 5.2 m -73.01 -28.26 62.26 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 119.767 1.167 . . . . 3.27 114.002 178.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 1.2 t -61.72 -42.05 98.44 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.312 0.645 . . . . 3.2200000000000002 109.779 169.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 47.7 mt -73.82 -35.06 42.06 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.191 0 C-N-CA 124.353 1.061 . . . . 2.2799999999999998 112.61 176.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.66 -35.67 72.99 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.197 0.908 . . . . 2.8100000000000001 111.408 178.005 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -69.47 -46.47 66.58 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 119.199 0.909 . . . . 2.5099999999999998 111.425 167.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 51.7 tp -55.88 -49.36 73.58 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.151 0.98 . . . . 2.9300000000000002 110.628 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.22 -57.8 9.24 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.662 1.185 . . . . 2.4900000000000002 110.12 172.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -25.76 44.87 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.836 1.254 . . . . 4.1600000000000001 113.83 176.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 13.8 m -88.67 -27.42 21.28 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.639 1.976 . . . . 3.0800000000000001 113.028 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 66.6 mt -78.72 -39.25 36.9 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 125.705 1.602 . . . . 3.1099999999999999 111.096 174.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -76.27 73.1 3.07 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.872 2.069 . . . . 1.6899999999999999 112.808 -171.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.36 -30.71 0.88 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 125.927 1.691 . . . . 3.9900000000000002 114.614 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -112.95 -4.28 13.94 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.779 2.431 . . . . 2.3100000000000001 114.083 -168.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 8.5 t 65.31 14.94 9.75 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 115.322 1.601 . . . . 3.3199999999999998 115.322 173.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -79.74 -15.83 56.76 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.335 1.454 . . . . 2.3900000000000001 111.651 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 68.0 14.44 9.35 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 128.841 2.857 . . . . 5.1699999999999999 114.371 174.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -101.21 153.36 19.68 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-O 124.169 1.938 . . . . 2.7599999999999998 110.61 141.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 29.9 mm -99.62 101.41 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 127.477 2.311 . . . . 2.3500000000000001 108.296 171.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.82 162.52 3.14 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.404 1.482 . . . . 2.5099999999999998 112.143 162.753 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.61 -36.76 67.3 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.05 -1.031 . . . . 3.4300000000000002 113.083 -177.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -80.2 -17.66 51.73 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 120.939 -1.101 . . . . 4.2800000000000002 112.26 178.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -73.92 -44.94 53.46 Favored 'General case' 0 CA--C 1.552 1.046 0 O-C-N 121.156 -0.965 . . . . 1.8 109.233 163.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -62.88 -30.98 71.93 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.871 1.669 . . . . 3.1400000000000001 112.969 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 85.9 p -63.68 -24.39 67.76 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 119.973 -1.705 . . . . 2.3599999999999999 113.433 172.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 24.4 t -67.26 -36.13 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 CA-C-N 119.561 1.073 . . . . 2.5299999999999998 110.984 174.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -63.22 -53.13 57.97 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.836 0.854 . . . . 2.7200000000000002 110.916 173.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 83.7 mt -57.74 -36.54 72.22 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.217 1.007 . . . . 2.46 111.945 177.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 93.1 m -62.4 -54.06 45.83 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.894 1.278 . . . . 1.74 111.538 175.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.2 mtm -58.41 -39.42 79.68 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 118.164 0.438 . . . . 2.1800000000000002 111.662 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 94.3 mt -69.92 -45.25 67.95 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.669 -0.682 . . . . 2.6499999999999999 112.297 177.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 87.1 m -64.24 -32.46 74.06 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.672 1.124 . . . . 3.0299999999999998 113.205 176.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 52.6 mtp -71.24 -38.86 71.94 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.977 0.808 . . . . 2.9399999999999999 112.522 168.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.9 -36.78 75.68 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.084 1.311 . . . . 1.9199999999999999 112.955 -177.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -75.35 -26.15 58.34 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.787 -0.571 . . . . 3.8900000000000001 111.824 176.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -66.08 -42.99 88.63 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.793 0.837 . . . . 2.6200000000000001 112.267 166.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -71.17 -26.99 63.21 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.142 0.577 . . . . 3.7200000000000002 111.408 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -54.76 35.57 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.511 1.524 . . . . 3.29 112.266 162.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -59.48 -27.73 66.39 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.592 1.957 . . . . 3.1899999999999999 112.556 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 16.8 mt -72.38 -11.48 60.71 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 126.163 1.785 . . . . 2.5800000000000001 114.446 176.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -96.38 -3.93 42.8 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 113.625 0.972 . . . . 3.8999999999999999 113.625 170.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -117.43 -65.1 1.22 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.391 1.476 . . . . 3.1899999999999999 110.919 -178.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -87.37 40.47 0.93 Allowed 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 126.932 2.093 . . . . 4.7300000000000004 112.45 173.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp . . . . . 0 C--O 1.251 1.141 0 C-N-CA 129.558 3.143 . . . . 8.0199999999999996 116.493 -169.069 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 . . . . . 0 C--O 1.238 0.456 0 N-CA-C 112.372 0.508 . . . . 5.0499999999999998 112.372 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' THR . . . . . 0.443 ' HB ' ' H ' ' A' ' 5' ' ' LEU . 40.7 p -158.7 161.59 28.09 Favored Pre-proline 0 CA--C 1.534 0.338 0 C-N-CA 127.527 2.331 . . . . 3.1800000000000002 109.968 -176.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -70.74 -8.71 24.23 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.708 2.272 . . . . 2.0800000000000001 112.188 157.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.443 ' H ' ' HB ' ' A' ' 3' ' ' THR . 0.3 OUTLIER -73.32 -47.4 42.94 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.751 2.02 . . . . 3.6299999999999999 110.247 179.963 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.32 -40.61 71.37 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.066 0.848 . . . . 3.3399999999999999 111.199 167.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.9 mtpt -67.87 -28.15 67.29 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 119.829 -1.794 . . . . 6.6500000000000004 114.113 173.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.83 -50.6 19.67 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.471 1.108 . . . . 2.2200000000000002 110.653 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.0 mt -56.04 -50.6 70.48 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.862 1.265 . . . . 2.9100000000000001 110.497 175.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 32.5 p -65.89 -39.65 90.85 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 116.845 -1.55 . . . . 3.4500000000000002 112.398 178.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 50.0 m -57.55 -45.75 84.75 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 120.603 1.547 . . . . 2.4399999999999999 109.949 172.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 12.8 ttp -66.85 -45.11 79.21 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.444 1.098 . . . . 3.8100000000000001 112.126 -175.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -60.13 -41.62 87.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 124.799 1.24 . . . . 3.3799999999999999 112.023 171.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 90.4 m -61.43 -52.05 66.17 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.218 1.007 . . . . 2.3199999999999998 111.333 177.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.46 -36.93 67.1 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 119.148 -0.453 . . . . 2.8599999999999999 111.302 170.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -64.02 -37.51 87.7 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 120.81 -0.356 . . . . 3.0600000000000001 111.708 -177.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.3 m-70 -62.29 -50.26 72.37 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.098 0.863 . . . . 5.0999999999999996 111.718 170.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.75 -38.65 85.93 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.423 0.689 . . . . 7.8099999999999996 112.842 -176.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -76.58 -43.87 36.94 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.79 0.836 . . . . 4.5199999999999996 111.303 172.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.0 t -64.43 -38.73 92.06 Favored 'General case' 0 C--O 1.241 0.635 0 O-C-N 119.936 -1.727 . . . . 2.6899999999999999 113.244 -176.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.36 3.59 86.49 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 126.178 1.847 . . . . 1.76 115.325 -175.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.09 -43.23 61.03 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.464 1.505 . . . . 6.0999999999999996 113.958 175.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 178.29 -138.3 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 129.28 3.032 . . . . 3.77 107.116 -173.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -11.6 99.06 0.01 OUTLIER Glycine 0 N--CA 1.475 1.263 0 C-N-CA 127.939 2.685 . . . . 3.7599999999999998 114.284 -174.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.2 t 57.4 163.4 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 116.357 1.984 . . . . 3.1099999999999999 116.357 175.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -137.68 134.71 35.72 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.429 1.891 . . . . 5.8099999999999996 110.532 -171.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 92.9 mt 92.34 -9.08 0.2 Allowed 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 130.135 3.374 . . . . 4.2599999999999998 111.042 -158.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.1 p -132.49 152.16 51.64 Favored 'General case' 0 C--O 1.249 1.035 0 C-N-CA 127.68 2.392 . . . . 2.5699999999999998 114.021 -176.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 10.8 mt -104.62 103.63 13.32 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.163 1.385 . . . . 3.0 109.638 172.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.4 t -72.88 150.92 42.22 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 120.395 -1.441 . . . . 3.02 111.017 168.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -40.61 -45.31 2.3 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 116.444 2.016 . . . . 4.0300000000000002 116.444 -165.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.45 -31.45 69.77 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.178 -1.576 . . . . 4.8499999999999996 114.022 177.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -68.52 -47.07 67.9 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.441 1.897 . . . . 2.0299999999999998 109.812 173.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.1 tp -59.8 -37.85 80.28 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.148 0.579 . . . . 2.8799999999999999 111.117 175.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.1 ttmt -68.33 -42.63 79.03 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 121.654 -0.654 . . . . 3.9900000000000002 111.845 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -51.24 -44.0 61.61 Favored 'General case' 0 CA--C 1.55 0.956 0 CA-C-N 118.405 0.548 . . . . 5.4100000000000001 112.244 164.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.2 tt -63.23 -64.1 1.0 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.013 0.925 . . . . 2.96 111.324 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.3 mt -56.94 -50.08 77.01 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 N-CA-C 108.851 -0.796 . . . . 1.74 108.851 -175.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.3 tttt -66.22 -13.17 59.89 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 119.708 1.14 . . . . 4.75 113.941 -176.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -95.88 -32.89 12.43 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 117.914 -1.041 . . . . 3.9700000000000002 113.809 168.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -80.82 -46.82 14.75 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.963 1.705 . . . . 4.2999999999999998 111.554 -178.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 26.6 mt -147.44 80.8 1.51 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.157 1.783 . . . . 3.9300000000000002 110.409 -177.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 43.9 t -91.84 -51.01 5.43 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 120.398 -1.439 . . . . 5.54 111.969 169.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.6 mp 52.53 -143.6 0.69 Allowed 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.94 1.296 . . . . 4.5999999999999996 108.17 -165.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -95.64 10.8 68.72 Favored Glycine 0 CA--C 1.533 1.199 0 O-C-N 121.263 -0.898 . . . . 4.5599999999999996 112.312 157.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -107.32 -55.52 2.33 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 118.166 0.983 . . . . 5.5800000000000001 112.812 -157.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 42.7 tpp -76.59 88.01 3.29 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.337 1.455 . . . . 2.73 110.733 -171.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.8 mttp -87.11 166.97 14.6 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.569 1.548 . . . . 4.5599999999999996 112.737 -175.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -47.61 -53.17 15.49 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 115.593 1.701 . . . . 4.3700000000000001 115.593 -169.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.3 m -73.98 -26.58 60.54 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.139 0.792 . . . . 4.2800000000000002 113.139 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.8 m -71.27 -29.79 65.5 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 118.819 0.736 . . . . 3.1099999999999999 110.829 174.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.4 mt -68.55 -47.78 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.214 1.005 . . . . 2.3100000000000001 110.676 169.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -71.03 -30.92 67.26 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 112.787 0.662 . . . . 4.0499999999999998 112.787 -176.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.506 ' CG ' ' HZ3' ' A' ' 57' ' ' LYS . 13.4 t70 -73.9 -37.75 64.57 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.355 -0.841 . . . . 3.1200000000000001 112.229 170.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 64.8 tp -60.84 -40.32 92.37 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-O 117.738 -1.125 . . . . 3.1699999999999999 111.109 169.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -57.31 -51.51 69.08 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 120.278 1.399 . . . . 2.5699999999999998 110.213 176.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.506 ' HZ3' ' CG ' ' A' ' 54' ' ' ASP . 1.5 tttm -50.66 -30.39 13.44 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.228 1.411 . . . . 4.0599999999999996 113.673 168.055 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.35 -32.36 22.49 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.515 1.126 . . . . 2.5699999999999998 112.205 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.7 mt -67.27 -41.54 85.35 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.091 0.956 . . . . 3.4399999999999999 110.622 173.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -94.47 80.02 3.88 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.93 2.092 . . . . 1.6399999999999999 113.297 -167.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -58.77 -21.6 56.16 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 115.044 1.498 . . . . 4.4299999999999997 115.044 -166.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -106.69 -5.73 18.38 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.201 1.4 . . . . 2.9100000000000001 114.374 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.5 t 58.61 31.16 20.79 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.915 1.286 . . . . 3.3199999999999998 114.215 -175.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.6 p30 -69.68 -14.64 62.91 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.578 1.151 . . . . 2.6000000000000001 111.791 175.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 68.02 8.5 6.54 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 129.861 3.264 . . . . 5.3399999999999999 114.39 -178.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -112.56 120.13 40.52 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 127.092 2.157 . . . . 3.1299999999999999 107.554 172.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 15.4 mm -90.23 101.28 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 123.466 0.707 . . . . 2.3399999999999999 109.256 174.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -48.35 155.42 0.51 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.24 1.016 . . . . 3.5899999999999999 111.955 161.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.434 ' CZ ' ' HB3' ' B' ' 80' ' ' CYS . 0.1 OUTLIER -51.43 -41.85 61.11 Favored 'General case' 0 CA--C 1.548 0.865 0 O-C-N 120.634 -1.291 . . . . 4.6399999999999997 110.982 158.122 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.8 pttm -66.86 -21.08 66.02 Favored 'General case' 0 CA--C 1.552 1.023 0 O-C-N 120.035 -1.666 . . . . 4.6299999999999999 114.781 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -85.39 -48.78 8.69 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.147 1.379 . . . . 2.2799999999999998 110.834 170.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -55.89 -33.8 64.96 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 126.029 1.732 . . . . 3.2000000000000002 112.43 174.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.3 t -58.94 -29.1 66.87 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.542 -1.349 . . . . 2.6600000000000001 113.333 170.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 19.2 t -69.34 -36.86 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 O-C-N 120.563 -1.335 . . . . 3.04 110.407 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -63.32 -51.72 64.87 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.525 1.13 . . . . 4.0300000000000002 111.722 169.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 65.9 mt -58.01 -33.77 69.31 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 118.512 0.596 . . . . 2.9100000000000001 112.388 176.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 50.0 m -62.41 -54.73 35.95 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.642 1.177 . . . . 2.04 110.344 171.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 45.6 mtp -53.27 -45.99 69.08 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.401 1.08 . . . . 2.96 112.028 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.8 mt -66.83 -48.83 67.68 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 123.898 0.879 . . . . 2.3999999999999999 112.211 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 9.0 t -66.76 -34.4 77.74 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.695 -0.628 . . . . 2.3500000000000001 112.406 -178.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 89.9 mtp -64.61 -39.1 93.11 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.289 0.636 . . . . 2.2200000000000002 112.258 168.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.32 -34.68 78.52 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.669 1.122 . . . . 1.5700000000000001 112.743 177.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -63.42 -23.18 67.29 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 113.357 0.873 . . . . 4.0199999999999996 113.357 170.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.65 -40.45 88.69 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 119.923 1.238 . . . . 3.1000000000000001 112.472 170.081 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -71.58 -39.24 70.71 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.681 0.792 . . . . 3.1400000000000001 110.825 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.2 -43.35 67.12 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.25 1.42 . . . . 2.98 112.287 170.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -67.76 -27.46 66.79 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.234 1.414 . . . . 3.8999999999999999 112.971 177.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.3 mt -74.31 -15.49 60.96 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 113.454 0.909 . . . . 3.0499999999999998 113.454 172.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -95.07 -4.84 45.64 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.873 1.269 . . . . 4.5300000000000002 114.394 173.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 20.7 t70 . . . . . 0 N--CA 1.468 0.47 0 C-N-CA 125.131 1.372 . . . . 3.77 111.805 175.783 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 74.2 p . . . . . 0 N--CA 1.466 0.37 0 N-CA-C 111.601 0.223 . . . . 3.1200000000000001 111.601 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.46 -21.95 69.9 Favored 'Trans proline' 0 CA--C 1.537 0.65 0 C-N-CA 121.987 1.791 . . . . 1.5900000000000001 113.235 170.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -83.89 -42.35 16.46 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.757 1.162 . . . . 4.2599999999999998 112.417 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -59.81 -43.18 94.63 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 118.918 0.781 . . . . 4.1799999999999997 110.214 168.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -62.76 -39.29 93.71 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 120.855 -1.153 . . . . 4.8499999999999996 112.471 171.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.97 -52.68 62.06 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.44 1.018 . . . . 1.8 111.23 176.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 37.6 mt -57.38 -39.04 75.22 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.785 1.234 . . . . 2.5499999999999998 112.231 176.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 94.8 m -61.75 -51.98 66.1 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.451 0.7 . . . . 2.4199999999999999 110.793 171.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 86.5 m -55.54 -36.22 66.53 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.396 1.478 . . . . 2.3799999999999999 112.28 -179.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 75.1 mmm -55.63 -51.98 65.37 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 122.926 0.49 . . . . 4.0999999999999996 111.943 170.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.17 -26.07 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.158 0.89 . . . . 3.3999999999999999 112.842 -178.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 25.4 m -56.67 -56.49 20.75 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.078 1.351 . . . . 1.97 110.844 169.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.98 -35.94 77.29 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 118.08 -0.962 . . . . 3.27 109.482 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -59.73 -49.25 78.45 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 118.448 -0.787 . . . . 3.6099999999999999 111.972 177.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 15.8 m80 -56.82 -48.69 77.44 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 120.012 1.278 . . . . 2.71 111.544 173.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -26.62 65.93 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 124.144 0.978 . . . . 6.8300000000000001 113.082 178.216 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -87.96 -30.24 20.18 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.6 -1.313 . . . . 4.7300000000000004 113.281 168.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 42.2 p -87.24 -36.99 17.63 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 120.914 1.688 . . . . 2.0600000000000001 114.678 -162.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.45 3.15 85.85 Favored Glycine 0 CA--C 1.533 1.166 0 O-C-N 119.714 -1.866 . . . . 1.55 112.922 169.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -43.23 91.68 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 119.042 1.421 . . . . 5.7300000000000004 111.81 -172.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -138.27 157.78 45.59 Favored 'General case' 0 C--O 1.249 1.073 0 C-N-CA 127.237 2.215 . . . . 4.5599999999999996 111.153 173.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.88 7.1 10.92 Favored Glycine 0 CA--C 1.534 1.233 0 CA-C-N 114.703 -1.135 . . . . 2.7400000000000002 113.25 -167.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 53.9 m 48.1 -145.51 0.32 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.044 1.737 . . . . 7.96 111.464 -161.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 32.3 mtpt 71.53 -163.94 0.13 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 127.324 2.25 . . . . 12.16 111.938 169.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 5.4 mp -106.68 14.07 27.34 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.655 1.582 . . . . 5.6299999999999999 111.63 168.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 74.7 p -108.72 149.44 29.0 Favored 'General case' 0 C--O 1.248 1.023 0 C-N-CA 126.223 1.809 . . . . 2.3700000000000001 113.402 -174.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -115.13 90.62 3.38 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.712 2.405 . . . . 3.0899999999999999 109.45 -157.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.2 m -81.53 160.58 23.86 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.324 1.45 . . . . 2.8500000000000001 113.304 -173.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -40.44 -41.26 1.37 Allowed 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 116.41 2.004 . . . . 4.2300000000000004 116.41 -175.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? -78.63 -43.04 27.22 Favored 'General case' 0 CA--C 1.546 0.827 0 O-C-N 119.971 -1.706 . . . . 7.1900000000000004 112.034 175.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -53.7 -44.16 69.56 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.364 0.983 . . . . 1.72 109.6 172.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.43 -49.33 77.27 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.889 2.076 . . . . 3.27 112.029 176.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -52.39 -47.1 66.42 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 121.093 -1.005 . . . . 3.4700000000000002 111.795 169.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -68.67 -24.21 64.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.108 1.763 . . . . 3.4199999999999999 114.381 177.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.5 tt -71.58 -59.32 2.82 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.001 1.32 . . . . 3.2200000000000002 108.912 172.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 78.8 mt -53.76 -58.71 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.386 0.674 . . . . 2.54 110.419 -176.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -9.15 8.56 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 114.07 1.137 . . . . 6.0499999999999998 114.07 -172.595 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.29 -40.79 3.59 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 125.942 1.697 . . . . 6.9900000000000002 110.836 -177.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -68.04 -49.9 58.58 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.187 1.358 . . . . 3.9199999999999999 110.839 176.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -115.21 178.24 4.36 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.979 2.512 . . . . 3.9300000000000002 111.93 -171.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.1 m -138.55 -43.35 0.49 Allowed 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 114.774 1.398 . . . . 4.4800000000000004 114.774 165.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 7.4 mp 50.92 -112.73 0.65 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.626 1.571 . . . . 6.6399999999999997 111.759 -176.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -157.99 -58.12 0.01 OUTLIER Glycine 0 N--CA 1.471 1.023 0 CA-C-N 119.067 0.848 . . . . 4.6699999999999999 113.934 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.71 -23.43 66.11 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 117.45 0.625 . . . . 6.7300000000000004 112.018 174.279 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 2.0 ttm -58.5 104.88 0.24 Allowed 'General case' 0 C--N 1.338 0.105 0 C-N-CA 124.988 1.315 . . . . 3.3399999999999999 113.538 -157.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -163.62 176.7 9.4 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 128.122 2.569 . . . . 5.0999999999999996 109.532 -171.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 33.7 tp10 -39.35 -58.9 1.14 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.912 1.685 . . . . 4.8399999999999999 113.639 -171.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 3.7 m -74.18 -4.88 38.55 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 116.439 2.014 . . . . 3.0 116.439 -176.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 97.6 p -102.21 -28.72 12.13 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 120.979 1.718 . . . . 3.0299999999999998 112.5 161.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 54.0 mt -69.5 -39.77 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.645 1.578 . . . . 2.8599999999999999 112.826 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -72.33 -37.4 68.9 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.637 0.653 . . . . 2.9300000000000002 112.546 -177.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.403 ' CG ' ' HZ1' ' B' ' 57' ' ' LYS . 11.6 t70 -67.92 -45.39 74.5 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.42 -0.8 . . . . 2.96 111.315 169.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 4.7 tt -51.86 -51.37 57.17 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 117.588 -1.196 . . . . 3.2400000000000002 110.211 176.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.6 ppp? -64.72 -44.83 88.95 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.128 0.876 . . . . 2.7599999999999998 112.021 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . 0.403 ' HZ1' ' CG ' ' B' ' 54' ' ' ASP . 0.7 OUTLIER -58.54 -32.29 68.75 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.607 1.163 . . . . 4.7000000000000002 111.832 174.356 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 58.9 m -80.49 -16.92 53.14 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.969 1.307 . . . . 2.6000000000000001 113.663 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 17.7 mt -73.78 -40.32 63.53 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 119.124 0.874 . . . . 3.2000000000000002 110.442 165.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -76.32 149.27 37.07 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.696 1.199 . . . . 2.1499999999999999 114.2 -176.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.77 -2.73 9.28 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.756 1.222 . . . . 3.7200000000000002 112.997 171.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -103.86 -27.47 12.18 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.547 1.314 . . . . 3.0899999999999999 114.547 -168.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 16.4 t 69.5 30.62 4.0 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.246 1.819 . . . . 3.9100000000000001 111.9 -158.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 42.5 p30 -91.21 -24.92 19.75 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.376 1.071 . . . . 2.4100000000000001 112.629 -172.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 63.38 16.8 9.81 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 129.24 3.016 . . . . 5.9900000000000002 113.697 -171.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -116.8 122.23 43.84 Favored 'General case' 0 C--O 1.24 0.565 0 C-N-CA 129.173 2.989 . . . . 2.6800000000000002 108.826 176.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 25.1 mm -101.37 87.87 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 125.779 1.632 . . . . 2.2999999999999998 109.169 -177.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -62.55 165.98 5.74 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.986 0.914 . . . . 4.1500000000000004 111.442 171.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.71 -34.15 37.54 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 120.563 -1.336 . . . . 3.46 113.262 -177.443 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -73.66 -17.5 61.14 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.486 1.514 . . . . 6.0999999999999996 114.825 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -93.03 -44.17 8.54 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.38 1.872 . . . . 1.8600000000000001 108.896 169.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -54.07 -36.97 63.7 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.409 1.484 . . . . 3.1699999999999999 113.152 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 90.8 p -68.7 -19.95 64.39 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 119.993 -1.692 . . . . 2.0800000000000001 114.243 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 46.9 t -61.61 -41.78 91.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 120.658 1.572 . . . . 2.5 109.724 172.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -61.4 -52.41 64.69 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.567 1.147 . . . . 2.7000000000000002 110.397 175.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 76.7 mt -58.22 -33.3 69.17 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.379 0.672 . . . . 2.1000000000000001 112.066 177.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 28.0 m -67.33 -51.91 46.69 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.401 1.08 . . . . 1.73 110.974 175.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 70.7 mtp -55.13 -44.37 74.99 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.539 1.136 . . . . 3.1899999999999999 111.312 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.91 -51.19 65.64 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.617 1.167 . . . . 4.0 111.639 178.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . 0.434 ' HB3' ' CZ ' ' A' ' 69' ' ' PHE . 86.2 m -70.48 -33.58 71.41 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 114.065 1.135 . . . . 3.04 114.065 -175.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 94.0 mtp -68.06 -41.34 82.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 118.934 0.788 . . . . 2.8199999999999998 111.256 171.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.98 -35.82 77.17 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 118.659 -0.686 . . . . 1.8999999999999999 112.78 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -76.84 -29.79 56.04 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.729 1.149 . . . . 4.2800000000000002 112.366 177.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -56.37 -47.67 78.4 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.213 0.915 . . . . 2.48 111.551 165.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -69.75 -35.38 74.92 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.183 0.993 . . . . 3.6200000000000001 112.01 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -60.67 -48.78 80.26 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.438 1.495 . . . . 4.4000000000000004 111.722 173.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -63.86 -34.95 79.09 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.049 0.94 . . . . 5.5199999999999996 111.214 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 83.4 mt -70.77 -11.72 61.12 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.658 0.985 . . . . 3.4900000000000002 113.658 175.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -99.06 -6.12 29.05 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.601 1.561 . . . . 3.6699999999999999 113.747 169.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -110.65 -42.74 3.98 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.061 1.745 . . . . 3.6800000000000002 112.552 -171.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -81.96 24.26 0.64 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.125 1.37 . . . . 3.8900000000000001 113.027 173.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 77.1 tttt . . . . . 0 C--O 1.254 1.306 0 C-N-CA 129.584 3.154 . . . . 5.25 115.78 -163.73 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 C--O 1.238 0.452 0 N-CA-C 105.835 -1.913 . . . . 4.2000000000000002 105.835 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 12.8 p -73.48 168.52 24.6 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 124.367 1.067 . . . . 3.73 112.03 -175.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -63.58 -29.23 70.11 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.756 1.637 . . . . 2.0600000000000001 112.946 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 42.7 tp -70.33 -39.66 74.6 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 118.555 0.616 . . . . 4.0599999999999996 111.111 174.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -65.43 -39.09 91.67 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.108 0.563 . . . . 3.8799999999999999 111.923 173.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.1 -43.25 95.71 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.211 -0.931 . . . . 4.1799999999999997 111.723 172.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.95 -51.95 67.5 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.403 1.081 . . . . 1.6299999999999999 112.738 175.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.5 pp -64.82 -28.47 69.59 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.387 0.994 . . . . 4.3099999999999996 113.195 175.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 90.7 m -58.73 -49.94 75.75 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 118.286 -0.864 . . . . 2.5800000000000001 109.853 167.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.4 m -57.43 -37.27 72.51 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 119.537 1.062 . . . . 2.2799999999999998 111.717 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 80.6 mmm -59.78 -58.27 9.29 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.778 0.831 . . . . 3.8500000000000001 111.541 174.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.2 m -66.94 -29.18 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 O-C-N 121.242 -0.911 . . . . 3.23 112.233 -176.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 52.4 m -61.55 -55.38 31.54 Favored 'General case' 0 CA--C 1.506 -0.742 0 C-N-CA 125.591 1.556 . . . . 1.8300000000000001 111.313 176.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -75.87 -35.34 59.91 Favored 'General case' 0 CA--C 1.522 -0.116 0 O-C-N 125.28 1.613 . . . . 3.3900000000000001 109.417 -176.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -57.24 -44.04 83.48 Favored 'General case' 0 C--O 1.226 -0.177 0 CA-C-O 118.504 -0.76 . . . . 3.7799999999999998 111.156 177.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -70.26 -35.71 73.95 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.127 1.33 . . . . 2.9100000000000001 112.594 175.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -70.65 -12.22 61.42 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.712 1.004 . . . . 7.1900000000000004 113.712 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.431 ' HH ' ' HG3' ' A' ' 40' ' ' LYS . 26.7 m-85 -107.58 -47.99 3.51 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.903 2.081 . . . . 3.1800000000000002 112.94 171.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.5 t -62.0 -29.74 70.47 Favored 'General case' 0 C--O 1.249 1.04 0 C-N-CA 126.554 1.941 . . . . 2.8700000000000001 113.553 176.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.56 -4.84 87.86 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 127.763 2.601 . . . . 1.3899999999999999 114.009 173.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -78.53 60.22 2.61 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.812 1.806 . . . . 7.54 110.365 171.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 51.86 -151.07 0.28 Allowed 'General case' 0 C--O 1.252 1.196 0 C-N-CA 126.154 1.782 . . . . 8.3699999999999992 112.803 -175.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.91 -151.59 8.53 Favored Glycine 0 CA--C 1.529 0.966 0 N-CA-C 109.659 -1.376 . . . . 2.4900000000000002 109.659 -145.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.5 m -69.3 161.19 29.8 Favored 'General case' 0 C--O 1.25 1.125 0 CA-C-O 123.338 1.542 . . . . 4.0599999999999996 111.032 155.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.1 mtmt -139.01 108.55 6.18 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.201 1.4 . . . . 8.7899999999999991 108.228 -160.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 43.4 mt 114.6 -17.74 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.482 1 C-N-CA 132.592 4.357 . . . . 4.2800000000000002 110.459 -154.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.3 p -121.62 161.97 21.49 Favored 'General case' 0 C--O 1.246 0.91 0 C-N-CA 127.177 2.191 . . . . 2.27 112.0 173.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 39.8 mt -104.95 117.45 34.04 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.73 1.212 . . . . 2.9300000000000002 110.1 170.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 13.0 t -80.61 160.29 25.13 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 118.28 0.491 . . . . 2.9900000000000002 111.0 160.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.72 -46.77 2.7 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 127.149 2.18 . . . . 4.4900000000000002 114.045 -169.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -76.01 -27.36 57.35 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 120.706 -1.246 . . . . 7.3399999999999999 112.718 -175.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -65.37 -57.27 8.78 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.733 1.213 . . . . 1.49 108.573 173.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.3 tp -56.39 -45.02 80.78 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.136 0.975 . . . . 3.3100000000000001 112.152 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -31.76 71.69 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.5 -0.75 . . . . 5.5800000000000001 112.846 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -82.33 -28.95 31.32 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.943 0.897 . . . . 4.0599999999999996 112.837 174.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.3 tt -73.34 -52.05 15.25 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.552 1.141 . . . . 3.3799999999999999 110.947 178.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.5 mt -50.88 -60.27 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-N 119.853 1.206 . . . . 1.8799999999999999 111.114 -175.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.273 0.0 OUTLIER -78.1 9.33 3.8 Favored 'General case' 0 CA--C 1.56 1.328 0 N-CA-C 114.197 1.184 . . . . 5.8399999999999999 114.197 -175.778 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.431 ' HG3' ' HH ' ' A' ' 19' ' ' TYR . 23.0 mmtm -106.53 -31.04 8.69 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 127.441 2.296 . . . . 3.3799999999999999 112.556 166.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -71.18 -56.74 5.45 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 126.371 1.868 . . . . 4.6200000000000001 108.463 173.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -102.69 125.36 49.4 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 127.863 2.465 . . . . 3.4700000000000002 108.248 172.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 30.4 m -107.07 26.14 10.5 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.455 1.102 . . . . 4.7300000000000004 112.693 176.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -147.44 172.72 13.5 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.716 1.206 . . . . 4.6299999999999999 113.352 -175.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.78 -178.96 53.5 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 124.787 1.184 . . . . 5.4500000000000002 112.919 -175.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.444 ' CD ' ' HZ1' ' A' ' 48' ' ' LYS . 27.4 tp10 -82.83 51.87 2.01 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.92 1.288 . . . . 6.5199999999999996 110.025 177.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.2 tpt -83.85 56.65 3.76 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 123.249 1.5 . . . . 2.4500000000000002 112.876 -168.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.444 ' HZ1' ' CD ' ' A' ' 46' ' ' GLU . 83.2 mttt -102.68 175.16 5.59 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.11 1.764 . . . . 5.3600000000000003 112.171 -173.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -58.26 -39.52 79.42 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.14 -0.975 . . . . 3.6200000000000001 113.412 -170.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -71.54 6.23 1.97 Allowed 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 114.571 1.323 . . . . 4.1299999999999999 114.571 175.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 29.7 t -121.75 -48.07 2.17 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.278 1.831 . . . . 3.2000000000000002 109.889 170.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 37.1 mt -54.1 -39.21 40.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.778 1.231 . . . . 2.1400000000000001 113.304 174.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.69 -54.07 37.37 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.778 0.717 . . . . 4.0099999999999998 111.695 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.96 -30.21 65.05 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.149 0.426 . . . . 2.9300000000000002 112.149 -176.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.8 tt -57.89 -51.61 68.89 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 116.895 -1.526 . . . . 3.1499999999999999 110.135 165.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.9 ttt -52.22 -48.94 64.85 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 120.98 1.718 . . . . 2.3599999999999999 112.176 174.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.0 mtpt -62.63 -27.23 69.07 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.515 0.726 . . . . 5.5800000000000001 112.676 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.5 m -89.0 -25.73 21.85 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.48 1.512 . . . . 3.1899999999999999 113.91 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 14.5 mt -63.56 -42.02 98.39 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.685 1.13 . . . . 3.1299999999999999 110.676 171.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -87.13 142.34 27.99 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 124.588 1.155 . . . . 1.8 113.509 -169.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.98 9.6 42.07 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.55 1.54 . . . . 3.9300000000000002 112.779 178.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -143.48 -25.65 0.58 Allowed 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 115.969 1.841 . . . . 2.8100000000000001 115.969 -164.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.6 m 56.45 34.31 24.04 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.432 1.493 . . . . 3.0699999999999998 112.88 -161.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -79.43 1.17 26.45 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.116 1.767 . . . . 2.1699999999999999 111.558 178.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 58.53 -13.43 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 129.475 3.11 . . . . 4.5700000000000003 116.569 -163.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -101.45 123.65 45.86 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-O 124.071 1.891 . . . . 2.7200000000000002 112.239 -176.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.6 mm -92.49 93.81 4.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 113.747 -1.57 . . . . 2.4500000000000002 109.013 171.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -53.15 147.22 10.16 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 127.283 2.233 . . . . 2.5 110.542 164.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -47.44 -37.19 11.11 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.58 1.152 . . . . 3.9300000000000002 113.079 178.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -69.56 -31.08 69.05 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.714 2.405 . . . . 3.5899999999999999 113.862 176.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -77.49 -47.66 19.06 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.595 1.158 . . . . 2.0899999999999999 109.06 170.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -55.05 -28.16 50.12 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.297 1.439 . . . . 3.0699999999999998 112.277 173.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 52.1 m -62.03 -26.93 68.53 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 119.882 -1.761 . . . . 3.1899999999999999 113.683 171.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 m -78.68 -28.94 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 CA-C-N 121.004 1.729 . . . . 3.77 112.831 175.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -59.97 -55.14 37.76 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.357 1.063 . . . . 2.8999999999999999 110.678 169.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.1 mt -56.06 -38.84 71.16 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.754 0.822 . . . . 2.8199999999999998 112.438 175.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 75.8 m -60.74 -55.53 32.12 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.495 1.118 . . . . 1.6799999999999999 111.562 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 16.3 ptp -61.07 -38.08 84.95 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.986 0.812 . . . . 3.1200000000000001 112.333 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 85.5 mt -64.74 -41.44 95.94 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.829 0.851 . . . . 2.75 113.047 175.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 40.4 t -71.7 -32.16 67.51 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.656 0.613 . . . . 2.2200000000000002 112.656 178.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 77.2 mtp -65.83 -43.27 89.07 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.284 0.475 . . . . 2.7000000000000002 112.284 167.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.22 -38.07 89.73 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.659 0.663 . . . . 1.9099999999999999 111.95 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -61.35 -20.56 63.13 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.18 1.178 . . . . 3.6699999999999999 114.18 174.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.25 -40.88 70.73 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 120.77 1.623 . . . . 3.7000000000000002 112.332 171.109 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -69.51 -45.12 69.64 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.872 1.269 . . . . 3.46 109.833 -177.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.68 -46.43 67.25 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.539 1.936 . . . . 4.1799999999999997 111.224 171.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -68.58 -27.28 65.92 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.252 1.021 . . . . 4.6699999999999999 113.645 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 58.5 mt -72.0 -8.26 53.48 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 120.759 -1.213 . . . . 3.48 113.51 175.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -98.56 0.23 44.54 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 114.73 1.382 . . . . 5.21 114.73 167.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 30.7 t70 . . . . . 0 N--CA 1.474 0.73 0 C-N-CA 125.148 1.379 . . . . 3.8599999999999999 111.466 165.967 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.479 0.991 0 CA-C-O 119.301 -0.381 . . . . 2.8700000000000001 110.536 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -63.17 -14.86 44.44 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.273 1.982 . . . . 2.25 112.446 173.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.01 -48.1 15.03 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.316 1.447 . . . . 3.7000000000000002 111.155 171.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -52.1 -42.21 63.06 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.494 1.043 . . . . 3.9199999999999999 110.753 167.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . 0.442 ' HA ' ' CE ' ' B' ' 7' ' ' LYS . 0.0 OUTLIER -71.77 -25.87 62.21 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 114.781 1.4 . . . . 5.9299999999999997 114.781 178.965 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.31 -51.57 59.75 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 117.685 -1.15 . . . . 1.74 111.439 165.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.2 mp -59.41 -40.64 87.33 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 121.05 1.75 . . . . 3.9300000000000002 111.898 173.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 40.3 m -53.78 -51.63 62.81 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.455 1.102 . . . . 2.3900000000000001 110.001 173.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 90.8 m -53.48 -37.43 62.69 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.516 1.126 . . . . 2.0600000000000001 112.638 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 11.5 mtp -61.49 -47.04 87.44 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.105 0.562 . . . . 4.7599999999999998 111.671 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 4.0 p -76.02 -32.4 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-O 118.438 -0.791 . . . . 3.6200000000000001 113.008 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 89.1 m -54.86 -56.72 16.43 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.171 1.35 . . . . 1.9199999999999999 110.547 175.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.43 -37.21 77.3 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.543 -0.753 . . . . 3.3599999999999999 109.705 -175.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -60.68 -52.93 63.05 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.626 0.77 . . . . 3.7799999999999998 112.673 175.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -66.23 -38.0 86.86 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.75 0.82 . . . . 2.5699999999999998 111.312 -178.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 3.7 ttpm? -56.19 -58.94 5.8 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.86 1.264 . . . . 6.3700000000000001 112.069 170.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -67.36 -25.91 66.21 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 121.259 -0.901 . . . . 3.0099999999999998 112.699 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 61.1 m -63.33 -10.08 14.78 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.839 1.051 . . . . 2.2000000000000002 113.839 171.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -88.11 -7.4 73.68 Favored Glycine 0 CA--C 1.536 1.399 0 CA-C-O 118.347 -1.252 . . . . 1.4299999999999999 115.216 170.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 7.0 mmt180 -70.26 -3.59 17.86 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 120.406 2.103 . . . . 4.6100000000000003 114.489 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -175.0 174.0 2.56 Favored 'General case' 0 C--O 1.247 0.94 0 C-N-CA 129.328 3.051 . . . . 3.6400000000000001 108.39 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -40.28 153.69 0.06 OUTLIER Glycine 0 N--CA 1.468 0.822 0 C-N-CA 126.469 1.985 . . . . 3.1699999999999999 114.459 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 35.6 m 63.76 124.53 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.245 1.418 . . . . 4.1699999999999999 111.753 -176.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 24.1 tttt -102.08 -4.19 26.34 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 114.05 1.13 . . . . 8.0399999999999991 114.05 -178.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -103.49 0.12 30.62 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.105 1.762 . . . . 4.6799999999999997 112.94 169.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 9.6 p -132.16 153.84 50.13 Favored 'General case' 0 C--O 1.249 1.052 0 C-N-CA 125.609 1.563 . . . . 1.9299999999999999 109.155 173.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -110.42 124.56 51.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.375 -1.284 . . . . 2.96 109.537 158.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 9.7 p -59.25 165.63 2.57 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.015 0.526 . . . . 2.9100000000000001 111.225 167.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . 0.423 HH21 ' C ' ' B' ' 52' ' ' ILE . 23.4 ttt180 -52.5 -29.74 26.63 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 120.562 -1.336 . . . . 6.6399999999999997 114.117 174.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 tmtt? -79.34 -36.36 39.56 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.716 -1.24 . . . . 5.9199999999999999 112.863 177.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -63.85 -53.79 45.14 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.589 0.709 . . . . 1.9099999999999999 109.512 169.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 20.2 tp -51.74 -41.21 61.39 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 128.058 2.543 . . . . 3.46 112.427 176.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 15.8 mttt -56.37 -46.85 79.84 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 121.079 -1.013 . . . . 3.8799999999999999 112.476 -178.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -60.91 -53.22 59.91 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 117.761 -1.114 . . . . 3.8300000000000001 111.718 173.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -51.98 -53.47 41.1 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.429 1.013 . . . . 3.5600000000000001 111.48 177.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 96.4 mt -60.35 -55.49 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-N 119.575 1.08 . . . . 2.23 109.12 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 25.6 ttpt -69.15 -15.19 63.35 Favored 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 113.281 0.845 . . . . 5.1699999999999999 113.281 -169.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 18.3 mmtp -85.77 -63.11 1.38 Allowed 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 127.49 2.316 . . . . 4.9699999999999998 112.402 170.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -75.41 -9.03 58.21 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.856 0.862 . . . . 4.8700000000000001 112.584 -171.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 89.6 mt -125.83 42.3 3.33 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.416 1.486 . . . . 4.54 110.727 165.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 19.5 p -68.13 11.59 0.15 Allowed 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 115.444 1.646 . . . . 4.0599999999999996 115.444 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -103.49 -6.3 21.94 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.005 1.722 . . . . 4.1600000000000001 113.843 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -131.87 -171.43 12.82 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 124.395 0.998 . . . . 3.4199999999999999 115.07 -170.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -74.65 53.78 0.58 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.213 1.805 . . . . 5.29 112.583 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.91 19.16 9.32 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.327 1.851 . . . . 3.3999999999999999 113.219 -179.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.0 ptmt -52.44 152.42 3.53 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.898 1.679 . . . . 4.9000000000000004 112.886 165.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -39.29 -54.77 1.8 Allowed 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 116.41 2.004 . . . . 3.8100000000000001 116.41 -163.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 8.7 m -67.53 -23.19 65.42 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 114.458 1.281 . . . . 4.0 114.458 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 8.2 t -65.79 -26.16 67.57 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 120.757 -1.214 . . . . 3.2000000000000002 111.125 169.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . 0.423 ' C ' HH21 ' B' ' 31' ' ' ARG . 74.7 mt -88.21 -8.75 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.988 1.315 . . . . 2.9300000000000002 111.449 175.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -72.94 -44.93 60.59 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.051 -1.031 . . . . 3.4300000000000002 109.03 160.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.548 ' HA ' ' HE3' ' B' ' 57' ' ' LYS . 9.9 t0 -71.17 -47.34 58.21 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.508 0.594 . . . . 3.3700000000000001 112.355 176.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -59.17 -39.74 83.45 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 118.169 -0.919 . . . . 3.9900000000000002 111.05 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 27.6 tpp -53.79 -65.11 0.62 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.866 0.866 . . . . 3.3500000000000001 109.26 169.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . 0.548 ' HE3' ' HA ' ' B' ' 54' ' ' ASP . 12.1 ttpp -48.16 -34.78 10.47 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.845 1.658 . . . . 5.1799999999999997 114.034 177.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 52.4 m -87.14 -30.57 20.96 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.312 1.045 . . . . 3.21 113.595 -174.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.1 pp -90.99 -36.27 14.18 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.211 -0.931 . . . . 3.8700000000000001 112.087 174.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . 0.433 ' O ' ' HE3' ' B' ' 61' ' ' LYS . 30.5 t70 -76.06 153.66 36.22 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.412 1.485 . . . . 2.7400000000000002 112.404 171.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . 0.433 ' HE3' ' O ' ' B' ' 60' ' ' ASP . 6.4 mmtp -130.36 15.35 5.56 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.401 1.26 . . . . 4.4000000000000004 114.401 -171.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -161.4 -3.42 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 117.028 2.233 . . . . 2.9300000000000002 117.028 -165.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 74.0 m 60.65 41.81 14.7 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.077 2.151 . . . . 3.8799999999999999 112.877 179.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 59.0 p30 -95.39 -17.98 21.11 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.495 1.518 . . . . 2.5699999999999998 112.76 -174.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 62.76 -12.31 0.08 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 129.85 3.26 . . . . 5.5800000000000001 115.806 -172.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -79.46 131.35 36.04 Favored 'General case' 0 C--O 1.249 1.07 0 CA-C-N 120.906 1.685 . . . . 3.8500000000000001 111.224 161.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 33.6 mm -107.09 94.18 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 115.131 -0.94 . . . . 2.2999999999999998 109.579 174.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -60.11 154.9 18.33 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.355 1.862 . . . . 2.96 112.262 168.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -46.55 -38.0 8.81 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.99 1.716 . . . . 3.9300000000000002 113.418 178.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -78.81 -38.22 38.79 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 120.648 -1.282 . . . . 3.8500000000000001 112.568 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -56.18 -52.56 63.93 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 119.237 0.926 . . . . 2.3399999999999999 108.749 168.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -52.09 -41.86 62.76 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.932 1.293 . . . . 4.0300000000000002 113.454 174.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.7 -24.61 65.41 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.681 -1.262 . . . . 2.6600000000000001 113.514 176.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 79.7 t -73.67 -35.52 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 119.148 0.885 . . . . 2.7000000000000002 110.666 172.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -59.98 -51.2 70.68 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.728 0.695 . . . . 2.7799999999999998 111.191 167.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 93.4 mt -58.87 -36.18 74.2 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 118.865 -0.588 . . . . 2.2799999999999998 112.329 176.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 95.1 m -59.88 -47.4 85.91 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.313 1.045 . . . . 1.8300000000000001 111.109 173.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 57.4 mtm -58.17 -42.74 86.68 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.467 1.03 . . . . 2.4399999999999999 112.437 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 70.6 mt -65.6 -48.41 72.4 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.191 0.596 . . . . 2.5 112.182 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 69.0 m -59.55 -43.14 93.63 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.284 0.634 . . . . 2.8399999999999999 111.839 176.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 23.8 mtp -64.97 -34.94 79.62 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.253 0.933 . . . . 3.1200000000000001 112.577 175.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.9 -45.51 77.74 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.808 0.731 . . . . 1.6599999999999999 112.154 176.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -67.65 -25.26 65.63 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.305 0.854 . . . . 3.8100000000000001 113.305 175.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -66.0 -47.25 75.12 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 119.066 0.848 . . . . 2.3799999999999999 111.058 176.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -67.2 -37.77 84.22 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.591 1.156 . . . . 2.71 112.23 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.16 -48.98 77.38 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.811 1.244 . . . . 3.04 111.036 174.263 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -57.01 -33.03 66.75 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.07 0.948 . . . . 3.7200000000000002 113.008 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.86 -42.61 97.52 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.394 0.997 . . . . 4.6600000000000001 112.08 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . 0.586 ' CD ' ' HZ2' ' B' ' 92' ' ' LYS . 26.6 mm-40 -72.76 -32.25 65.51 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 114.777 1.399 . . . . 3.71 114.777 179.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 -75.22 -29.43 60.27 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.347 1.859 . . . . 4.3399999999999999 114.062 -177.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -105.83 10.1 32.67 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.362 1.065 . . . . 3.54 112.926 -172.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . 0.586 ' HZ2' ' CD ' ' B' ' 89' ' ' GLU . 3.3 ttpm? . . . . . 0 C--O 1.249 1.079 0 C-N-CA 129.584 3.154 . . . . 5.2000000000000002 116.69 -177.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 . . . . . 0 CA--C 1.549 0.905 0 N-CA-C 107.497 -1.298 . . . . 6.2199999999999998 107.497 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 35.3 p -70.94 166.88 33.37 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 126.441 1.896 . . . . 2.52 111.835 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -59.61 -25.02 77.58 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 121.961 1.774 . . . . 1.53 113.567 169.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tt -85.42 -38.07 19.09 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.521 1.055 . . . . 3.4199999999999999 112.272 178.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.2 tm-20 -54.34 -46.48 72.93 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.619 1.1 . . . . 4.7400000000000002 109.639 161.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.3 mtpt -64.91 -23.19 67.15 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 121.477 -0.765 . . . . 6.0499999999999998 111.991 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.06 -46.55 56.46 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.575 1.15 . . . . 2.0600000000000001 110.997 173.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -70.0 -39.61 75.78 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.793 1.237 . . . . 4.1399999999999997 112.942 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.3 m -58.88 -43.5 90.92 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.431 1.492 . . . . 2.98 110.793 168.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 53.5 m -60.32 -47.57 85.45 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.614 1.097 . . . . 2.1400000000000001 109.531 169.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.1 ttm -57.6 -49.61 75.85 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 117.316 -1.325 . . . . 3.9700000000000002 111.915 -175.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.9 p -69.68 -25.41 28.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 CA-C-N 119.992 1.269 . . . . 3.2599999999999998 112.978 174.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.8 m -66.58 -53.35 35.49 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 117.537 -1.221 . . . . 1.8400000000000001 110.104 174.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -53.48 -42.78 67.61 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.822 0.737 . . . . 3.2200000000000002 109.113 167.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -63.31 -44.03 96.13 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 119.588 -0.845 . . . . 4.0300000000000002 111.326 -170.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.3 m80 -73.19 -34.8 66.18 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 115.03 1.493 . . . . 2.4700000000000002 115.03 171.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -67.86 -24.74 65.28 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.632 1.106 . . . . 5.7000000000000002 113.301 175.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.401 ' CE2' ' HA ' ' A' ' 37' ' ' LEU . 38.8 m-85 -102.95 -42.66 5.75 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.769 1.628 . . . . 3.4900000000000002 113.048 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.0 m -67.58 -15.28 63.57 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 120.173 1.351 . . . . 2.9399999999999999 113.122 172.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.93 14.94 60.54 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 125.69 1.614 . . . . 1.8899999999999999 114.68 168.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.5 mmp_? -94.28 -3.16 51.08 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 119.627 1.714 . . . . 7.0999999999999996 113.465 176.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 177.23 176.1 0.38 Allowed 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 129.39 3.076 . . . . 4.5599999999999996 110.558 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.65 -147.55 36.31 Favored Glycine 0 N--CA 1.47 0.944 0 C-N-CA 126.0 1.762 . . . . 2.1899999999999999 113.595 167.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.9 t -66.68 155.95 36.59 Favored 'General case' 0 C--O 1.25 1.085 0 O-C-N 120.718 -1.46 . . . . 4.1299999999999999 110.751 163.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.7 pttp -65.8 -24.11 66.84 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.745 1.218 . . . . 7.79 112.165 169.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.3 tp -70.61 -52.54 20.74 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.192 1.397 . . . . 4.5099999999999998 109.339 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 65.4 p -96.12 155.97 16.53 Favored 'General case' 0 C--O 1.253 1.269 0 C-N-CA 124.719 1.208 . . . . 1.8500000000000001 112.948 -165.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -89.91 116.25 27.84 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 112.122 -2.308 . . . . 4.0999999999999996 108.827 153.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.4 p -75.47 170.44 16.11 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.163 0.585 . . . . 2.7799999999999998 110.751 158.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.37 -45.31 3.03 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 125.51 1.524 . . . . 4.6399999999999997 113.195 178.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? -70.07 -45.01 67.94 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 119.943 -1.723 . . . . 6.9199999999999999 113.102 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -61.07 -41.46 96.65 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.951 0.9 . . . . 1.5900000000000001 110.693 -176.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.52 -40.86 98.16 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.303 1.841 . . . . 3.6099999999999999 112.077 -179.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.6 ttmt -64.74 -43.08 94.5 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.028 -1.045 . . . . 4.2999999999999998 112.277 171.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -64.24 -36.25 83.46 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.848 0.859 . . . . 4.1600000000000001 111.738 176.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.401 ' HA ' ' CE2' ' A' ' 19' ' ' TYR . 58.1 tp -65.88 -69.59 0.29 Allowed 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 128.058 2.543 . . . . 3.6899999999999999 111.608 177.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.3 mt -56.81 -51.35 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 CA-C-N 119.641 1.109 . . . . 2.0899999999999999 110.32 -174.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -72.55 -4.35 30.09 Favored 'General case' 0 CA--C 1.555 1.156 0 O-C-N 121.279 -0.888 . . . . 4.8899999999999997 112.11 -173.458 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -96.56 -45.31 6.78 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-O 117.155 -1.402 . . . . 4.7699999999999996 112.715 159.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -51.81 -44.61 63.57 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 119.897 1.226 . . . . 4.2800000000000002 111.76 175.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.2 mt -139.19 66.5 1.41 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.632 2.773 . . . . 3.6000000000000001 108.798 -169.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.6 t -70.91 21.52 0.04 OUTLIER 'General case' 0 CA--C 1.559 1.304 0 O-C-N 120.534 -1.354 . . . . 4.4000000000000004 114.556 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -83.51 162.2 20.99 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 120.186 -1.571 . . . . 4.9000000000000004 113.169 -174.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.38 -0.68 24.31 Favored Glycine 0 N--CA 1.477 1.381 0 N-CA-C 116.451 1.34 . . . . 4.0599999999999996 116.451 -171.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -75.4 -32.09 60.63 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 118.599 1.199 . . . . 7.1699999999999999 110.971 166.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.53 151.41 27.76 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.597 1.159 . . . . 3.0800000000000001 111.083 174.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.88 176.83 0.52 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 130.413 3.485 . . . . 5.3099999999999996 108.639 178.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -55.58 -51.4 67.26 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 120.942 1.701 . . . . 6.2199999999999998 110.344 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.0 m -67.34 60.26 0.06 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.799 2.04 . . . . 3.8399999999999999 113.302 168.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.6 t 172.63 -54.53 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 129.311 3.045 . . . . 2.6699999999999999 108.877 -176.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 13.9 mm -61.72 -39.57 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.376 1.47 . . . . 2.7400000000000002 111.802 174.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -69.9 -26.63 64.26 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.276 0.843 . . . . 3.3300000000000001 113.276 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -85.63 -32.25 22.13 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.286 0.948 . . . . 2.1800000000000002 112.266 173.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.54 -43.67 76.04 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.4 0.68 . . . . 3.9399999999999999 109.941 163.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.7 tpt -54.33 -29.71 48.88 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 119.526 1.057 . . . . 2.54 113.374 173.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.0 mttm -83.49 -31.71 26.35 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.617 1.167 . . . . 6.0599999999999996 112.703 174.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 46.3 t -81.69 -32.94 31.49 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 126.217 1.807 . . . . 2.46 113.699 -177.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -68.59 -39.04 81.1 Favored 'General case' 0 C--N 1.334 -0.065 0 C-N-CA 126.223 1.809 . . . . 3.29 111.178 173.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -84.67 144.41 28.58 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.24 1.416 . . . . 2.2400000000000002 111.225 -176.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.7 ttmt -116.25 -27.75 6.75 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.256 1.206 . . . . 5.2800000000000002 114.256 -163.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -96.84 -67.42 0.85 Allowed 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.224 1.81 . . . . 3.0499999999999998 113.243 165.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 53.1 m 137.56 38.78 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.489 1 C-N-CA 133.071 4.548 . . . . 3.7599999999999998 110.71 -172.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.9 p30 -91.36 -15.8 28.44 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.205 -1.56 . . . . 2.3199999999999998 112.784 -177.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.4 5.49 1.18 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 128.324 2.65 . . . . 6.46 115.287 -168.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -102.12 129.39 48.46 Favored 'General case' 0 C--O 1.24 0.599 0 C-N-CA 125.188 1.395 . . . . 3.6800000000000002 110.929 164.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 10.7 mm -99.69 105.91 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 124.467 1.107 . . . . 2.2799999999999998 110.908 175.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -79.94 154.1 28.51 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.721 2.409 . . . . 3.2000000000000002 109.366 166.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.02 -39.18 62.98 Favored 'General case' 0 CA--C 1.547 0.833 0 O-C-N 120.172 -1.58 . . . . 3.6600000000000001 113.867 -178.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.3 pttm -71.51 -12.96 61.65 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.393 1.257 . . . . 3.8199999999999998 114.393 175.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 73.2 mt-10 -79.67 -63.37 1.43 Allowed 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 108.299 -1.0 . . . . 1.72 108.299 158.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -49.97 -33.44 17.79 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 126.915 2.086 . . . . 3.5 115.618 -171.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.2 t -58.14 -22.56 51.66 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.721 -1.237 . . . . 3.9399999999999999 112.597 176.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 5.5 p -58.23 -46.22 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 CA-C-N 119.108 0.867 . . . . 3.3199999999999998 111.137 173.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -70.27 -48.23 57.71 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 125.783 1.633 . . . . 4.1900000000000004 111.93 178.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.5 mt -53.85 -37.61 63.82 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 122.924 0.49 . . . . 3.02 111.384 175.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 42.8 m -68.21 -51.31 46.99 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.733 1.213 . . . . 2.27 111.751 173.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 40.1 mtm -54.88 -42.58 72.26 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.803 1.183 . . . . 2.9300000000000002 112.668 177.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.97 -47.53 82.77 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.403 0.681 . . . . 2.3300000000000001 111.653 174.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 88.4 m -62.72 -35.7 80.59 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.511 0.93 . . . . 2.77 113.511 175.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 58.9 mtp -62.25 -43.65 98.33 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 118.797 0.726 . . . . 3.3700000000000001 111.267 174.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.29 -41.26 85.72 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 122.844 0.458 . . . . 1.8400000000000001 111.522 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -72.3 -29.23 63.66 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.634 -0.666 . . . . 4.29 111.868 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -65.15 -44.22 89.28 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.292 0.951 . . . . 2.5499999999999998 111.753 171.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -61.01 -45.31 95.31 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.258 1.023 . . . . 2.6800000000000002 111.515 174.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -53.29 -48.24 68.52 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.56 1.544 . . . . 3.8399999999999999 111.991 176.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -61.8 -34.47 75.97 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.78 1.232 . . . . 3.7599999999999998 112.275 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 79.9 mt -72.33 -16.86 61.88 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.62 0.97 . . . . 2.3799999999999999 113.62 178.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -95.16 -11.66 27.77 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.336 1.236 . . . . 3.1099999999999999 114.336 172.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.7 t70 . . . . . 0 N--CA 1.471 0.617 0 C-N-CA 125.818 1.647 . . . . 2.8399999999999999 113.034 -168.886 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.7 p . . . . . 0 N--CA 1.47 0.545 0 CA-C-O 119.516 -0.278 . . . . 2.5499999999999998 111.238 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -67.91 -16.69 45.98 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 122.211 1.941 . . . . 1.5700000000000001 111.742 173.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.26 -46.65 27.02 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-O 118.143 -0.932 . . . . 3.2000000000000002 110.576 173.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -57.6 -48.13 80.26 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.708 1.14 . . . . 4.6600000000000001 109.612 172.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -62.5 -29.62 70.68 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.351 -0.843 . . . . 4.8300000000000001 112.978 178.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.04 -43.31 79.02 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.491 1.117 . . . . 1.8999999999999999 111.822 171.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 32.8 mt -66.3 -40.83 90.26 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 119.346 0.975 . . . . 3.0299999999999998 111.3 173.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 90.3 m -59.95 -42.51 94.21 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.993 1.317 . . . . 1.97 111.686 172.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 92.2 m -59.47 -43.77 93.18 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.139 0.976 . . . . 2.1400000000000001 110.654 171.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -59.99 -51.82 68.04 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.605 0.762 . . . . 4.4299999999999997 111.286 177.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 48.5 t -56.94 -31.6 36.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 125.078 1.351 . . . . 2.7400000000000002 113.15 175.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 33.3 m -65.47 -55.26 18.92 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.406 1.082 . . . . 1.6100000000000001 110.491 175.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.8 -39.58 71.51 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.347 0.659 . . . . 2.3199999999999998 110.9 170.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -59.91 -53.84 53.11 Favored 'General case' 0 C--O 1.225 -0.196 0 O-C-N 123.778 0.674 . . . . 3.5499999999999998 109.285 -174.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 28.0 m80 -56.39 -49.25 75.01 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.598 -0.689 . . . . 3.0600000000000001 112.522 172.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.39 -26.44 67.84 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 114.13 1.159 . . . . 6.9400000000000004 114.13 -176.18 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -107.04 -32.42 7.86 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 120.438 -1.414 . . . . 3.6699999999999999 113.162 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 42.3 t -72.34 -38.22 68.67 Favored 'General case' 0 C--O 1.247 0.935 0 C-N-CA 125.191 1.396 . . . . 2.1899999999999999 113.167 176.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.69 2.86 81.63 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 125.58 1.562 . . . . 1.74 114.299 176.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -43.96 25.98 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.498 1.149 . . . . 4.1799999999999997 111.782 -171.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -159.97 -163.0 1.06 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.865 1.666 . . . . 3.9500000000000002 110.787 177.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 58.48 -135.94 51.48 Favored Glycine 0 N--CA 1.468 0.768 0 N-CA-C 109.301 -1.52 . . . . 3.1800000000000002 109.301 -171.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 5.3 t -82.84 162.08 21.74 Favored 'General case' 0 C--O 1.248 0.985 0 CA-C-O 124.4 2.048 . . . . 3.9500000000000002 112.105 152.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -91.65 143.31 26.69 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.543 1.537 . . . . 7.3300000000000001 108.674 171.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.3 tp 82.31 -15.04 0.72 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 128.174 2.59 . . . . 3.7400000000000002 112.868 -164.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 54.8 p -112.38 144.62 41.52 Favored 'General case' 0 C--O 1.246 0.874 0 C-N-CA 125.859 1.664 . . . . 2.0800000000000001 114.542 169.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 52.5 mt -94.11 101.41 13.43 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.069 2.148 . . . . 3.1800000000000002 109.514 167.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.2 t -71.59 162.0 30.13 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 120.69 -1.257 . . . . 2.6400000000000001 111.452 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 tmm_? -53.93 -14.28 0.97 Allowed 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 116.345 1.98 . . . . 6.2400000000000002 116.345 -174.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.01 -45.74 8.16 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.318 -1.488 . . . . 6.75 113.302 164.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -52.36 -45.62 65.82 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.488 1.115 . . . . 1.6399999999999999 109.893 175.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -61.15 -56.62 18.74 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.5 1.52 . . . . 3.48 111.924 -178.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -69.93 -27.45 64.78 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 119.933 -1.73 . . . . 4.4199999999999999 112.935 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -70.78 -26.02 63.15 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.992 0.738 . . . . 3.3399999999999999 112.992 169.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 34.5 tp -72.66 -58.16 3.57 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-O 117.339 -1.315 . . . . 3.1800000000000002 110.813 172.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 38.2 mt -53.03 -49.24 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 CA-C-N 119.864 1.211 . . . . 2.1099999999999999 110.423 -178.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 22.6 mtpp -64.45 -12.15 40.64 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.262 1.208 . . . . 5.2400000000000002 114.262 -175.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -109.12 -27.15 9.76 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.524 1.53 . . . . 4.3899999999999997 113.256 172.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -72.22 -38.84 68.88 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 127.878 2.471 . . . . 4.96 113.22 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 43.1 mt -147.56 79.78 1.49 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.505 1.522 . . . . 4.29 109.215 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 15.7 p -90.19 -16.48 29.38 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.397 1.258 . . . . 3.6600000000000001 114.397 -172.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -57.93 -2.24 0.15 Allowed 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 119.228 3.047 . . . . 4.5599999999999996 119.228 -170.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 163.65 161.98 13.78 Favored Glycine 0 N--CA 1.472 1.056 0 CA-C-N 120.562 1.528 . . . . 3.9199999999999999 114.45 174.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 73.97 -45.69 0.6 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 127.504 2.321 . . . . 5.96 113.534 172.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 33.4 tpp -78.12 71.68 4.6 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 124.19 1.948 . . . . 3.0800000000000001 115.41 -148.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -84.84 168.77 14.79 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.555 2.342 . . . . 5.6500000000000004 111.879 170.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -52.96 -48.42 67.39 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.688 0.795 . . . . 3.54 112.085 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 53.3 p -68.14 -4.2 12.97 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.495 1.665 . . . . 5.2000000000000002 115.495 178.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 16.4 m -97.73 -26.71 14.64 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.641 1.11 . . . . 3.5600000000000001 112.229 165.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 81.2 mt -82.09 -49.0 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 125.27 1.428 . . . . 3.0099999999999998 111.713 -177.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -75.82 -15.4 60.24 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.042 0.386 . . . . 4.04 112.042 -165.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -75.33 -41.95 55.55 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.436 0.695 . . . . 4.0300000000000002 112.021 160.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.34 -43.89 79.51 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.041 0.936 . . . . 4.25 110.621 172.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 9.7 tpt -56.87 -47.87 79.43 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.951 2.1 . . . . 2.3999999999999999 111.495 172.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.6 tmtt? -66.23 -24.91 66.69 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.409 1.084 . . . . 6.04 113.487 173.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.7 t -84.06 -41.2 17.43 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 120.695 -1.253 . . . . 3.2000000000000002 112.086 -178.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 14.1 mt -57.01 -59.55 4.9 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 127.395 2.278 . . . . 3.8599999999999999 111.155 164.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -85.64 56.29 3.89 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 123.139 1.447 . . . . 1.7 110.856 -171.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -58.05 -19.62 33.03 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.535 1.534 . . . . 7.4800000000000004 114.026 -169.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -95.55 -10.7 28.91 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 116.441 2.015 . . . . 2.4500000000000002 116.441 174.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 23.0 t 62.2 32.69 17.17 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.2 1.4 . . . . 3.3599999999999999 114.4 -178.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 46.2 p30 -73.56 -18.5 61.07 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 121.106 -0.996 . . . . 2.2000000000000002 111.388 172.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 78.63 6.64 2.35 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 131.572 3.949 . . . . 4.3499999999999996 115.918 179.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -131.21 140.43 49.88 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.865 1.666 . . . . 2.3500000000000001 111.278 175.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 28.7 mt -110.15 118.96 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 O-C-N 121.152 -0.967 . . . . 2.5 111.988 -173.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -93.6 164.3 13.22 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 127.136 2.174 . . . . 3.1800000000000002 111.032 165.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -49.06 -32.52 9.72 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.016 1.726 . . . . 3.48 115.142 -176.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.92 -45.95 69.53 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.121 -0.987 . . . . 4.5099999999999998 111.164 179.34 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -58.25 -48.95 78.81 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.66 1.184 . . . . 1.76 109.326 171.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -56.54 -24.51 47.33 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 114.785 1.402 . . . . 3.1800000000000002 114.785 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 29.3 t -55.86 -27.83 53.53 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 120.422 -1.424 . . . . 3.2999999999999998 114.003 170.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 89.5 t -64.45 -50.53 75.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-N 119.244 0.929 . . . . 2.3199999999999998 109.981 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -61.28 -45.58 93.9 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.107 0.963 . . . . 2.8100000000000001 111.853 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 87.9 mt -56.26 -41.93 76.57 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 122.966 0.506 . . . . 3.1400000000000001 112.014 174.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 39.0 m -62.05 -46.72 87.89 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.91 0.884 . . . . 2.0800000000000001 111.34 174.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 88.5 mtp -61.17 -42.55 98.77 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.002 0.819 . . . . 3.3500000000000001 112.324 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 79.4 mt -61.36 -54.1 48.04 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.511 0.724 . . . . 3.02 111.171 174.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 52.5 m -56.19 -40.95 74.76 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 114.048 1.129 . . . . 2.79 114.048 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 50.4 mtp -74.3 -31.06 62.34 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 118.666 -0.683 . . . . 3.4700000000000002 111.927 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.13 -36.46 72.1 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.73 0.696 . . . . 1.8700000000000001 111.411 172.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -65.23 -26.85 68.3 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 121.389 -0.82 . . . . 3.8199999999999998 112.784 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -61.53 -44.02 97.81 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 120.264 1.393 . . . . 3.1800000000000002 112.013 171.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -74.21 -35.16 63.9 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.92 0.888 . . . . 3.48 111.982 178.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -56.29 -45.9 79.99 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.829 1.251 . . . . 3.3999999999999999 111.094 170.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -63.38 -15.72 58.36 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.476 1.51 . . . . 3.3199999999999998 112.677 175.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 56.9 mt -98.92 -5.11 31.35 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.824 1.65 . . . . 3.29 114.216 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -84.38 -32.72 24.04 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.655 1.182 . . . . 4.6200000000000001 112.809 161.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -75.35 -47.35 28.06 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.954 1.302 . . . . 3.0099999999999998 112.936 -174.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -83.44 28.65 0.54 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 125.255 1.422 . . . . 3.48 113.627 -176.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 44.1 mttp . . . . . 0 C--O 1.251 1.184 0 CA-C-O 115.01 -2.424 . . . . 5.5800000000000001 115.145 173.321 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 . . . . . 0 C--O 1.241 0.606 0 N-CA-C 106.658 -1.608 . . . . 4.96 106.658 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 75.9 p -55.9 161.33 3.58 Favored Pre-proline 0 N--CA 1.475 0.807 0 C-N-CA 126.657 1.983 . . . . 2.7000000000000002 112.166 175.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.44 -14.84 47.0 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 122.07 1.847 . . . . 2.1400000000000001 113.258 173.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -80.32 -48.37 13.09 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.893 1.224 . . . . 4.1799999999999997 111.375 173.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -55.55 -37.17 67.63 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 121.854 0.835 . . . . 4.2800000000000002 110.432 168.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.84 -37.51 87.86 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.719 -1.238 . . . . 4.2199999999999998 113.149 170.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.6 -44.05 91.82 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.228 1.011 . . . . 2.5299999999999998 112.026 174.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.0 mt -63.83 -45.31 90.14 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.692 0.797 . . . . 3.2200000000000002 110.711 175.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 49.2 m -52.61 -53.47 46.31 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.22 1.408 . . . . 2.8700000000000001 111.514 170.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.3 t -69.99 -31.52 69.24 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 118.051 -0.976 . . . . 4.1600000000000001 112.123 -177.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 37.8 mtt -60.59 -44.77 95.88 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.193 0.997 . . . . 4.2699999999999996 112.092 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 33.6 m -75.27 -25.7 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 119.571 1.078 . . . . 3.8900000000000001 112.812 175.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.3 m -69.29 -50.2 48.94 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.385 1.474 . . . . 1.9199999999999999 111.555 177.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.4 p -60.53 -41.94 95.45 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.155 -0.684 . . . . 2.6600000000000001 109.155 172.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -65.0 -49.46 70.14 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 118.563 -0.732 . . . . 4.4800000000000004 111.236 -173.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.6 m80 -59.61 -43.96 93.59 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 120.301 1.409 . . . . 3.0499999999999998 113.276 172.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -63.45 -44.49 94.37 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.228 1.011 . . . . 4.5 112.712 -175.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -76.55 -43.59 38.45 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.978 0.911 . . . . 3.3999999999999999 112.343 172.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.7 t -62.94 -26.0 68.61 Favored 'General case' 0 C--O 1.242 0.669 0 N-CA-C 115.347 1.61 . . . . 2.7000000000000002 115.347 -163.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.37 2.85 75.6 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 125.053 1.311 . . . . 2.2599999999999998 114.913 173.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.61 63.95 7.82 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.18 1.49 . . . . 7.8499999999999996 108.167 169.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.439 ' CD ' ' HZ3' ' A' ' 32' ' ' LYS . 30.2 mt-10 78.71 -171.37 0.06 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.927 1.691 . . . . 4.1200000000000001 112.984 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.84 -149.66 29.32 Favored Glycine 0 C--N 1.341 0.833 0 N-CA-C 109.363 -1.495 . . . . 3.3599999999999999 109.363 -159.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 63.7 m -76.98 166.83 22.79 Favored 'General case' 0 C--O 1.248 1.005 0 O-C-N 121.286 -1.126 . . . . 2.9100000000000001 112.017 151.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.8 ptmt -85.94 4.87 35.69 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 126.364 1.866 . . . . 5.5499999999999998 113.923 169.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 40.8 tp -96.93 -5.14 38.67 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.463 1.905 . . . . 4.4400000000000004 110.73 167.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.51 ' HG1' ' CD ' ' A' ' 66' ' ' GLU . 42.2 p -146.45 149.73 34.25 Favored 'General case' 0 C--O 1.253 1.263 0 N-CA-C 114.799 1.407 . . . . 1.8600000000000001 114.799 -161.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.2 mt -107.99 102.35 11.53 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 113.512 -1.676 . . . . 2.6499999999999999 110.137 173.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.3 t -75.85 173.24 11.42 Favored 'General case' 0 CA--C 1.552 1.031 0 O-C-N 120.884 -1.135 . . . . 3.6600000000000001 112.764 173.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -55.52 -9.82 0.55 Allowed 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 127.615 2.366 . . . . 4.2800000000000002 117.272 -171.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.439 ' HZ3' ' CD ' ' A' ' 23' ' ' GLU . 7.0 ptmt -93.39 -50.39 5.47 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.741 1.385 . . . . 4.5999999999999996 114.741 164.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -54.2 -41.12 68.26 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.663 1.985 . . . . 2.4199999999999999 108.933 176.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.79 -47.94 67.72 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 114.333 -1.303 . . . . 3.2400000000000002 110.78 -175.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -55.24 -49.53 71.77 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.165 -0.959 . . . . 5.4199999999999999 112.108 171.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.472 ' CD ' ' HZ1' ' A' ' 40' ' ' LYS . 28.3 tp10 -66.78 -10.29 45.92 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.263 1.425 . . . . 3.4199999999999999 114.437 -178.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.7 tt -94.27 -54.27 3.62 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.887 1.221 . . . . 2.9199999999999999 111.402 165.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.6 mt -53.52 -50.83 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 CA-C-N 119.978 1.263 . . . . 2.1000000000000001 110.999 -175.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.5 mtpt -71.99 -2.57 18.67 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.599 0.963 . . . . 4.6600000000000001 113.599 -177.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.472 ' HZ1' ' CD ' ' A' ' 36' ' ' GLU . 44.9 mmtm -101.97 -15.74 16.71 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.45 1.9 . . . . 3.96 113.63 167.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -94.45 -55.07 3.29 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.423 1.489 . . . . 4.4199999999999999 112.544 178.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -68.69 91.04 0.42 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.806 2.042 . . . . 3.0499999999999998 110.332 -177.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.4 t -62.58 -17.04 59.26 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.876 1.27 . . . . 5.7599999999999998 112.5 173.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 28.0 mt -59.13 -25.74 64.12 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 127.908 2.483 . . . . 4.7000000000000002 113.765 171.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.67 -34.72 0.85 Allowed Glycine 0 CA--C 1.538 1.479 0 C-N-CA 125.233 1.397 . . . . 4.3899999999999997 116.456 170.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.501 ' CD ' ' HZ1' ' A' ' 48' ' ' LYS . 8.8 mm-40 -67.17 -4.62 10.77 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.19 1.796 . . . . 5.25 114.762 -178.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.5 tpt -69.89 78.71 0.47 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 123.514 1.626 . . . . 2.6400000000000001 109.795 167.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.501 ' HZ1' ' CD ' ' A' ' 46' ' ' GLU . 3.6 ttmp? -94.53 147.65 23.06 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 127.894 2.478 . . . . 5.7300000000000004 111.658 -160.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -47.64 -44.39 26.92 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.984 2.113 . . . . 4.6100000000000003 115.463 -160.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.4 m -71.91 -35.46 69.7 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.002 1.274 . . . . 2.9399999999999999 113.36 176.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.7 m -74.36 -9.38 58.54 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.871 1.269 . . . . 3.2000000000000002 112.608 173.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.2 mm -79.75 -29.51 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-O 118.447 -0.787 . . . . 3.6400000000000001 110.908 166.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.36 -33.73 75.83 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.848 1.204 . . . . 2.5099999999999998 110.726 173.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -70.54 -43.42 69.57 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.174 0.897 . . . . 3.3100000000000001 112.507 168.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 37.1 tp -62.67 -46.42 88.29 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.387 -0.816 . . . . 3.0299999999999998 111.559 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.09 -53.92 36.63 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 124.199 1.0 . . . . 2.7000000000000002 110.768 166.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 tmpt? -56.59 -28.81 61.16 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 120.243 1.383 . . . . 5.5300000000000002 113.25 177.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.2 m -83.76 -37.29 22.82 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.119 1.767 . . . . 2.4100000000000001 112.642 -177.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 11.0 mp -65.0 -49.87 68.54 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.538 0.735 . . . . 3.5899999999999999 110.661 163.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -88.97 59.69 5.13 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 127.406 2.283 . . . . 1.5700000000000001 112.139 -170.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.9 mtmp? -40.57 -32.69 0.22 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 127.456 2.302 . . . . 4.5999999999999996 115.764 -177.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -98.94 -6.51 28.66 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 115.651 1.722 . . . . 2.9500000000000002 115.651 -178.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.8 t 57.87 31.54 20.67 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.852 1.661 . . . . 3.2799999999999998 114.331 -178.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -69.07 -16.82 63.78 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.969 0.907 . . . . 2.2000000000000002 111.397 173.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.58 15.37 2.13 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 130.214 3.405 . . . . 4.46 114.368 178.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.51 ' CD ' ' HG1' ' A' ' 28' ' ' THR . 4.1 mm-40 -131.18 133.84 45.92 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 127.841 2.456 . . . . 2.52 110.48 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.2 mm -107.34 99.45 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.129 0.972 . . . . 2.6899999999999999 111.097 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -68.32 157.11 36.35 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.531 1.933 . . . . 2.8599999999999999 110.343 170.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.5 -35.23 52.56 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 120.13 1.332 . . . . 3.2000000000000002 113.001 179.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -63.91 -30.2 71.3 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.238 -0.914 . . . . 4.1100000000000003 113.182 174.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -83.56 -45.83 13.1 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.862 1.265 . . . . 2.6000000000000001 110.434 175.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -49.7 -44.16 47.97 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 126.19 1.796 . . . . 4.8499999999999996 111.812 176.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.5 t -60.56 -22.75 64.02 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 120.594 -1.317 . . . . 2.7799999999999998 114.121 176.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.7 t -68.89 -32.91 56.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 O-C-N 120.015 -1.678 . . . . 3.5600000000000001 110.882 176.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -60.55 -57.15 13.95 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.993 0.917 . . . . 3.02 110.961 171.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -53.59 -43.49 68.61 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.965 0.906 . . . . 3.3399999999999999 111.344 176.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 58.9 m -51.97 -54.97 23.43 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.615 1.166 . . . . 2.1499999999999999 111.291 173.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 78.8 mtm -63.44 -43.04 98.57 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 118.817 -0.611 . . . . 2.9100000000000001 112.412 -177.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 63.1 mt -63.21 -39.37 94.45 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.492 0.587 . . . . 2.3599999999999999 112.182 176.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.425 ' HB3' ' CZ ' ' B' ' 69' ' ' PHE . 87.9 m -65.06 -38.1 89.71 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 118.674 -0.679 . . . . 2.8599999999999999 112.514 172.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 15.1 mtp -64.75 -36.07 83.13 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.453 1.024 . . . . 3.3399999999999999 113.165 171.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.66 -53.08 53.06 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.295 0.952 . . . . 1.96 111.946 174.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -65.04 -25.97 68.06 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.573 0.953 . . . . 3.7200000000000002 113.573 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -60.31 -43.07 96.68 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.52 1.128 . . . . 3.8700000000000001 113.074 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -75.23 -45.02 42.97 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.014 1.326 . . . . 2.8100000000000001 111.358 178.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -49.76 -48.68 50.17 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.346 1.859 . . . . 3.0800000000000001 110.939 175.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -56.11 -27.12 52.67 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.462 1.505 . . . . 3.2999999999999998 113.386 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 43.6 mt -80.12 -27.87 39.08 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.184 -0.947 . . . . 2.3100000000000001 112.432 178.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -87.36 -20.04 27.29 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.747 1.219 . . . . 2.73 113.888 175.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 26.6 t70 . . . . . 0 CA--C 1.54 0.572 0 C-N-CA 128.401 2.68 . . . . 2.8199999999999998 113.669 -178.741 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 41.3 p . . . . . 0 N--CA 1.471 0.607 0 CA-C-O 119.528 -0.272 . . . . 3.5299999999999998 110.41 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -63.96 -23.9 67.68 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.341 2.027 . . . . 1.8999999999999999 112.218 173.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 73.7 mt -75.07 -43.21 54.54 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.187 0.995 . . . . 4.3200000000000003 111.895 174.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -66.99 -28.57 68.36 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.011 1.278 . . . . 3.8700000000000001 112.086 168.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -36.07 82.88 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.188 -1.57 . . . . 5.8899999999999997 112.551 167.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.0 -44.79 68.64 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.287 1.035 . . . . 2.1200000000000001 112.371 171.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 50.2 mt -60.82 -42.36 97.54 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.86 1.209 . . . . 2.77 111.838 175.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 20.8 p -68.81 -37.48 79.25 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 117.776 -1.107 . . . . 3.52 111.904 173.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 85.3 m -59.09 -42.81 91.37 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.944 1.247 . . . . 1.9399999999999999 111.45 169.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 8.4 mtt -58.24 -51.44 69.77 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.678 0.791 . . . . 4.4000000000000004 110.61 175.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.32 -36.58 64.52 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 113.883 1.068 . . . . 2.8599999999999999 113.883 173.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 90.7 m -63.22 -52.66 61.31 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.443 1.497 . . . . 1.6200000000000001 110.928 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.16 -39.1 65.92 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 114.878 -1.056 . . . . 3.1899999999999999 108.525 -175.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -57.53 -45.65 84.79 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.039 0.535 . . . . 3.6299999999999999 111.019 176.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 6.7 m80 -68.7 -29.46 67.9 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.776 1.028 . . . . 2.6800000000000002 113.776 177.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 18.7 ttmm -68.04 -28.31 67.28 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.35 1.06 . . . . 4.2599999999999998 113.475 176.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -85.79 -45.83 11.24 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.927 0.891 . . . . 4.04 112.08 166.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 38.3 t -60.69 -27.25 67.73 Favored 'General case' 0 C--O 1.249 1.054 0 N-CA-C 114.524 1.305 . . . . 2.4199999999999999 114.524 -175.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.96 -2.25 90.28 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 116.637 -2.201 . . . . 1.46 115.268 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.4 mtp85 -75.11 -110.71 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.559 1.544 . . . . 4.8200000000000003 110.207 172.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -44.37 129.55 6.49 Favored 'General case' 0 C--O 1.248 1.0 0 CA-C-N 120.48 1.491 . . . . 4.1699999999999999 111.201 171.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.43 -35.41 91.67 Favored Glycine 0 N--CA 1.469 0.848 0 CA-C-N 114.533 -1.212 . . . . 3.29 115.64 -132.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 2.0 t -62.25 138.27 58.39 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.089 1.756 . . . . 4.6399999999999997 111.754 172.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -130.95 155.87 46.06 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.836 1.654 . . . . 6.8700000000000001 111.861 -169.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.0 mp 76.16 3.44 3.67 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 128.877 2.871 . . . . 5.0099999999999998 111.921 -157.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 10.9 p -143.47 149.03 36.98 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 131.322 3.849 . . . . 2.27 112.082 -166.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 50.4 mt -118.65 121.21 39.62 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.182 1.793 . . . . 3.1899999999999999 111.799 -176.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 4.7 t -91.77 -178.72 5.12 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.089 1.356 . . . . 2.6099999999999999 113.926 166.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 29.8 ttp85 -60.5 -23.91 64.9 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.144 2.177 . . . . 6.21 116.597 -161.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 mptt -110.47 -19.44 12.93 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 115.095 1.517 . . . . 9.0 115.095 172.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -54.8 -59.59 4.52 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.093 0.957 . . . . 2.3100000000000001 109.32 160.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -61.86 -39.66 92.64 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 127.101 2.16 . . . . 3.2599999999999998 110.963 -177.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -39.67 82.04 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.177 -1.577 . . . . 6.8799999999999999 113.993 178.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 32.7 tp10 -90.31 -21.46 22.04 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 118.003 -0.999 . . . . 4.0 112.611 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.7 tt -54.46 -62.37 1.7 Allowed 'General case' 0 C--N 1.343 0.315 0 CA-C-O 118.086 -0.959 . . . . 3.5 109.499 164.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 35.1 mt -47.61 -57.62 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 C-N-CA 123.892 0.877 . . . . 2.0 110.479 -175.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -72.96 -2.39 20.78 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 113.894 1.072 . . . . 5.7699999999999996 113.894 -168.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 24.9 mttp -117.7 -33.6 4.48 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 120.358 -1.464 . . . . 3.7599999999999998 114.331 170.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -60.32 -41.32 93.24 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.839 1.255 . . . . 5.25 110.151 170.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -102.0 117.23 34.38 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 106.281 -1.748 . . . . 3.3300000000000001 106.281 158.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 9.2 t -110.1 -9.71 14.7 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.3 1.04 . . . . 3.9399999999999999 112.811 -171.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -54.61 -2.76 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 117.915 2.561 . . . . 4.0300000000000002 117.915 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.37 17.32 59.04 Favored Glycine 0 N--CA 1.476 1.307 0 CA-C-N 120.116 1.325 . . . . 5.3499999999999996 115.208 174.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.7 -163.4 1.02 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.359 1.464 . . . . 6.46 111.652 177.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 78.18 178.04 0.14 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.515 2.726 . . . . 3.2599999999999998 114.713 176.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -165.58 139.95 4.74 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.182 1.793 . . . . 8.3699999999999992 108.517 -175.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -61.56 -31.88 71.93 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 121.057 1.753 . . . . 4.7400000000000002 111.643 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.3 m -70.44 24.81 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.263 1.825 . . . . 3.7599999999999998 115.285 165.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -139.77 15.54 2.5 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.411 1.485 . . . . 3.4900000000000002 111.939 154.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 71.7 mt -112.28 -46.59 5.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.612 1.165 . . . . 2.5600000000000001 111.204 -176.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.83 -30.03 71.02 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.055 0.843 . . . . 3.71 111.586 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -78.6 -46.38 19.45 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 128.696 2.798 . . . . 5.3499999999999996 113.967 171.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 48.9 tp -58.25 -35.98 72.54 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.18 0.446 . . . . 3.73 111.157 173.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.4 mmm -49.29 -46.24 46.24 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.899 1.28 . . . . 2.9199999999999999 111.194 171.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.3 mptt -68.72 -39.78 80.26 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.745 -1.222 . . . . 8.2300000000000004 112.129 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.5 t -64.98 -29.57 70.5 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-O 122.229 1.014 . . . . 2.1299999999999999 113.303 -176.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.2 mp -76.66 -21.35 55.56 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.594 1.158 . . . . 4.1299999999999999 112.717 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -89.14 127.67 35.74 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.968 1.307 . . . . 2.3399999999999999 110.133 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.32 11.53 21.05 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 120.616 -1.302 . . . . 4.4900000000000002 112.753 -170.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 33.4 p30 -163.45 -27.01 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.69 1.737 . . . . 3.1000000000000001 115.69 -165.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 29.9 t 70.38 51.96 0.36 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.436 1.495 . . . . 3.6099999999999999 110.603 -170.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 11.7 p30 -82.86 -54.57 5.0 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.48 1.512 . . . . 3.8999999999999999 109.871 -174.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 171.74 -25.5 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 131.656 3.982 . . . . 8.7300000000000004 113.881 169.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -154.96 154.54 32.74 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 125.331 1.452 . . . . 2.27 110.49 -163.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 3.1 mm -92.99 105.37 16.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 126.072 1.749 . . . . 2.98 109.037 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.1 165.32 20.54 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.41 -0.806 . . . . 3.1499999999999999 110.631 167.091 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . 0.425 ' CZ ' ' HB3' ' A' ' 80' ' ' CYS . 0.4 OUTLIER -54.1 -38.57 65.51 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 120.421 -1.424 . . . . 5.0599999999999996 112.997 178.642 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -76.67 -21.7 55.06 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.75 -1.219 . . . . 5.4500000000000002 113.69 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -69.75 -61.45 1.78 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.182 0.993 . . . . 2.2999999999999998 109.507 160.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.04 -32.85 70.13 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 128.504 2.721 . . . . 3.2999999999999998 114.866 -172.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 60.2 p -61.85 -14.75 36.34 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 119.482 -2.011 . . . . 2.3799999999999999 113.299 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 5.1 p -60.67 -29.37 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 O-C-N 121.06 -1.025 . . . . 3.9399999999999999 112.486 170.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -75.77 -47.72 24.72 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.506 1.522 . . . . 3.2400000000000002 111.33 175.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 93.8 mt -54.67 -35.7 63.82 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.225 0.61 . . . . 2.46 111.555 169.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 19.3 m -63.14 -53.81 47.5 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.199 0.999 . . . . 2.0 111.312 172.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 19.8 mtm -56.45 -49.7 73.85 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.93 0.892 . . . . 2.8900000000000001 112.191 177.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 85.2 mt -60.94 -43.83 98.12 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.33 1.052 . . . . 2.46 111.589 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.6 t -72.59 -28.79 63.01 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 113.08 0.77 . . . . 3.6600000000000001 113.08 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 86.2 mtp -67.22 -42.74 83.57 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 118.996 0.816 . . . . 3.54 111.074 170.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.06 -27.25 69.27 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 118.711 0.687 . . . . 2.27 112.706 173.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -73.31 -28.62 62.18 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.311 1.226 . . . . 4.1100000000000003 114.311 170.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -65.65 -44.79 85.28 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 120.275 1.398 . . . . 3.3900000000000001 109.804 170.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -67.67 -31.84 72.1 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.135 0.974 . . . . 2.9199999999999999 110.614 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.11 -50.88 70.14 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.763 1.225 . . . . 4.3399999999999999 111.852 167.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -59.61 -33.08 71.04 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.501 1.52 . . . . 3.1899999999999999 112.243 -177.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 94.2 mt -79.27 -18.62 52.39 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.836 1.254 . . . . 2.54 113.782 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . 0.485 ' CD ' ' HZ3' ' B' ' 92' ' ' LYS . 51.2 mm-40 -95.13 -11.79 27.56 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 114.381 1.252 . . . . 3.54 114.381 176.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -94.23 -50.21 5.38 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.556 1.542 . . . . 3.1899999999999999 112.798 174.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -82.0 52.63 2.01 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.274 1.43 . . . . 2.8599999999999999 111.792 -174.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . 0.485 ' HZ3' ' CD ' ' B' ' 89' ' ' GLU . 57.2 mmtt . . . . . 0 C--O 1.248 1.021 0 C-N-CA 128.558 2.743 . . . . 4.9299999999999997 114.609 171.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 C--O 1.239 0.511 0 N-CA-C 106.126 -1.805 . . . . 3.7400000000000002 106.126 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.9 p -62.64 163.6 14.92 Favored Pre-proline 0 CA--C 1.54 0.561 0 C-N-CA 126.334 1.853 . . . . 2.3399999999999999 113.547 -167.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -67.86 -12.76 36.41 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 122.406 2.071 . . . . 1.49 113.342 169.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.08 -38.08 32.48 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.718 1.145 . . . . 3.2599999999999998 110.891 174.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -55.7 -53.97 49.98 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 108.473 -0.936 . . . . 4.7000000000000002 108.473 166.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.6 mttp -64.38 -25.08 67.87 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 112.316 0.488 . . . . 4.2400000000000002 112.316 -176.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.41 -47.02 58.65 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.203 0.91 . . . . 1.9399999999999999 111.722 171.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 43.5 mt -62.83 -44.53 95.9 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.02 0.928 . . . . 2.3599999999999999 111.387 176.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 88.1 m -61.51 -46.4 90.14 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.459 1.903 . . . . 2.2400000000000002 111.908 173.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.8 m -61.67 -45.48 93.83 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.215 0.916 . . . . 2.2200000000000002 110.468 177.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -60.49 -52.61 64.46 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.618 0.645 . . . . 4.6200000000000001 110.937 -177.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.7 p -63.95 -23.63 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 O-C-N 120.96 -1.088 . . . . 3.3500000000000001 113.318 177.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.9 m -65.87 -58.3 5.91 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 117.721 -1.133 . . . . 2.2200000000000002 109.826 172.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -40.3 66.57 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.822 0.849 . . . . 2.8300000000000001 110.291 175.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -57.31 -49.59 75.61 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 124.718 1.261 . . . . 3.6699999999999999 110.433 -174.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -61.97 -42.22 98.88 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.274 -0.892 . . . . 2.5800000000000001 112.633 175.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -69.5 -36.41 76.46 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.838 -1.164 . . . . 7.6500000000000004 112.764 -176.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -85.12 -20.08 30.85 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.414 1.486 . . . . 3.71 114.567 172.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.7 p -55.84 -32.23 63.43 Favored 'General case' 0 N--CA 1.485 1.303 0 O-C-N 119.79 -1.819 . . . . 3.52 113.509 171.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 109.72 -131.31 10.41 Favored Glycine 0 C--N 1.34 0.792 0 CA-C-N 114.255 -1.339 . . . . 3.9300000000000002 114.298 126.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -123.32 -14.64 7.39 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 127.112 2.165 . . . . 6.0199999999999996 111.85 -171.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -131.59 153.3 50.03 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 126.96 2.104 . . . . 4.2199999999999998 111.705 -170.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.64 -124.32 34.19 Favored Glycine 0 C--N 1.337 0.625 0 CA-C-N 113.302 -1.772 . . . . 2.3999999999999999 109.75 -169.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 42.2 t -98.08 168.99 9.93 Favored 'General case' 0 C--O 1.252 1.19 0 CA-C-O 122.651 1.215 . . . . 3.6000000000000001 111.434 160.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -107.95 22.37 16.06 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 129.594 3.157 . . . . 5.8099999999999996 111.987 175.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.4 tp -96.0 -5.02 42.12 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.463 1.105 . . . . 4.3700000000000001 110.386 153.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.1 p -150.6 135.69 17.68 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 113.173 0.805 . . . . 1.97 113.173 -151.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.5 mp -98.53 108.91 21.72 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.783 1.233 . . . . 3.27 112.297 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.1 p -64.26 158.15 24.03 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 124.562 1.145 . . . . 3.7200000000000002 112.54 167.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.7 tpt180 -44.39 -43.52 7.7 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.479 0.918 . . . . 5.75 113.479 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.77 -33.53 66.36 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.039 1.125 . . . . 4.7800000000000002 114.039 179.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -64.86 -51.46 61.91 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.518 1.527 . . . . 2.21 108.589 173.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.3 tp -58.34 -41.64 85.07 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.027 0.931 . . . . 3.5600000000000001 112.732 175.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tmpt? -53.79 -33.68 56.74 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.41 0.684 . . . . 7.9400000000000004 112.385 177.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -79.51 -48.76 13.33 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 118.538 -0.744 . . . . 3.9700000000000002 111.191 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.3 tp -49.15 -59.84 3.31 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.306 1.042 . . . . 3.04 111.263 177.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.5 mt -57.99 -35.0 50.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 123.242 0.617 . . . . 2.1400000000000001 110.556 -177.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -72.71 -2.88 21.99 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.563 1.32 . . . . 4.9299999999999997 114.563 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt -133.1 -28.34 1.54 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 127.124 2.17 . . . . 3.9399999999999999 112.476 -172.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -68.54 -123.29 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 107.701 -1.222 . . . . 4.1200000000000001 107.701 144.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -56.98 -53.12 61.69 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 115.869 1.803 . . . . 3.1099999999999999 115.869 -158.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 17.0 t 62.07 -4.06 0.22 Allowed 'General case' 0 CA--C 1.558 1.269 0 N-CA-C 116.59 2.07 . . . . 4.4900000000000002 116.59 172.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -42.82 -49.56 5.76 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 115.911 1.819 . . . . 5.7400000000000002 115.911 -151.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.81 -37.13 0.43 Allowed Glycine 0 N--CA 1.468 0.78 0 C-N-CA 124.781 1.181 . . . . 4.0199999999999996 112.98 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -61.87 -35.36 78.07 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.214 1.006 . . . . 7.3099999999999996 111.834 172.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -71.37 63.53 0.38 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 127.027 2.131 . . . . 2.4100000000000001 114.347 -178.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.6 mmmt -92.26 165.23 13.21 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 129.285 3.034 . . . . 8.7400000000000002 109.788 161.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.465 ' CD ' ' H ' ' A' ' 49' ' ' GLU . 3.0 mp0 -42.38 -51.41 4.91 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.106 1.762 . . . . 4.7599999999999998 114.654 -168.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.1 m -71.99 -28.21 63.26 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 114.964 1.468 . . . . 3.71 114.964 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.4 t -76.22 -27.52 56.85 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 120.316 -1.49 . . . . 2.52 111.004 170.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 74.8 mt -74.11 -22.94 18.39 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 O-C-N 121.327 -0.858 . . . . 2.9900000000000002 111.039 169.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.27 -51.28 54.87 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.91 1.284 . . . . 3.73 110.488 168.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.41 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 3.4 t70 -69.15 -39.74 78.62 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.269 0.47 . . . . 2.3199999999999998 112.269 178.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 57.4 tp -63.78 -50.9 67.19 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 116.524 -1.703 . . . . 3.1800000000000002 110.757 173.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.1 ttt -53.81 -48.53 69.78 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-N 121.305 1.866 . . . . 2.2200000000000002 110.31 174.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.41 ' HE2' ' HA ' ' A' ' 54' ' ' ASP . 2.4 tmmm? -56.37 -29.47 61.47 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.191 0.996 . . . . 4.0999999999999996 113.502 174.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 24.4 t -77.24 -33.2 56.1 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 120.215 -1.553 . . . . 2.9399999999999999 112.912 174.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 18.9 mt -80.56 -47.57 14.0 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.793 0.724 . . . . 3.1600000000000001 111.821 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -79.14 79.07 5.58 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 127.964 2.505 . . . . 2.1800000000000002 111.918 -163.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -68.32 -18.35 64.48 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 116.516 2.043 . . . . 4.4699999999999998 116.516 -177.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.84 -26.99 49.77 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 120.641 1.564 . . . . 3.04 111.669 161.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.3 m 58.77 76.21 0.36 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.79 2.036 . . . . 4.4299999999999997 111.413 177.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -146.27 -109.0 0.1 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.305 -0.861 . . . . 3.2000000000000002 110.082 -151.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -139.49 -20.7 0.93 Allowed 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 115.522 1.675 . . . . 6.3300000000000001 115.522 168.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -130.82 153.08 49.46 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 122.95 1.357 . . . . 3.8500000000000001 113.651 174.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 27.3 mt -90.2 113.9 27.02 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 C-N-CA 126.863 2.065 . . . . 3.3799999999999999 110.55 173.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -64.77 156.99 28.77 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.579 1.151 . . . . 3.6299999999999999 110.662 163.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -57.15 -28.98 63.22 Favored 'General case' 0 CA--C 1.549 0.937 0 O-C-N 120.897 -1.127 . . . . 4.4299999999999997 110.859 165.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.81 -25.88 63.98 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 120.097 -1.627 . . . . 7.2000000000000002 113.746 174.2 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -80.97 -53.21 6.64 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.672 1.189 . . . . 2.4199999999999999 109.288 170.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -48.67 -23.93 1.19 Allowed 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 127.273 2.229 . . . . 3.79 114.573 176.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 47.0 m -52.9 -36.22 59.11 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.647 1.579 . . . . 2.9199999999999999 112.537 171.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 p -79.65 -30.24 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 121.621 -0.674 . . . . 3.2000000000000002 111.696 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -60.23 -56.91 15.76 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.749 0.82 . . . . 2.9300000000000002 110.611 173.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.1 mt -58.84 -34.62 71.76 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.678 0.791 . . . . 2.5800000000000001 112.625 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 84.1 m -62.71 -54.27 41.84 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.459 1.104 . . . . 1.9399999999999999 111.173 173.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 46.6 mtp -54.58 -47.02 73.83 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.243 0.928 . . . . 2.8799999999999999 111.364 177.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.74 -50.21 71.96 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.401 1.08 . . . . 2.3799999999999999 112.392 178.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 93.1 m -63.82 -33.95 76.83 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.192 0.906 . . . . 3.23 113.429 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 92.5 mtp -64.16 -43.89 93.79 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.221 0.918 . . . . 2.75 111.129 175.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.53 -39.73 92.13 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.07 0.548 . . . . 1.6200000000000001 112.272 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -62.44 -31.64 72.38 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.387 0.884 . . . . 3.5600000000000001 113.387 174.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 15.2 t30 -73.29 -37.18 66.31 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.631 1.105 . . . . 2.3999999999999999 112.134 178.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.88 -37.99 89.48 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.195 0.998 . . . . 3.0600000000000001 112.123 167.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.05 -43.38 91.7 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.865 0.866 . . . . 3.0 111.267 174.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -63.35 -32.2 73.56 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.367 1.467 . . . . 3.71 112.007 176.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 35.0 mt -74.94 -17.97 60.47 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.189 -0.944 . . . . 2.1400000000000001 113.025 175.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -94.61 4.24 54.09 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.969 1.707 . . . . 2.6299999999999999 113.779 169.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 11.0 t70 . . . . . 0 N--CA 1.474 0.753 0 C-N-CA 124.889 1.276 . . . . 4.04 110.975 164.068 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 2.6 p . . . . . 0 N--CA 1.476 0.871 0 CA-C-O 119.732 -0.175 . . . . 3.6499999999999999 111.175 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -73.93 -10.65 23.2 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.393 2.062 . . . . 2.1699999999999999 112.744 169.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -67.9 -54.58 17.69 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.693 1.197 . . . . 3.7200000000000002 111.662 -177.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -57.37 -30.85 65.21 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 118.996 0.816 . . . . 4.0899999999999999 111.979 175.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -74.89 -33.92 62.12 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 120.522 -1.361 . . . . 6.2300000000000004 111.848 176.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.22 -46.19 65.01 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.472 1.509 . . . . 1.5900000000000001 111.304 173.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.3 mp -66.65 -36.73 83.26 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.14 0.882 . . . . 3.7999999999999998 111.381 176.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 54.5 m -56.21 -48.36 76.58 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 121.592 -0.692 . . . . 2.4399999999999999 111.07 166.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 90.4 m -62.46 -35.46 79.38 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.629 1.172 . . . . 1.8899999999999999 111.766 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -54.84 -59.9 4.1 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 118.439 -0.791 . . . . 4.5800000000000001 110.607 166.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 17.8 m -67.83 -17.89 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 CA-C-N 120.332 1.424 . . . . 3.2599999999999998 113.588 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 62.3 m -71.83 -48.87 43.19 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.752 1.621 . . . . 1.7 111.171 171.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 64.5 p -58.07 -33.35 68.95 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 118.202 -0.904 . . . . 2.5499999999999998 110.101 166.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -72.76 -49.54 30.23 Favored 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 119.713 1.142 . . . . 3.7000000000000002 111.834 -175.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -72.63 -17.45 61.67 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 120.171 -1.58 . . . . 3.02 114.459 178.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -82.72 -66.46 0.89 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.392 0.677 . . . . 5.5700000000000003 111.77 166.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -69.69 -29.98 67.54 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.591 1.087 . . . . 3.1899999999999999 113.633 -175.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 19.9 p -70.91 -19.31 62.61 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 122.445 2.384 . . . . 2.4900000000000002 111.986 172.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -94.04 17.69 58.28 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 126.886 2.184 . . . . 2.2000000000000002 113.477 168.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 51.2 tpt85 -72.9 -28.89 62.74 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.207 1.004 . . . . 4.1399999999999997 111.193 169.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -157.63 153.81 27.38 Favored 'General case' 0 C--O 1.251 1.149 0 C-N-CA 125.866 1.667 . . . . 3.4900000000000002 111.952 170.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.66 -136.35 36.89 Favored Glycine 0 C--N 1.335 0.528 0 C-N-CA 125.559 1.552 . . . . 2.8599999999999999 112.014 168.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 11.4 m -58.02 128.42 37.0 Favored 'General case' 0 C--O 1.246 0.915 0 O-C-N 122.292 -0.534 . . . . 3.5699999999999998 111.181 174.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -76.46 111.79 12.3 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 126.134 1.773 . . . . 8.2599999999999998 107.315 148.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 35.4 tp 141.72 -41.69 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 130.038 3.335 . . . . 4.6900000000000004 106.925 -161.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 71.0 p -121.6 141.71 50.83 Favored 'General case' 0 C--O 1.255 1.36 0 CA-C-O 123.22 1.486 . . . . 2.7599999999999998 112.903 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 22.0 mt -93.72 95.98 9.51 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 111.83 -2.441 . . . . 2.9100000000000001 107.267 157.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 6.6 m -65.58 155.97 34.15 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 120.721 -1.237 . . . . 2.8399999999999999 110.441 169.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 25.2 ttt180 -41.54 -29.1 0.15 Allowed 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 117.43 2.381 . . . . 4.9699999999999998 117.43 -174.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -85.88 -38.04 18.49 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 115.229 1.566 . . . . 5.2599999999999998 115.229 172.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -56.78 -48.53 77.7 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.049 0.94 . . . . 1.77 108.918 167.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 14.4 tp -63.52 -43.9 95.83 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.055 0.942 . . . . 3.0600000000000001 111.899 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 23.4 ttmt -56.5 -47.17 79.88 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 119.268 -0.396 . . . . 3.8700000000000001 111.738 179.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -59.61 -44.2 93.49 Favored 'General case' 0 CA--C 1.553 1.08 0 N-CA-C 113.452 0.908 . . . . 3.3500000000000001 113.452 174.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 31.3 tp -61.18 -55.67 29.61 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.812 1.245 . . . . 3.1099999999999999 111.186 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 19.7 mt -59.07 -52.57 59.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 108.889 -0.782 . . . . 2.0499999999999998 108.889 -178.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.3 -27.15 67.07 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 113.937 1.088 . . . . 6.7400000000000002 113.937 -173.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -85.49 -53.81 4.96 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 120.093 1.315 . . . . 4.6200000000000001 114.516 170.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -72.73 -31.21 64.8 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 118.245 0.475 . . . . 4.79 110.937 -171.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -110.27 72.56 0.8 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.078 1.351 . . . . 2.77 108.911 161.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.7 t -71.39 61.81 0.34 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.971 1.308 . . . . 3.5899999999999999 112.306 174.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.25 166.84 11.21 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 127.337 2.255 . . . . 5.46 112.402 -173.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -85.9 -72.64 1.29 Allowed Glycine 0 C--N 1.338 0.649 0 C-N-CA 125.291 1.424 . . . . 4.0800000000000001 109.676 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . 0.565 ' H ' ' CD ' ' B' ' 46' ' ' GLU . 1.2 pm0 -40.27 -30.61 0.11 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 128.831 2.852 . . . . 6.0499999999999998 115.258 164.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -72.99 53.37 0.35 Allowed 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.792 -1.193 . . . . 3.04 111.431 163.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.451 ' HA ' ' HE2' ' B' ' 48' ' ' LYS . 2.7 mmpt? -59.09 159.81 6.91 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 123.157 1.456 . . . . 5.9500000000000002 111.443 172.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -76.87 -8.52 57.5 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.381 -0.825 . . . . 6.1299999999999999 113.103 -156.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 12.3 t -102.6 -14.76 16.62 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.022 1.729 . . . . 3.5099999999999998 113.872 162.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 4.5 m -62.44 -28.48 69.84 Favored 'General case' 0 N--CA 1.482 1.157 0 CA-C-N 121.259 1.845 . . . . 3.2200000000000002 110.493 166.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 14.0 mm -52.36 -37.24 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 126.461 1.904 . . . . 2.4100000000000001 113.253 165.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -82.92 -27.22 30.75 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.164 0.985 . . . . 3.7200000000000002 112.592 -173.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.76 -46.94 67.49 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 118.428 -0.796 . . . . 2.5 110.461 161.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -54.56 -49.04 71.3 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.407 1.083 . . . . 3.5499999999999998 110.558 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.42 -48.89 79.2 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.982 0.913 . . . . 2.6400000000000001 111.765 174.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -18.58 62.13 Favored 'General case' 0 CA--C 1.555 1.144 0 N-CA-C 114.634 1.346 . . . . 4.1900000000000004 114.634 172.123 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.9 m -94.13 -29.79 14.97 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.41 1.884 . . . . 3.1800000000000002 112.483 -179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 96.2 mt -74.91 -49.14 21.3 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.475 1.11 . . . . 3.2599999999999998 111.082 165.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -82.84 63.92 7.19 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 125.998 1.719 . . . . 2.3100000000000001 111.643 -172.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 27.7 mttm -56.09 -20.47 17.35 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.084 1.754 . . . . 4.9000000000000004 112.194 175.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -72.42 -32.58 66.46 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.511 1.924 . . . . 2.75 113.877 174.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 21.2 t 62.93 29.38 16.51 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.675 1.19 . . . . 3.77 113.227 -161.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 10.0 p30 -86.44 -14.53 43.0 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.4 1.48 . . . . 2.1699999999999999 112.462 -177.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 69.46 2.06 3.58 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 128.979 2.911 . . . . 5.0800000000000001 116.923 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -100.53 147.34 26.03 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 127.783 2.433 . . . . 2.8300000000000001 110.923 167.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 43.3 mm -106.4 103.52 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 108.128 -1.064 . . . . 2.1499999999999999 108.128 160.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.26 165.51 23.51 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.578 1.551 . . . . 2.5 110.738 165.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -52.59 -26.21 12.78 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 115.222 1.564 . . . . 3.5699999999999998 115.222 -175.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.3 -43.84 16.99 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 120.649 -1.282 . . . . 4.1299999999999999 111.647 177.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -55.92 -35.53 66.71 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.29 1.036 . . . . 2.3100000000000001 110.133 169.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -76.87 -38.55 53.45 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.365 1.866 . . . . 4.4000000000000004 113.498 176.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 51.9 p -73.05 -34.61 66.39 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 119.767 -1.833 . . . . 2.71 111.72 176.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.8 p -69.28 -29.81 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.143 0.883 . . . . 3.9100000000000001 112.352 172.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -59.06 -57.79 11.5 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.179 -0.951 . . . . 2.6200000000000001 111.382 166.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 96.6 mt -62.03 -29.47 70.3 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.462 0.705 . . . . 3.0 112.321 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 45.5 m -63.37 -53.34 53.99 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.856 1.262 . . . . 2.2599999999999998 111.622 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 74.1 mtm -59.41 -39.74 84.44 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 119.173 0.897 . . . . 2.73 111.471 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.83 -56.43 19.54 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.12 0.568 . . . . 3.0699999999999998 111.608 173.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 5.1 t -60.3 -32.45 71.22 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.218 0.917 . . . . 2.8300000000000001 112.592 -177.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 76.9 mtp -71.63 -33.15 68.7 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.841 1.052 . . . . 3.3999999999999999 113.841 170.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.19 -35.51 81.03 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 120.535 1.516 . . . . 2.04 112.391 172.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -64.25 -19.6 65.49 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.215 -0.928 . . . . 4.2000000000000002 112.947 171.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.72 -45.21 79.45 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.771 1.169 . . . . 2.8599999999999999 112.063 170.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.88 -46.3 78.87 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.565 1.146 . . . . 3.8500000000000001 110.244 177.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -53.08 -47.38 68.56 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.942 1.697 . . . . 3.77 112.19 175.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -61.15 -27.74 68.61 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.476 1.51 . . . . 3.48 113.163 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 43.8 mt -79.38 -13.57 59.53 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.208 1.003 . . . . 2.77 112.949 178.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -108.21 8.53 27.95 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.161 1.785 . . . . 3.6499999999999999 113.081 168.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -107.03 -54.77 2.42 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.849 1.259 . . . . 3.6800000000000002 112.145 174.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.28 31.75 0.51 Allowed 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 124.904 1.282 . . . . 3.3100000000000001 112.678 176.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 2.1 ptmm? . . . . . 0 C--O 1.257 1.469 0 N-CA-C 117.314 2.338 . . . . 5.25 117.314 -157.642 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 . . . . . 0 N--CA 1.461 0.101 0 N-CA-C 113.267 0.84 . . . . 5.4900000000000002 113.267 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 44.2 p -111.62 160.02 31.08 Favored Pre-proline 0 N--CA 1.468 0.474 0 CA-C-N 116.002 -0.545 . . . . 2.3700000000000001 111.845 -156.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -59.37 -21.22 59.94 Favored 'Trans proline' 0 CA--C 1.536 0.588 0 C-N-CA 121.771 1.648 . . . . 1.3700000000000001 111.63 166.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.79 -49.9 14.78 Favored 'General case' 0 C--N 1.344 0.361 0 CA-C-O 118.333 -0.842 . . . . 3.3999999999999999 110.525 174.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -62.93 -33.02 74.47 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 120.792 1.633 . . . . 3.4700000000000002 111.875 176.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -67.92 -25.12 65.32 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.665 -1.272 . . . . 5.1799999999999997 113.04 172.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.49 -44.53 34.99 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.827 0.851 . . . . 1.8600000000000001 111.936 172.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.7 mt -64.13 -40.53 96.37 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 121.107 -0.996 . . . . 2.4700000000000002 111.962 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.6 p -61.97 -45.16 94.87 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 117.511 -1.233 . . . . 3.79 111.162 171.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 54.3 m -53.91 -38.22 64.6 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 119.16 0.891 . . . . 2.1299999999999999 111.54 173.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.1 tpp -56.3 -48.46 76.62 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 118.766 -0.635 . . . . 4.4299999999999997 111.89 175.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.7 m -72.27 -29.53 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 119.462 1.028 . . . . 3.4199999999999999 112.67 175.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.8 m -57.43 -57.87 10.77 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.827 1.194 . . . . 1.8500000000000001 111.472 175.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.92 -24.51 58.52 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.62 0.768 . . . . 3.21 110.311 -178.238 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -65.33 -59.23 4.26 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-O 117.982 -1.008 . . . . 3.0899999999999999 111.535 170.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 63.2 m-70 -58.78 -42.23 88.51 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 120.782 1.628 . . . . 4.3499999999999996 112.656 -175.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.5 tttt -39.55 -53.71 2.06 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.246 2.218 . . . . 6.6399999999999997 113.937 168.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -95.95 -29.47 14.14 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.31 1.226 . . . . 3.8100000000000001 114.31 -178.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.8 t -73.43 -34.12 65.28 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 127.073 2.149 . . . . 2.5899999999999999 113.181 -177.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -73.57 -22.04 78.86 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 124.319 0.961 . . . . 2.04 112.338 170.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -86.21 68.74 10.36 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.188 1.395 . . . . 6.1600000000000001 110.206 -177.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.505 ' HG2' ' H ' ' A' ' 24' ' ' GLY . 8.8 tt0 102.78 -176.76 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 129.638 3.175 . . . . 3.9900000000000002 111.588 173.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.505 ' H ' ' HG2' ' A' ' 23' ' ' GLU . . . 57.93 -145.12 40.87 Favored Glycine 0 N--CA 1.47 0.926 0 C-N-CA 124.895 1.236 . . . . 2.75 110.7 -170.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -79.51 169.49 17.96 Favored 'General case' 0 CA--C 1.553 1.066 0 O-C-N 121.504 -0.998 . . . . 3.1200000000000001 111.054 153.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.5 ptpp? -94.66 -5.65 45.11 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.66 1.584 . . . . 6.4400000000000004 115.161 -173.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 25.8 tp -100.96 4.54 42.6 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.609 1.564 . . . . 4.3799999999999999 111.012 169.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.526 ' HG1' ' CD ' ' A' ' 66' ' ' GLU . 55.0 p -142.6 144.94 33.06 Favored 'General case' 0 C--O 1.246 0.911 0 C-N-CA 125.991 1.717 . . . . 1.95 112.397 -165.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 26.1 tp -113.72 88.12 2.77 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.787 1.635 . . . . 4.0 108.891 -172.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -59.93 160.98 7.07 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.531 1.533 . . . . 2.3799999999999999 114.922 -176.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.59 -20.32 1.16 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 128.374 2.669 . . . . 4.2199999999999998 114.744 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.81 -26.09 13.89 Favored 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 119.98 1.264 . . . . 4.5300000000000002 113.629 167.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -66.16 -53.7 34.41 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.499 1.045 . . . . 1.6799999999999999 109.348 175.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 35.6 tp -50.82 -44.54 59.22 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.712 2.005 . . . . 3.2000000000000002 113.363 -176.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.405 ' HZ1' ' CD ' ' A' ' 36' ' ' GLU . 1.8 tmpt? -56.17 -34.99 66.72 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.137 1.375 . . . . 6.5700000000000003 113.012 -177.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.405 ' CD ' ' HZ1' ' A' ' 35' ' ' LYS . 1.4 tp10 -99.77 13.53 33.38 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.951 1.3 . . . . 4.3200000000000003 114.32 177.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.9 tp -96.69 -56.04 2.71 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.096 0.862 . . . . 3.8799999999999999 110.296 152.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 23.5 mt -60.46 -61.97 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 119.194 0.906 . . . . 2.02 110.161 -168.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -68.31 -11.05 58.86 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.354 1.062 . . . . 5.3499999999999996 111.982 -177.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.64 -42.12 29.58 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.741 1.616 . . . . 6.2000000000000002 111.303 173.305 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -103.28 -72.53 0.69 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.956 0.902 . . . . 6.9500000000000002 109.283 -178.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.1 mt -72.91 22.61 0.06 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 128.637 2.775 . . . . 4.71 114.84 -171.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 26.6 p -51.8 -35.7 45.03 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.637 1.975 . . . . 4.3499999999999996 115.151 -175.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -62.03 -19.59 63.04 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.301 1.84 . . . . 5.0899999999999999 114.941 -173.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -78.58 25.25 2.47 Favored Glycine 0 CA--C 1.532 1.12 0 CA-C-O 118.869 -0.962 . . . . 5.96 113.308 172.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 56.93 20.33 5.24 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 126.54 1.936 . . . . 5.46 113.004 -170.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.4 ttm -82.21 37.88 0.52 Allowed 'General case' 0 N--CA 1.471 0.609 0 O-C-N 120.521 -1.362 . . . . 2.52 113.151 -174.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.9 pttt -73.27 162.88 28.86 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.147 1.379 . . . . 5.6500000000000004 111.714 170.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -25.44 -60.8 0.07 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 128.677 2.791 . . . . 5.1500000000000004 116.39 -162.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.2 t -70.86 -10.11 58.95 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 115.029 1.492 . . . . 3.7599999999999998 115.029 -173.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.3 t -84.13 -13.83 51.91 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.593 1.157 . . . . 2.9399999999999999 112.594 168.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 12.3 mm -79.64 -32.59 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 O-C-N 120.212 -1.555 . . . . 2.6499999999999999 112.794 -173.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.18 -44.03 85.15 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.854 0.862 . . . . 3.0600000000000001 111.736 -175.421 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -72.12 -38.44 69.27 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 122.77 0.428 . . . . 2.3900000000000001 111.387 176.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.98 -49.18 78.68 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 118.679 -0.677 . . . . 3.6800000000000002 110.134 174.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.42 -44.44 89.07 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.396 1.478 . . . . 2.4900000000000002 111.753 177.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -55.93 -30.82 62.25 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.033 0.933 . . . . 4.96 112.751 172.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.65 -23.57 42.46 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.52 1.128 . . . . 2.2599999999999998 113.181 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.416 ' C ' ' HZ1' ' A' ' 61' ' ' LYS . 45.5 mt -89.19 -34.14 16.78 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 114.866 1.432 . . . . 2.96 114.866 -173.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -82.07 154.65 25.49 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 120.787 1.631 . . . . 1.74 112.582 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.416 ' HZ1' ' C ' ' A' ' 59' ' ' LEU . 0.7 OUTLIER -127.84 10.65 6.55 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.067 1.747 . . . . 4.2199999999999998 113.137 175.7 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -121.69 -33.28 3.63 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.699 1.2 . . . . 2.9100000000000001 114.151 -165.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.5 t 76.66 23.07 1.1 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.938 2.495 . . . . 4.6299999999999999 112.602 -167.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.9 p30 -76.91 -24.57 52.48 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.833 1.653 . . . . 2.3799999999999999 111.59 177.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 67.39 19.82 10.04 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 128.652 2.781 . . . . 4.75 113.784 -166.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.526 ' CD ' ' HG1' ' A' ' 28' ' ' THR 0.432 25.9 pt-20 -132.61 132.36 42.41 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 126.207 2.908 . . . . 3.3500000000000001 115.978 167.398 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 20.1 mm -74.59 107.31 5.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-N 112.072 -2.331 . . . . 2.0499999999999998 106.868 177.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -62.15 152.57 32.68 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.478 -1.237 . . . . 4.5099999999999998 108.899 172.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -58.38 -25.88 62.56 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 120.652 -1.28 . . . . 3.52 113.371 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -69.69 -34.65 74.22 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.1 0.96 . . . . 4.6900000000000004 113.403 171.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -79.22 -36.91 39.33 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.318 1.447 . . . . 1.8799999999999999 110.229 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -53.69 -35.71 61.4 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.012 1.325 . . . . 3.2000000000000002 112.201 174.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.9 m -56.03 -30.09 61.36 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 120.799 -1.188 . . . . 2.7200000000000002 113.458 170.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.5 t -71.37 -35.92 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.924 0.889 . . . . 3.3100000000000001 110.565 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -59.95 -50.29 74.32 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.75 0.82 . . . . 2.9399999999999999 111.925 176.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.03 -49.98 74.14 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.28 0.632 . . . . 3.8199999999999998 110.544 175.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.9 m -52.9 -52.65 56.88 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.302 1.441 . . . . 1.98 112.091 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 40.4 mtp -55.41 -48.27 74.65 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.388 1.075 . . . . 2.3599999999999999 112.284 178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.3 mt -66.6 -43.28 85.24 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.461 0.704 . . . . 2.5699999999999998 111.721 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 68.6 m -60.73 -33.72 73.34 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 118.293 -0.86 . . . . 2.1200000000000001 113.013 173.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 89.9 mtp -68.11 -34.97 77.38 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.627 1.103 . . . . 2.9500000000000002 112.481 172.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.47 -43.85 84.34 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 119.645 1.111 . . . . 2.1899999999999999 111.818 170.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -64.49 -24.03 67.48 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.555 0.946 . . . . 3.4300000000000002 113.555 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -67.41 -44.71 78.12 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.309 0.959 . . . . 3.0499999999999998 112.333 174.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -70.67 -46.01 63.99 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.584 1.554 . . . . 2.7799999999999998 111.393 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -51.55 -50.07 60.78 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.998 1.719 . . . . 3.1699999999999999 110.763 174.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -60.09 -29.02 68.31 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.197 1.399 . . . . 3.5600000000000001 112.906 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.8 mt -76.59 -15.47 59.84 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 118.207 -0.902 . . . . 2.23 113.12 178.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -104.31 -20.32 13.8 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 114.849 1.425 . . . . 3.0099999999999998 114.849 172.154 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 7.3 t70 . . . . . 0 N--CA 1.472 0.644 0 C-N-CA 126.973 2.109 . . . . 3.6200000000000001 113.45 -171.998 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.9 p . . . . . 0 C--O 1.238 0.488 0 CA-C-O 120.624 0.25 . . . . 3.0 110.405 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -62.64 -20.85 72.05 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 121.784 1.656 . . . . 1.79 111.943 167.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -76.47 -50.89 12.9 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.262 0.937 . . . . 3.77 111.143 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -52.89 -45.81 67.69 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 122.327 1.06 . . . . 4.5099999999999998 110.398 169.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 13.8 ttpt -63.0 -25.12 68.24 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.594 0.961 . . . . 6.0 113.594 176.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.6 -49.8 43.9 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.938 1.245 . . . . 2.1499999999999999 110.953 177.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 6.4 mp -61.65 -39.16 90.35 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.81 0.844 . . . . 3.5499999999999998 111.263 174.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 58.9 m -59.18 -50.76 72.79 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.412 1.485 . . . . 2.3199999999999998 110.954 174.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 89.1 m -61.43 -36.31 80.01 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.218 1.407 . . . . 1.99 110.706 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 1.6 ttp -56.24 -59.22 5.26 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.608 1.163 . . . . 4.5199999999999996 111.82 167.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 78.2 t -60.89 -31.79 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 CA-C-N 120.828 1.649 . . . . 2.9300000000000002 112.684 178.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 87.4 m -72.0 -49.87 33.46 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.337 1.455 . . . . 1.8700000000000001 111.895 -176.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 7.4 p -62.8 -38.09 89.32 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 118.377 -0.82 . . . . 2.3500000000000001 109.302 169.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -58.3 -57.77 11.42 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 118.936 -0.554 . . . . 3.46 110.74 -176.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -63.2 -36.67 84.42 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.582 1.083 . . . . 2.6200000000000001 112.599 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -76.77 -24.08 52.91 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.506 1.299 . . . . 6.0700000000000003 114.506 -176.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -91.34 -37.88 12.97 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 120.024 1.284 . . . . 3.1800000000000002 112.167 166.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 34.3 t -65.09 -28.64 69.59 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.416 -1.428 . . . . 2.73 112.53 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.2 6.92 82.49 Favored Glycine 0 CA--C 1.534 1.252 0 C-N-CA 125.615 1.579 . . . . 1.3600000000000001 114.828 176.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 45.7 mmt-85 -57.57 -41.98 82.18 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 119.455 1.627 . . . . 6.6399999999999997 111.76 170.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.437 ' CD ' ' HZ3' ' B' ' 32' ' ' LYS . 31.7 tt0 -145.12 136.93 25.56 Favored 'General case' 0 C--O 1.256 1.418 0 C-N-CA 126.568 1.947 . . . . 4.2199999999999998 111.405 178.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.03 -118.45 6.56 Favored Glycine 0 C--N 1.34 0.802 0 C-N-CA 127.479 2.466 . . . . 3.4100000000000001 113.148 162.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.5 m -47.72 122.45 4.92 Favored 'General case' 0 C--O 1.246 0.878 0 C-N-CA 125.093 1.357 . . . . 4.1200000000000001 112.057 170.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 15.1 pttm -106.64 4.14 27.61 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.023 1.729 . . . . 8.2200000000000006 114.811 -178.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -102.19 -2.09 29.97 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.589 1.555 . . . . 5.1200000000000001 113.011 169.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 7.7 p -137.89 147.02 44.06 Favored 'General case' 0 C--O 1.244 0.812 0 C-N-CA 128.677 2.791 . . . . 2.2200000000000002 111.539 -173.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -96.64 107.94 20.47 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.505 0.722 . . . . 3.5699999999999998 109.936 166.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.75 145.01 55.14 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.144 -0.687 . . . . 3.21 109.144 167.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 5.9 ttt-85 -41.69 -40.54 2.0 Allowed 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.654 1.581 . . . . 4.6100000000000003 114.748 -173.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.437 ' HZ3' ' CD ' ' B' ' 23' ' ' GLU . 2.9 ptmt -61.07 -43.56 98.7 Favored 'General case' 0 CA--C 1.555 1.148 0 N-CA-C 115.247 1.573 . . . . 5.7800000000000002 115.247 173.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -65.13 -49.6 69.3 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 127.58 2.352 . . . . 1.6299999999999999 107.697 176.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -55.04 -49.37 71.76 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.103 1.361 . . . . 3.6600000000000001 111.214 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -13.91 61.95 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 114.904 1.446 . . . . 5.8499999999999996 114.904 -175.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -84.21 -40.84 17.6 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 112.475 0.546 . . . . 3.1800000000000002 112.475 169.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 tt -50.9 -57.93 7.26 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.04 1.336 . . . . 2.9199999999999999 110.498 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 24.2 mt -59.1 -48.16 87.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 123.994 0.918 . . . . 2.4100000000000001 110.038 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.43 ' HZ3' ' CD ' ' B' ' 46' ' ' GLU . 16.4 tppt? -57.67 -21.51 40.56 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.966 1.306 . . . . 4.5499999999999998 112.986 -175.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 mttm -98.74 -42.62 7.13 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 114.32 1.23 . . . . 4.2300000000000004 114.32 165.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -50.83 -48.75 59.82 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 126.348 1.859 . . . . 5.0999999999999996 112.191 -177.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 73.1 mt -125.17 120.22 30.73 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.291 1.437 . . . . 3.6699999999999999 109.213 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 44.2 t -84.21 -76.0 0.32 Allowed 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 107.733 -1.21 . . . . 4.4800000000000004 107.733 160.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 76.6 mt 52.68 -105.14 0.22 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.468 1.107 . . . . 4.1699999999999999 111.531 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -102.05 7.22 54.6 Favored Glycine 0 N--CA 1.484 1.851 0 C-N-CA 125.537 1.541 . . . . 4.1100000000000003 114.828 172.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . 0.43 ' CD ' ' HZ3' ' B' ' 39' ' ' LYS . 0.7 OUTLIER 70.34 110.95 0.06 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 130.965 3.706 . . . . 8.5899999999999999 109.736 -170.942 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 84.6 mmm -58.73 -38.87 79.3 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.497 1.295 . . . . 2.8300000000000001 114.497 -174.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? 71.16 141.27 0.05 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.481 1.912 . . . . 4.6100000000000003 114.428 157.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -58.57 -31.47 68.03 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 119.922 -1.736 . . . . 3.73 112.043 -172.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 22.7 t -70.18 1.46 4.74 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 115.409 1.633 . . . . 4.0099999999999998 115.409 173.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 2.7 p -124.71 -41.62 2.12 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.259 0.936 . . . . 3.0699999999999998 111.959 157.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 84.6 mt -54.22 -41.91 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 124.434 1.094 . . . . 2.4199999999999999 112.696 -176.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -63.53 -34.54 78.01 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 119.429 1.013 . . . . 3.2000000000000002 111.733 -173.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -93.82 -35.13 12.88 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.878 1.671 . . . . 4.6900000000000004 113.585 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 7.1 tt -53.37 -42.4 66.83 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.702 1.201 . . . . 3.7599999999999998 110.146 169.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.7 -48.42 72.48 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.639 1.576 . . . . 2.9199999999999999 111.44 171.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 13.4 mttm -59.73 -37.32 78.63 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 119.527 1.058 . . . . 7.8799999999999999 111.641 173.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 5.0 t -65.66 -22.62 66.66 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.018 0.927 . . . . 2.3700000000000001 113.154 175.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 29.0 mt -77.64 -42.96 32.98 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.981 0.913 . . . . 3.3399999999999999 110.845 168.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -76.2 78.57 3.0 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.886 2.474 . . . . 1.8100000000000001 114.527 -162.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 65.6 mmtt -61.15 -13.1 15.21 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 115.505 1.669 . . . . 4.4699999999999998 115.505 -170.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -120.05 2.62 10.96 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.862 1.43 . . . . 2.9700000000000002 114.862 176.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 23.0 t 62.96 18.94 11.28 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.702 1.371 . . . . 3.4300000000000002 114.702 172.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 47.5 p-10 -79.7 -11.29 59.86 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.924 1.689 . . . . 2.1400000000000001 112.337 -177.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 67.43 16.98 10.09 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 130.565 3.546 . . . . 5.3099999999999996 113.613 -175.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -111.51 141.5 45.0 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.653 1.981 . . . . 2.27 107.846 165.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 50.4 mm -108.33 102.59 14.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 O-C-N 120.152 -1.592 . . . . 2.23 107.791 172.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . 0.474 ' HB3' ' H ' ' B' ' 70' ' ' LYS . 88.9 m-20 -47.38 153.78 0.48 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.074 0.549 . . . . 3.3300000000000001 110.661 168.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -47.47 -25.8 1.19 Allowed 'General case' 0 CA--C 1.555 1.138 0 CA-C-O 121.839 0.828 . . . . 3.6699999999999999 112.75 158.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.474 ' H ' ' HB3' ' B' ' 68' ' ' ASP . 6.7 ttpm? -86.85 -25.31 24.58 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 129.108 2.963 . . . . 4.9199999999999999 114.952 176.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -80.81 -43.71 19.64 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 119.935 1.243 . . . . 1.8200000000000001 108.57 169.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -50.65 -31.32 15.87 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 129.812 3.245 . . . . 3.02 115.659 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 30.9 t -53.23 -38.38 62.9 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.98 -1.075 . . . . 2.3700000000000001 112.124 171.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 57.4 t -67.24 -34.13 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 O-C-N 121.378 -0.826 . . . . 2.3599999999999999 111.294 -177.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -59.76 -62.74 1.65 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 118.35 0.523 . . . . 2.7999999999999998 110.892 175.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 52.4 mt -62.31 -30.53 71.21 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.202 0.601 . . . . 2.8199999999999998 112.327 -176.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 91.1 m -58.32 -47.8 82.57 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.741 0.816 . . . . 1.72 111.029 172.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 79.6 mtm -62.99 -38.21 90.26 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.017 0.826 . . . . 2.2200000000000002 112.803 177.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 62.9 mt -61.28 -46.09 91.77 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.422 0.555 . . . . 2.5299999999999998 110.503 173.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 97.1 m -60.84 -38.47 85.63 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.692 0.797 . . . . 3.2400000000000002 112.858 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 28.1 mmt -60.22 -41.41 93.02 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 118.854 0.752 . . . . 4.3399999999999999 111.941 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.91 -38.37 79.55 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.409 0.55 . . . . 1.8700000000000001 112.054 177.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -71.84 -24.28 61.67 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.025 1.12 . . . . 4.6200000000000001 114.025 177.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -65.05 -46.13 82.51 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.509 0.724 . . . . 3.8300000000000001 112.015 170.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.33 -44.49 91.38 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.58 1.552 . . . . 3.29 112.149 177.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -50.39 -48.96 55.71 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.025 1.73 . . . . 3.3599999999999999 111.734 177.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -64.83 -21.04 66.71 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.336 1.454 . . . . 3.8799999999999999 113.653 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 44.3 mt -84.24 -20.57 32.02 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.199 1.0 . . . . 2.2599999999999998 112.057 173.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -97.41 -10.15 26.02 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 115.074 1.509 . . . . 3.7599999999999998 115.074 174.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -88.36 -33.44 17.95 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.34 1.456 . . . . 2.8900000000000001 113.652 -177.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -80.05 -6.59 57.89 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 115.086 1.513 . . . . 6.3799999999999999 115.086 -174.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 114.902 -2.475 . . . . 5.0499999999999998 117.469 -158.189 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 . . . . . 0 N--CA 1.432 -1.334 0 N-CA-C 106.982 -1.488 . . . . 4.0999999999999996 106.982 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 70.6 p -49.03 149.38 3.37 Favored Pre-proline 0 N--CA 1.47 0.537 0 C-N-CA 125.989 1.716 . . . . 2.23 111.467 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -64.68 -23.13 63.73 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.25 1.966 . . . . 1.45 111.939 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.29 -44.25 46.69 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.858 1.263 . . . . 3.3799999999999999 111.865 174.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -53.24 -53.05 56.37 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.998 1.272 . . . . 4.7000000000000002 110.083 174.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 33.9 mtmt -61.98 -21.11 64.56 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 113.186 0.81 . . . . 5.2999999999999998 113.186 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.54 -45.24 31.51 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.82 0.848 . . . . 1.95 111.369 170.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.6 mt -58.23 -47.28 84.02 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.474 1.033 . . . . 2.5899999999999999 110.832 173.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -66.81 -37.49 84.62 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 116.348 -1.787 . . . . 3.5600000000000001 112.462 175.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 42.1 m -55.65 -42.97 75.79 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 121.415 1.916 . . . . 2.0899999999999999 110.875 170.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 57.5 mtp -63.88 -47.03 82.27 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.996 1.319 . . . . 4.0599999999999996 112.033 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.3 t -65.69 -31.65 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 O-C-N 121.075 -1.016 . . . . 3.1899999999999999 111.531 175.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 93.3 m -67.42 -56.58 9.07 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.565 1.146 . . . . 2.0499999999999998 110.617 -179.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.0 p -57.97 -42.54 85.26 Favored 'General case' 0 CA--C 1.512 -0.512 0 O-C-N 123.737 0.648 . . . . 2.7999999999999998 109.461 178.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -67.74 -55.29 13.67 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.779 0.674 . . . . 4.04 111.412 -176.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -65.48 -29.7 70.39 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.382 -0.824 . . . . 2.6899999999999999 112.353 -177.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp -70.76 -57.08 5.02 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.33 0.968 . . . . 6.5499999999999998 112.493 171.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 -67.71 -23.25 65.25 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.623 1.101 . . . . 3.4399999999999999 113.135 -178.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.3 t -62.99 -19.77 64.65 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.402 1.26 . . . . 2.7400000000000002 114.402 172.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.04 33.55 6.35 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 126.709 2.099 . . . . 1.45 113.428 171.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -114.05 28.92 8.39 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.821 1.648 . . . . 6.9500000000000002 112.57 173.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.472 ' HG2' ' H ' ' A' ' 24' ' ' GLY . 4.1 tt0 126.8 -159.83 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.091 1 C-N-CA 132.666 4.387 . . . . 4.3399999999999999 110.26 171.968 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.472 ' H ' ' HG2' ' A' ' 23' ' ' GLU . . . 51.26 -141.24 21.84 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 124.876 1.227 . . . . 2.8199999999999998 111.622 -170.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.8 t -86.86 179.7 6.68 Favored 'General case' 0 C--O 1.249 1.04 0 CA-C-O 122.203 1.001 . . . . 2.9500000000000002 111.786 158.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -104.44 140.88 37.31 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.434 2.294 . . . . 5.54 108.705 166.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 9.7 tp 90.72 -18.26 0.17 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 131.063 3.745 . . . . 4.5499999999999998 110.98 -159.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.6 p -112.45 152.94 28.12 Favored 'General case' 0 C--O 1.246 0.898 0 C-N-CA 125.745 1.618 . . . . 2.2799999999999998 114.957 177.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.9 mt -107.58 105.83 15.91 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.177 1.391 . . . . 2.5099999999999998 111.687 163.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.9 t -62.0 160.98 11.42 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.78 1.232 . . . . 2.5899999999999999 111.227 163.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.4 ttm-85 -46.56 -21.88 0.23 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 126.465 1.906 . . . . 4.2199999999999998 114.906 -178.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.419 ' HZ2' ' CD ' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -95.88 -38.65 10.18 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.126 1.37 . . . . 4.7800000000000002 112.854 -178.835 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -61.11 -46.46 90.51 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.693 1.197 . . . . 1.4399999999999999 109.559 172.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.7 tp -66.38 -49.43 66.9 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.53 0.732 . . . . 2.98 111.398 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.1 ttmt -61.66 -37.17 83.06 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 113.15 0.796 . . . . 4.25 113.15 -177.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.461 ' CD ' ' HZ1' ' A' ' 40' ' ' LYS . 5.1 tp10 -57.63 -58.53 7.94 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.764 0.825 . . . . 3.75 112.317 164.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.4 tp -53.29 -54.67 33.01 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.744 1.217 . . . . 3.3199999999999998 112.909 -174.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.3 mt -60.17 -33.65 54.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 118.332 0.515 . . . . 2.3100000000000001 110.896 -174.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.484 ' HZ2' ' CD ' ' A' ' 46' ' ' GLU . 23.9 mmmt -67.52 -12.27 59.94 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 121.096 -1.002 . . . . 4.0599999999999996 113.138 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.461 ' HZ1' ' CD ' ' A' ' 36' ' ' GLU . 59.3 mmtt -92.66 -19.65 21.64 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.12 1.368 . . . . 3.3599999999999999 111.757 173.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -91.69 -93.12 0.14 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.632 1.973 . . . . 4.3600000000000003 106.589 178.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -75.52 24.99 0.11 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 128.901 2.88 . . . . 3.0800000000000001 114.544 -161.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 18.4 t -54.81 -25.68 29.83 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.64 -1.287 . . . . 3.6000000000000001 113.237 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.11 -21.43 66.35 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.83 1.652 . . . . 5.04 115.332 178.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -108.51 -28.28 4.64 Favored Glycine 0 N--CA 1.476 1.305 0 C-N-CA 124.752 1.168 . . . . 4.71 112.236 163.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.484 ' CD ' ' HZ2' ' A' ' 39' ' ' LYS . 0.2 OUTLIER 83.72 139.59 0.06 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 129.411 3.085 . . . . 7.9299999999999997 111.644 170.001 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.6 mmt -109.07 105.51 15.03 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.51 1.524 . . . . 3.3599999999999999 111.151 -173.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -89.91 164.18 14.68 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.146 1.378 . . . . 5.6100000000000003 110.891 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.412 ' CD ' ' H ' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -50.25 -50.06 51.22 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 120.997 -1.064 . . . . 5.9100000000000001 111.41 167.416 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.1 t -72.23 41.13 0.08 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.438 1.495 . . . . 4.04 113.136 168.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.0 m -160.29 -41.42 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.884 1.674 . . . . 2.96 112.66 177.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 33.8 mt -72.3 -38.73 62.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 119.367 0.985 . . . . 3.2599999999999998 112.086 -174.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -80.56 -23.1 40.18 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.757 0.823 . . . . 3.8100000000000001 112.016 -175.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -78.62 -38.99 38.51 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.283 0.633 . . . . 2.7000000000000002 111.673 165.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.79 -44.97 86.65 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.601 -0.714 . . . . 3.77 109.509 169.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.2 ttt -58.94 -41.97 88.65 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.306 0.957 . . . . 2.3500000000000001 112.039 173.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.98 -24.63 67.79 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 119.363 0.983 . . . . 5.1200000000000001 112.77 172.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 t -74.06 -33.18 63.61 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 120.48 -1.388 . . . . 3.0699999999999998 112.37 170.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.7 mp -80.75 -51.75 8.3 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 125.111 1.365 . . . . 3.8199999999999998 112.816 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -72.69 135.55 45.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.753 0.787 . . . . 1.72 111.886 -178.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.51 -40.45 5.11 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.568 1.547 . . . . 4.4800000000000004 111.939 178.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 43.4 p-10 -92.93 -11.16 34.06 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 116.389 1.996 . . . . 3.1299999999999999 116.389 -169.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.7 t 76.02 29.96 0.75 Allowed 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.881 1.672 . . . . 3.7999999999999998 113.556 174.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.9 p-10 -90.31 -14.28 33.51 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 126.578 1.951 . . . . 2.3500000000000001 112.691 -176.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 76.27 13.08 2.61 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 128.71 2.804 . . . . 4.4900000000000002 115.674 -174.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -133.91 132.08 39.84 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.557 2.343 . . . . 2.8199999999999998 109.355 -176.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 18.1 mm -98.99 107.84 21.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 120.572 -1.33 . . . . 2.0099999999999998 109.979 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -63.59 161.53 14.55 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.97 0.805 . . . . 3.8100000000000001 112.782 170.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -48.78 -37.39 18.98 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 122.519 1.152 . . . . 3.9399999999999999 112.21 169.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.17 -22.84 48.06 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 116.181 1.919 . . . . 7.5800000000000001 116.181 174.344 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -78.91 -51.12 10.11 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.398 1.454 . . . . 1.8799999999999999 109.07 170.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -50.25 -22.58 1.81 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 128.055 2.542 . . . . 3.0600000000000001 113.418 175.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.3 m -53.59 -32.51 51.34 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.58 -1.325 . . . . 2.9399999999999999 113.309 170.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 p -75.46 -25.79 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 122.967 0.507 . . . . 3.0699999999999998 111.856 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -63.36 -60.65 3.1 Favored 'General case' 0 C--N 1.343 0.299 0 CA-C-O 118.426 -0.797 . . . . 3.0299999999999998 109.968 172.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -51.93 -46.65 64.76 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.999 0.92 . . . . 4.1500000000000004 111.328 -178.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 56.3 m -55.06 -58.81 6.12 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.906 1.282 . . . . 2.1400000000000001 112.239 176.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 61.0 ttp -59.07 -43.82 91.81 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.633 0.773 . . . . 3.5 111.217 -178.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.22 -46.59 80.01 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.535 1.134 . . . . 3.8100000000000001 111.647 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 67.8 m -63.92 -40.92 97.58 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.157 0.583 . . . . 3.46 112.307 176.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 59.5 mtp -62.88 -39.33 94.12 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.631 0.65 . . . . 2.7599999999999998 112.029 172.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.01 -37.04 86.31 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.373 0.669 . . . . 2.4900000000000002 112.554 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -64.03 -28.03 69.52 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.847 1.054 . . . . 3.7200000000000002 113.847 173.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -65.86 -40.5 91.73 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 120.167 1.349 . . . . 2.8999999999999999 111.971 172.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -72.7 -39.52 66.92 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.687 0.795 . . . . 3.2999999999999998 111.697 178.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -52.78 -46.16 67.46 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.037 1.335 . . . . 5.3799999999999999 111.298 172.081 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -62.97 -27.25 69.27 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.488 1.515 . . . . 4.1200000000000001 113.228 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 37.5 mt -80.96 -21.43 40.38 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.543 1.137 . . . . 3.4100000000000001 112.452 176.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -91.12 -10.24 42.66 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 115.142 1.534 . . . . 3.77 115.142 172.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.9 t70 . . . . . 0 N--CA 1.47 0.566 0 C-N-CA 125.737 1.615 . . . . 3.7799999999999998 112.719 169.344 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 6.4 p . . . . . 0 C--O 1.237 0.417 0 CA-C-O 119.09 -0.481 . . . . 3.5600000000000001 110.26 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -69.83 -33.14 16.93 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 121.215 1.277 . . . . 2.1699999999999999 112.907 -172.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.01 -39.88 68.88 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.085 0.857 . . . . 3.6299999999999999 112.222 -172.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.93 -33.78 67.34 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.595 1.089 . . . . 4.1100000000000003 112.279 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -68.51 -32.28 72.13 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 120.678 -1.264 . . . . 5.5300000000000002 112.522 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -69.04 -51.58 37.55 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.421 1.088 . . . . 1.79 110.201 175.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 57.5 mt -54.28 -46.19 72.66 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.584 1.154 . . . . 3.0299999999999998 111.769 174.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 64.4 m -56.65 -52.39 65.08 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.04 0.936 . . . . 2.1200000000000001 111.181 172.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 51.7 m -55.49 -44.23 76.33 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.659 1.184 . . . . 2.1000000000000001 111.471 -175.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 9.7 mtt -57.68 -51.77 68.18 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.062 0.945 . . . . 4.2000000000000002 111.731 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 76.3 t -64.29 -43.59 97.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 124.204 1.001 . . . . 3.0499999999999998 112.067 178.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 31.3 m -55.6 -58.04 9.44 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.787 1.635 . . . . 2.52 110.248 178.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.48 -37.85 74.29 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 117.406 -1.283 . . . . 3.3399999999999999 109.571 -174.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -57.34 -48.0 80.11 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 118.945 0.793 . . . . 3.6000000000000001 111.003 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.12 -31.97 71.92 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 118.684 0.674 . . . . 2.8300000000000001 111.337 178.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 39.0 tttm -69.74 -32.67 71.34 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.304 1.224 . . . . 5.5300000000000002 114.304 173.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.405 ' HH ' ' CB ' ' B' ' 40' ' ' LYS . 69.5 m-85 -71.52 -31.55 67.19 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.763 1.225 . . . . 4.8499999999999996 111.569 166.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 40.3 t -70.82 -35.16 72.37 Favored 'General case' 0 C--O 1.244 0.785 0 C-N-CA 125.793 1.637 . . . . 2.2599999999999998 114.86 -176.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.17 7.41 67.47 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 125.375 1.464 . . . . 2.2000000000000002 113.774 167.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.43 -14.9 59.6 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.224 1.512 . . . . 4.5899999999999999 113.496 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.507 ' HG2' ' H ' ' B' ' 24' ' ' GLY 0.281 3.5 tm-20 164.0 -167.46 0.01 OUTLIER 'General case' 0 CA--C 1.564 1.502 0 C-N-CA 130.666 3.586 . . . . 3.6600000000000001 109.712 -176.868 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . 0.507 ' H ' ' HG2' ' B' ' 23' ' ' GLU . . . 58.47 -149.07 36.8 Favored Glycine 0 N--CA 1.467 0.751 0 C-N-CA 126.17 1.843 . . . . 3.8900000000000001 112.316 -174.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 41.4 t -66.92 154.73 40.32 Favored 'General case' 0 C--O 1.249 1.071 0 O-C-N 121.27 -1.135 . . . . 3.5600000000000001 110.274 153.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.0 1.09 37.19 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.415 1.486 . . . . 7.0499999999999998 112.67 177.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 57.8 tp -92.61 -30.11 15.78 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.365 1.466 . . . . 4.5800000000000001 112.239 174.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' THR . . . . . 0.423 ' HG1' ' CD ' ' B' ' 66' ' ' GLU . 16.6 p -128.32 167.38 17.02 Favored 'General case' 0 C--O 1.252 1.202 0 C-N-CA 128.703 2.801 . . . . 2.0499999999999998 113.679 -163.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 10.5 mt -101.35 114.03 27.64 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.07 1.748 . . . . 2.5 110.972 167.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 2.0 p -69.58 165.58 20.79 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.138 -0.976 . . . . 3.6899999999999999 112.935 166.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -41.8 -30.4 0.25 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.905 1.282 . . . . 4.5800000000000001 114.271 169.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.1 -42.96 10.8 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 119.92 -1.738 . . . . 7.2400000000000002 113.082 178.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -52.65 -44.17 65.96 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.621 0.769 . . . . 1.8899999999999999 110.663 167.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.93 -42.99 97.22 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.427 1.891 . . . . 3.6000000000000001 112.404 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -56.45 -40.94 75.64 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 120.274 -1.516 . . . . 3.5499999999999998 112.457 170.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -68.28 -43.53 77.53 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 117.974 -1.012 . . . . 3.1400000000000001 112.127 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.0 tp -51.41 -61.22 2.38 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 125.294 1.438 . . . . 3.1099999999999999 108.665 173.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 24.5 mt -54.3 -45.23 67.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 CA-C-N 118.739 0.7 . . . . 2.1699999999999999 109.85 -173.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -72.65 -31.72 65.32 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.223 0.609 . . . . 5.8499999999999996 111.751 -172.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . 0.405 ' CB ' ' HH ' ' B' ' 19' ' ' TYR . 36.6 mttp -89.25 -28.16 20.11 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 120.624 -1.298 . . . . 4.21 113.696 178.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -65.83 -61.42 2.07 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.768 1.627 . . . . 5.7199999999999998 110.654 166.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.49 101.46 5.63 Favored 'General case' 0 C--N 1.342 0.253 0 C-N-CA 124.601 1.16 . . . . 3.1299999999999999 108.454 -178.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 5.2 t -70.4 30.82 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 114.557 1.318 . . . . 4.7199999999999998 114.557 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 70.1 mt -118.25 -15.53 9.76 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.158 1.783 . . . . 4.2000000000000002 112.959 -163.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 104.24 -118.84 6.08 Favored Glycine 0 C--N 1.34 0.761 0 C-N-CA 124.454 1.026 . . . . 5.3899999999999997 112.62 177.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -92.5 111.3 22.84 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 113.328 0.862 . . . . 8.4299999999999997 113.328 -164.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 84.0 mmm -65.5 -28.52 69.25 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.823 0.82 . . . . 4.1900000000000004 112.07 155.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 tptt 72.3 144.09 0.07 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.875 2.87 . . . . 7.1900000000000004 111.303 -174.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 20.4 tp10 -49.61 -43.84 46.8 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.268 1.027 . . . . 4.5 113.55 -168.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 24.8 t -66.95 -7.95 25.98 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.316 1.598 . . . . 3.7400000000000002 115.316 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 12.3 t -105.5 -6.49 19.37 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 120.072 1.306 . . . . 2.8500000000000001 113.228 167.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 45.0 mm -73.55 -44.4 53.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 CA-C-N 120.172 1.351 . . . . 2.8900000000000001 110.718 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -71.13 -29.88 65.79 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.812 0.845 . . . . 2.98 112.632 -178.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.428 ' CG ' ' HZ1' ' B' ' 57' ' ' LYS . 11.3 t70 -71.81 -44.58 63.69 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.847 1.203 . . . . 3.6899999999999999 111.396 167.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.78 -49.61 70.5 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.832 0.742 . . . . 3.29 109.266 176.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 14.8 tpt -54.01 -51.32 64.35 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.794 1.638 . . . . 2.6299999999999999 112.806 173.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . 0.428 ' HZ1' ' CG ' ' B' ' 54' ' ' ASP . 0.9 OUTLIER -55.8 -39.33 71.17 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.571 1.548 . . . . 5.9800000000000004 112.195 173.931 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 30.5 m -74.48 -22.72 58.94 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.466 1.506 . . . . 2.5 110.664 -177.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 9.1 mt -83.17 -56.68 3.64 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.317 0.962 . . . . 2.75 113.212 169.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -70.82 139.57 50.96 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.877 0.695 . . . . 1.6599999999999999 112.877 -165.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 37.6 mmtm -135.02 -9.72 2.3 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.623 1.569 . . . . 4.8899999999999997 114.35 -175.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.23 -20.83 50.97 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.913 0.779 . . . . 3.04 110.884 164.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 22.7 t 72.48 41.13 0.6 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.563 1.945 . . . . 3.1800000000000002 110.82 -178.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -114.43 -125.52 0.28 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.421 1.488 . . . . 3.2400000000000002 108.54 -167.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -144.04 -2.52 0.91 Allowed 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 116.753 2.131 . . . . 4.4699999999999998 116.753 165.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . 0.423 ' CD ' ' HG1' ' B' ' 28' ' ' THR . 25.4 mt-10 -113.66 141.82 46.76 Favored 'General case' 0 C--O 1.244 0.812 0 C-N-CA 125.853 1.661 . . . . 2.8500000000000001 111.291 177.027 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 45.1 mm -89.9 111.17 22.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 127.948 2.499 . . . . 2.2999999999999998 109.846 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.94 159.27 33.01 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 128.092 2.557 . . . . 2.54 111.278 162.061 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -54.08 -35.39 62.03 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.256 1.206 . . . . 3.3599999999999999 114.256 -176.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -71.85 -36.38 70.12 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.71 -1.244 . . . . 4.2699999999999996 111.42 177.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -64.11 -51.78 62.32 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 124.344 1.058 . . . . 1.6799999999999999 109.259 171.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -52.05 -43.4 63.78 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.531 1.532 . . . . 3.3500000000000001 113.309 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 35.8 m -62.91 -21.08 65.77 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.354 -0.841 . . . . 3.5299999999999998 113.098 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 21.2 t -64.24 -40.11 87.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 CA-C-N 119.496 1.044 . . . . 2.6499999999999999 110.661 170.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -59.19 -55.43 35.02 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 118.753 0.706 . . . . 2.9100000000000001 110.665 177.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 66.9 mt -57.77 -38.28 75.16 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.581 1.152 . . . . 2.2999999999999998 110.781 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 99.8 m -61.91 -50.06 73.71 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.179 0.992 . . . . 1.8300000000000001 112.303 173.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.9 mtm -64.57 -37.39 87.4 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 119.559 1.072 . . . . 2.46 112.18 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -60.93 -52.63 64.23 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.63 0.772 . . . . 3.8199999999999998 111.953 172.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 93.8 m -63.86 -35.89 82.14 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.389 0.514 . . . . 3.1200000000000001 112.389 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 49.2 mmm -60.73 -42.92 98.27 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.721 0.808 . . . . 3.27 112.834 170.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.6 -33.64 71.26 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.518 1.053 . . . . 1.9099999999999999 112.003 176.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -69.82 -23.67 63.35 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.022 1.119 . . . . 3.4500000000000002 114.022 175.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -55.29 -49.6 71.71 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 120.561 1.528 . . . . 3.1800000000000002 111.056 166.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.16 -36.44 58.72 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.103 1.761 . . . . 3.04 112.196 -174.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -54.82 -47.14 74.44 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.217 1.407 . . . . 3.3900000000000001 111.281 166.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -67.18 -25.82 66.33 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.474 1.11 . . . . 3.1800000000000002 112.941 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 71.6 mt -78.2 -26.83 47.71 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 118.112 -0.947 . . . . 2.2799999999999998 112.824 174.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -97.39 10.94 38.34 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.561 1.544 . . . . 3.71 114.263 174.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -93.56 -54.36 3.69 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.739 1.215 . . . . 3.1200000000000001 112.047 162.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -82.66 37.73 0.54 Allowed 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 125.866 1.666 . . . . 3.1400000000000001 112.721 -176.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.26 1.607 0 N-CA-C 118.896 2.924 . . . . 5.5700000000000003 118.896 -145.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 . . . . . 0 C--O 1.238 0.48 0 N-CA-C 105.787 -1.931 . . . . 4.0 105.787 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 79.4 p -60.93 162.7 11.68 Favored Pre-proline 0 C--N 1.325 -0.483 0 C-N-CA 126.077 1.751 . . . . 2.3799999999999999 113.869 -170.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -61.8 -18.52 61.19 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.421 2.081 . . . . 1.5 112.504 164.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.12 -45.37 34.05 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.508 1.049 . . . . 3.1800000000000002 110.562 175.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -61.32 -37.9 84.93 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.905 -1.122 . . . . 4.5599999999999996 111.148 172.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -69.79 -31.54 69.52 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.019 -1.05 . . . . 4.0899999999999999 112.971 172.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.67 -48.52 66.41 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.743 1.217 . . . . 1.8700000000000001 111.603 173.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 74.6 mt -57.85 -47.38 82.86 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.89 1.276 . . . . 2.48 110.66 172.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 89.2 m -54.13 -48.48 70.76 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.113 1.365 . . . . 2.7200000000000002 111.8 172.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 92.1 m -66.55 -35.82 81.16 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.968 1.307 . . . . 2.0499999999999998 111.553 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -45.69 66.94 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.717 0.807 . . . . 5.1500000000000004 111.699 176.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.2 p -65.31 -29.72 48.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 119.355 0.98 . . . . 3.21 112.234 171.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 55.3 m -63.83 -54.77 29.88 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 117.654 -1.165 . . . . 1.9199999999999999 111.074 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.6 p -60.01 -36.64 77.66 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 119.525 1.057 . . . . 2.5699999999999998 110.481 174.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -68.06 -54.55 17.47 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 119.379 -0.928 . . . . 3.21 110.928 -175.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.43 ' CD2' ' HZ3' ' A' ' 26' ' ' LYS . 4.9 t60 -64.67 -29.44 70.44 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.921 0.888 . . . . 2.7400000000000002 113.276 -179.139 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 58.4 tttt -62.95 -70.84 0.18 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 127.537 2.335 . . . . 5.7599999999999998 112.579 166.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -65.68 -24.85 67.11 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.136 -0.978 . . . . 3.3700000000000001 112.099 -172.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.449 ' HG ' ' C ' ' A' ' 27' ' ' LEU . 46.7 t -60.21 -26.68 66.58 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 114.9 1.444 . . . . 2.4199999999999999 114.9 170.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -95.37 5.86 67.99 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 125.802 1.668 . . . . 1.3600000000000001 114.083 175.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.43 -44.74 92.83 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.96 1.38 . . . . 4.5300000000000002 111.462 172.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -146.69 161.05 41.4 Favored 'General case' 0 C--O 1.253 1.28 0 CA-C-O 123.49 1.614 . . . . 4.6799999999999997 113.24 176.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.18 -128.57 47.73 Favored Glycine 0 C--N 1.34 0.77 0 C-N-CA 126.944 2.211 . . . . 2.3199999999999998 111.733 164.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.0 m -52.72 125.27 16.17 Favored 'General case' 0 C--O 1.245 0.822 0 C-N-CA 123.189 0.595 . . . . 3.1600000000000001 110.33 166.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.43 ' HZ3' ' CD2' ' A' ' 17' ' ' HIS . 3.6 tmtm? -83.33 -2.88 56.79 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.223 1.009 . . . . 5.9800000000000004 113.328 176.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.449 ' C ' ' HG ' ' A' ' 20' ' ' SER . 9.8 mp -89.88 -34.13 16.2 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.878 2.071 . . . . 5.0800000000000001 111.691 174.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.413 ' HG1' ' CD ' ' A' ' 66' ' ' GLU . 0.9 OUTLIER -126.98 163.52 23.51 Favored 'General case' 0 C--O 1.254 1.313 0 C-N-CA 127.661 2.384 . . . . 2.3500000000000001 114.874 -167.042 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -109.35 105.63 15.1 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 127.582 2.353 . . . . 3.9199999999999999 112.097 -171.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.7 t -84.42 164.45 18.87 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.789 2.036 . . . . 2.4500000000000002 112.057 175.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.1 tmm_? -60.96 -22.15 64.16 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 116.509 2.04 . . . . 6.0499999999999998 116.509 -161.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.62 -41.27 16.54 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 120.635 -1.291 . . . . 6.71 111.901 166.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -54.46 -49.97 68.81 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 120.302 1.41 . . . . 1.4299999999999999 110.532 175.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -65.64 -45.84 81.5 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.956 1.703 . . . . 3.9399999999999999 112.452 -177.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.255 1.1 ptmt -73.0 -32.69 65.31 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 118.111 -1.436 . . . . 4.3499999999999996 112.67 176.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -61.9 -44.34 96.99 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.434 1.47 . . . . 3.5299999999999998 112.97 171.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.9 tp -51.64 -64.96 0.65 Allowed 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 126.292 1.837 . . . . 3.1400000000000001 110.161 170.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 84.6 mt -55.44 -45.56 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-O 118.349 -0.834 . . . . 2.1000000000000001 111.641 -176.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.418 ' HZ1' ' CD ' ' A' ' 49' ' ' GLU . 24.2 mmmt -55.32 -28.74 55.68 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 118.69 0.677 . . . . 4.3600000000000003 112.69 -174.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -97.52 -34.42 11.0 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.472 1.909 . . . . 4.1900000000000004 113.286 -173.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -85.28 -50.43 7.36 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.357 0.663 . . . . 5.3399999999999999 111.616 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.9 mp -92.76 54.89 2.31 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.678 1.591 . . . . 4.4299999999999997 109.518 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.5 t -79.67 35.92 0.31 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.506 1.122 . . . . 3.7400000000000002 113.586 -166.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -91.9 -8.59 45.93 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 116.76 2.133 . . . . 4.8300000000000001 116.76 -161.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 97.86 1.71 58.55 Favored Glycine 0 N--CA 1.474 1.202 0 CA-C-N 119.179 0.899 . . . . 3.5299999999999998 114.437 -176.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.7 -152.4 0.29 Allowed 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 107.941 -1.133 . . . . 6.6500000000000004 107.941 143.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.88 39.48 20.35 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 124.165 1.936 . . . . 2.7000000000000002 110.736 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -74.52 141.71 44.83 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 112.396 -2.184 . . . . 5.3300000000000001 109.586 174.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.418 ' CD ' ' HZ1' ' A' ' 39' ' ' LYS . 2.0 mm-40 -52.1 -39.92 60.51 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.799 1.778 . . . . 4.46 115.799 -148.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.1 p -78.4 -28.87 46.95 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 115.337 1.606 . . . . 3.54 115.337 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.3 t -56.25 -30.77 62.85 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.999 1.32 . . . . 2.3599999999999999 110.99 172.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 3.1 mt -74.68 -25.56 19.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 C-N-CA 124.141 0.976 . . . . 2.8599999999999999 112.497 -176.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -86.81 -30.33 21.59 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.627 0.649 . . . . 3.6099999999999999 111.642 178.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -71.82 -34.51 69.38 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.193 0.906 . . . . 2.8199999999999998 111.621 167.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 53.8 tp -61.28 -52.59 64.1 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 117.34 -1.314 . . . . 2.8700000000000001 110.15 165.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.2 ttt -53.33 -48.87 68.1 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 121.421 1.919 . . . . 2.3599999999999999 112.112 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.69 -29.83 8.14 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.779 1.632 . . . . 4.2699999999999996 113.361 174.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 50.2 m -93.49 -29.01 15.76 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.278 1.831 . . . . 3.3799999999999999 112.486 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.4 mt -78.66 -30.45 46.25 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.253 1.021 . . . . 3.1699999999999999 112.596 175.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -73.02 70.63 1.05 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.394 1.477 . . . . 1.3799999999999999 110.769 175.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.3 ttmp? -50.97 -29.61 12.74 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 115.602 1.705 . . . . 5.0599999999999996 115.602 -162.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -95.15 -18.98 20.47 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 115.495 1.665 . . . . 3.4900000000000002 115.495 175.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 59.96 108.94 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.363 1.465 . . . . 3.8500000000000001 112.221 -153.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.4 p30 -140.0 -78.73 0.31 Allowed 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.962 -1.086 . . . . 2.8399999999999999 110.405 173.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -166.81 -28.79 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 130.615 3.566 . . . . 6.5099999999999998 112.218 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.413 ' CD ' ' HG1' ' A' ' 28' ' ' THR . 15.5 pt-20 -154.4 166.79 32.13 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.564 1.145 . . . . 3.21 112.81 -173.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 6.9 mm -98.07 108.78 22.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 125.275 1.43 . . . . 2.2200000000000002 112.376 -170.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -74.67 159.13 32.47 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.814 1.646 . . . . 2.7000000000000002 111.665 165.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -46.38 -45.99 18.17 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.124 -1.61 . . . . 3.9900000000000002 113.281 170.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.4 pttm -72.53 -6.59 45.01 Favored 'General case' 0 CA--C 1.55 0.964 0 O-C-N 121.329 -0.857 . . . . 3.7999999999999998 113.282 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -91.42 -61.26 1.69 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.359 1.464 . . . . 1.5900000000000001 109.34 163.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -54.84 -22.96 16.23 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 128.019 2.528 . . . . 4.3099999999999996 115.497 -175.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.45 -30.68 20.51 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 124.986 1.315 . . . . 2.8199999999999998 112.484 167.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.2 p -69.16 -36.26 72.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 119.083 0.856 . . . . 3.4199999999999999 112.184 176.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -60.98 -48.14 83.2 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 118.966 0.803 . . . . 3.5899999999999999 111.317 174.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 73.0 mt -63.21 -36.13 82.61 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.78 0.832 . . . . 3.0099999999999998 111.573 177.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 57.8 m -66.2 -47.12 74.93 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.573 1.149 . . . . 1.71 111.228 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.9 mtp -57.41 -43.35 83.7 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.826 1.25 . . . . 2.8799999999999999 111.705 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 72.8 mt -67.8 -45.02 75.95 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.595 0.758 . . . . 2.5800000000000001 111.725 178.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 5.4 m -59.84 -34.79 73.56 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.547 1.067 . . . . 2.1699999999999999 113.749 174.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 56.3 mtp -72.44 -34.19 67.62 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.438 0.563 . . . . 3.4100000000000001 112.026 174.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.34 -47.07 68.47 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.591 -0.693 . . . . 1.8899999999999999 112.499 175.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -68.83 -26.63 65.26 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.361 -0.837 . . . . 3.75 113.147 176.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -63.86 -49.75 71.54 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.679 0.791 . . . . 2.9100000000000001 111.902 168.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -60.84 -46.4 90.72 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.319 1.048 . . . . 3.29 111.878 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -50.26 -50.87 48.81 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.559 1.544 . . . . 3.25 111.494 175.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -64.28 -26.58 68.56 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.197 1.399 . . . . 3.2599999999999998 113.201 -177.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 32.5 mt -78.01 -18.91 55.35 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.812 0.845 . . . . 2.23 111.926 175.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -91.9 -36.76 13.29 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.165 1.386 . . . . 3.4100000000000001 113.811 173.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 . . . . . 0 CA--C 1.542 0.636 0 C-N-CA 126.399 1.88 . . . . 3.46 113.607 177.021 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.5 p . . . . . 0 N--CA 1.472 0.656 0 N-CA-C 113.733 1.012 . . . . 2.5499999999999998 113.733 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -52.0 -23.14 16.09 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 124.529 3.486 . . . . 1.8200000000000001 114.954 163.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 56.1 tp -70.41 -48.64 55.13 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 120.092 1.314 . . . . 3.6600000000000001 110.29 174.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.09 -30.65 70.48 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.308 0.504 . . . . 4.8399999999999999 111.203 172.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 21.9 mmtt -66.27 -25.57 66.93 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 119.717 -1.864 . . . . 5.2599999999999998 113.126 169.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.28 -45.32 73.42 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 119.9 1.227 . . . . 1.79 111.613 172.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -60.56 -43.2 97.51 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.711 1.204 . . . . 3.98 111.655 170.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 25.9 m -57.32 -47.15 82.29 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.192 1.397 . . . . 2.0600000000000001 111.496 173.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 87.0 m -58.68 -44.29 90.18 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.223 1.009 . . . . 2.0299999999999998 109.867 175.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 3.0 tpp -53.83 -51.47 63.44 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.292 1.037 . . . . 4.6500000000000004 112.61 177.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 10.6 m -67.6 -27.65 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 CA-C-N 118.801 0.728 . . . . 3.4500000000000002 112.511 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 66.2 m -68.34 -47.13 68.31 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.538 1.135 . . . . 1.8700000000000001 110.93 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.91 -40.63 89.5 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.159 0.584 . . . . 2.29 110.007 166.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -63.66 -55.75 21.06 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 120.276 -0.57 . . . . 3.1800000000000002 111.355 -169.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 18.7 m170 -62.35 -35.39 78.97 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.454 0.701 . . . . 4.0499999999999998 112.344 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -74.59 -29.85 61.48 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.489 0.922 . . . . 5.1100000000000003 113.489 -175.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -94.95 -37.55 11.1 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.994 1.318 . . . . 3.48 112.426 175.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 84.1 p -57.65 -33.27 68.11 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.777 1.171 . . . . 2.2599999999999998 112.666 176.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.88 -3.4 73.75 Favored Glycine 0 CA--C 1.528 0.901 0 CA-C-O 116.378 -2.345 . . . . 1.3400000000000001 116.282 -170.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -65.29 -39.65 92.83 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.779 2.29 . . . . 5.6299999999999999 112.338 178.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -122.0 126.87 49.5 Favored 'General case' 0 C--O 1.254 1.298 0 C-N-CA 129.074 2.949 . . . . 3.3599999999999999 110.46 176.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.98 -128.55 42.6 Favored Glycine 0 C--N 1.337 0.61 0 C-N-CA 126.059 1.79 . . . . 2.4399999999999999 113.646 166.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -52.04 148.11 6.52 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.373 2.669 . . . . 4.0099999999999998 114.194 172.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -106.82 -6.32 17.79 Favored 'General case' 0 CA--C 1.553 1.059 0 N-CA-C 114.45 1.278 . . . . 7.25 114.45 -175.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 97.0 mt -99.49 3.56 45.66 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.926 1.29 . . . . 4.29 113.005 175.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 2.0 p -145.64 137.95 25.6 Favored 'General case' 0 C--O 1.246 0.871 0 C-N-CA 125.667 1.587 . . . . 2.3500000000000001 111.938 -166.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 48.4 mt -84.45 126.97 33.74 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 114.605 -1.18 . . . . 2.8300000000000001 109.926 173.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 3.1 m -105.92 150.34 25.75 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 127.037 2.135 . . . . 3.6099999999999999 110.291 -168.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 5.6 mmm-85 -37.61 -46.69 0.88 Allowed 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 117.095 2.258 . . . . 5.2999999999999998 117.095 -165.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.71 -34.23 22.97 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 119.604 1.093 . . . . 4.9000000000000004 112.635 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -50.02 -36.54 29.07 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.386 0.994 . . . . 1.8300000000000001 111.087 165.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.34 -37.98 74.77 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 112.606 0.595 . . . . 3.6699999999999999 112.606 -174.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 26.7 mmtm -63.91 -44.08 94.02 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.646 1.178 . . . . 6.4699999999999998 111.777 171.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 36.2 tp10 -74.5 -15.24 60.88 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 125.56 1.544 . . . . 3.0600000000000001 112.812 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 44.7 tp -96.85 -52.17 3.99 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 120.964 1.711 . . . . 3.3799999999999999 111.831 175.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 36.6 mt -52.03 -52.04 26.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 CA-C-N 121.306 1.866 . . . . 2.0499999999999998 109.995 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 tttp -71.8 10.96 0.58 Allowed 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 125.394 1.478 . . . . 5.54 113.528 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -128.43 -39.7 1.66 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.43 2.292 . . . . 4.3300000000000001 113.941 175.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -70.98 -13.7 62.1 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 119.505 1.048 . . . . 5.1100000000000003 112.514 169.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -134.45 114.46 12.91 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.925 1.69 . . . . 3.0699999999999998 108.292 175.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 12.3 p -85.66 -11.37 53.98 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.548 1.684 . . . . 5.1100000000000003 115.548 -166.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -58.49 -11.99 3.5 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 117.659 2.466 . . . . 5.1100000000000003 117.659 -163.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.36 -49.56 2.67 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 125.188 1.375 . . . . 4.4299999999999997 113.617 177.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -71.13 66.64 0.42 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.7 2.4 . . . . 5.3300000000000001 110.24 174.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.58 -26.3 8.72 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.866 1.666 . . . . 4.0800000000000001 111.558 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 20.0 mtpp 72.54 84.5 0.12 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.869 2.068 . . . . 5.6200000000000001 113.287 159.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -27.76 -52.2 0.08 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 128.856 2.862 . . . . 5.0199999999999996 116.445 -178.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 3.0 m -57.83 -28.8 64.42 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.857 1.208 . . . . 3.52 114.215 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 15.0 t -77.75 -8.2 57.64 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.368 1.067 . . . . 3.75 113.765 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 49.3 mt -85.2 -40.06 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 120.322 1.419 . . . . 2.9399999999999999 113.804 -165.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.24 -23.41 61.22 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 118.981 0.81 . . . . 3.1899999999999999 111.221 172.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -76.15 -44.52 37.92 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.451 0.7 . . . . 2.73 111.504 169.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 51.4 tp -55.01 -45.65 75.13 Favored 'General case' 0 C--N 1.344 0.355 0 O-C-N 121.039 -1.038 . . . . 3.3500000000000001 110.045 168.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 4.6 ttt -58.26 -51.12 71.12 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.951 0.796 . . . . 2.8599999999999999 111.463 175.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -54.97 -28.39 51.2 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.649 1.179 . . . . 4.96 113.311 173.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.0 t -81.2 -30.3 34.34 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.31 1.044 . . . . 2.3399999999999999 112.933 177.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 96.1 mt -86.25 -35.89 19.71 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.0 1.32 . . . . 3.52 112.798 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -75.94 70.99 2.72 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.489 1.915 . . . . 1.6599999999999999 111.129 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.91 -8.91 2.49 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.475 1.51 . . . . 3.98 114.996 -173.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -110.07 -0.63 17.93 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 120.05 1.295 . . . . 3.1400000000000001 113.71 172.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 73.8 m 55.81 33.93 22.46 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.176 1.39 . . . . 3.7799999999999998 113.628 -178.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -102.37 3.8 38.27 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 129.799 3.24 . . . . 2.46 112.033 -168.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 67.26 -10.3 0.35 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 131.117 3.767 . . . . 4.0599999999999996 115.454 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -109.74 144.88 37.52 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 126.163 1.785 . . . . 2.6499999999999999 110.391 175.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 19.8 mt -114.22 106.7 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 O-C-N 121.161 -0.962 . . . . 2.3500000000000001 111.241 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -68.91 159.99 31.59 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.989 2.116 . . . . 2.8799999999999999 110.923 172.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.6 -35.48 54.42 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 120.145 -1.597 . . . . 3.8199999999999998 112.829 170.284 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -63.53 -25.05 68.07 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.623 0.769 . . . . 4.5899999999999999 113.059 173.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -89.47 -54.77 3.94 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 125.835 1.654 . . . . 1.8300000000000001 110.17 174.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -58.42 -32.19 68.42 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 127.0 2.12 . . . . 2.8100000000000001 113.908 -176.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 9.1 p -53.88 -28.01 33.69 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.199 -1.563 . . . . 2.8999999999999999 113.587 168.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 59.7 t -72.31 -31.23 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 120.265 1.393 . . . . 2.5800000000000001 111.25 177.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -63.43 -54.51 35.47 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.556 -0.715 . . . . 4.0 110.192 173.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 72.1 mt -54.33 -40.1 67.68 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.552 1.141 . . . . 2.2400000000000002 111.366 174.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.4 m -59.94 -53.97 51.58 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.047 0.939 . . . . 1.9199999999999999 111.544 176.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.9 mtm -60.55 -40.04 90.15 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.373 0.533 . . . . 2.29 112.222 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 98.1 mt -59.27 -52.43 65.68 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.356 0.662 . . . . 2.5800000000000001 110.685 174.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 93.2 m -59.28 -33.55 71.19 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.537 1.31 . . . . 2.52 114.537 177.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 81.6 mtp -70.19 -33.72 72.07 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.71 0.804 . . . . 2.8700000000000001 112.74 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.73 -34.76 58.09 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.42 1.009 . . . . 1.8 112.079 171.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -62.03 -27.53 68.95 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.133 0.973 . . . . 3.54 112.926 175.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -60.9 -51.72 68.08 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.738 0.815 . . . . 2.98 111.154 170.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.7 -30.64 64.39 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 126.142 1.777 . . . . 3.2200000000000002 111.913 -176.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.68 -51.19 70.43 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.492 1.517 . . . . 3.1400000000000001 110.793 166.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -61.29 -28.32 69.11 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.786 0.834 . . . . 3.4199999999999999 112.336 178.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 63.8 mt -70.64 -39.72 73.5 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.5 -0.75 . . . . 2.8399999999999999 112.083 171.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -75.55 -19.13 59.51 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 115.087 1.514 . . . . 3.3500000000000001 115.087 177.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -78.43 -32.61 48.66 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.143 1.377 . . . . 4.1200000000000001 112.547 171.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -83.6 -8.55 59.29 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.696 0.999 . . . . 3.75 113.696 -173.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.892 0 CA-C-O 116.335 -1.793 . . . . 5.96 115.462 -167.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 106.856 -1.535 . . . . 4.0 106.856 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 81.2 p -113.12 155.09 44.85 Favored Pre-proline 0 N--CA 1.466 0.343 0 C-N-CA 124.661 1.184 . . . . 2.8100000000000001 110.316 165.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -67.7 -16.23 46.05 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 121.95 1.766 . . . . 2.6200000000000001 111.339 165.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.37 -50.44 65.55 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 123.871 0.868 . . . . 3.3999999999999999 111.02 -178.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -58.95 -43.58 91.3 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 118.778 0.717 . . . . 3.6299999999999999 111.777 173.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.37 -24.16 65.67 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.246 -0.909 . . . . 6.7199999999999998 111.428 -175.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.52 -49.94 23.97 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.789 0.836 . . . . 2.8199999999999998 111.094 166.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.5 mt -53.64 -32.11 50.05 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.48 1.036 . . . . 3.2999999999999998 112.176 175.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.27 -40.8 62.21 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 117.571 -1.204 . . . . 3.8399999999999999 112.137 173.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.5 t -61.81 -26.09 67.89 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 120.288 1.403 . . . . 4.4299999999999997 112.187 -177.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 13.4 mtm -65.23 -37.43 87.23 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.798 0.839 . . . . 4.0999999999999996 111.026 174.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 67.1 t -76.81 -32.7 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.076 1.351 . . . . 3.0600000000000001 111.357 173.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 51.6 m -64.04 -49.41 72.48 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.295 1.038 . . . . 2.46 110.65 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.4 p -64.72 -33.31 75.66 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.691 0.678 . . . . 2.8199999999999998 110.108 173.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.41 -56.5 19.61 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 118.411 0.55 . . . . 3.7400000000000002 109.627 178.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -45.67 84.37 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 120.48 -1.387 . . . . 2.8999999999999999 111.68 -178.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -68.23 -49.1 62.94 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.151 -0.968 . . . . 7.0999999999999996 113.373 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -76.97 -28.17 55.04 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.875 1.216 . . . . 3.5 112.427 178.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.8 p -68.97 -25.57 64.6 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-N 120.955 1.707 . . . . 2.9900000000000002 112.274 170.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -82.91 3.7 82.85 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 125.96 1.743 . . . . 1.9299999999999999 114.298 167.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.6 ttt-85 -64.21 -31.7 73.0 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.865 1.832 . . . . 6.9199999999999999 111.25 171.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -157.41 147.39 20.61 Favored 'General case' 0 C--O 1.249 1.075 0 C-N-CA 124.226 1.01 . . . . 3.8900000000000001 112.878 178.571 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.49 -123.63 30.78 Favored Glycine 0 C--N 1.338 0.694 0 C-N-CA 126.129 1.823 . . . . 3.4399999999999999 112.636 160.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.0 m -47.13 112.5 0.53 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.83 1.252 . . . . 3.5699999999999998 110.752 169.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.16 24.85 2.36 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.582 1.553 . . . . 5.3300000000000001 114.372 -169.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.5 tp -143.44 -43.23 0.28 Allowed 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 124.971 1.308 . . . . 5.0999999999999996 110.559 -177.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 16.9 p -79.83 144.52 33.42 Favored 'General case' 0 C--O 1.248 0.996 0 CA-C-O 122.859 1.314 . . . . 1.8300000000000001 110.849 172.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 28.0 mt -88.26 92.17 9.06 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 105.916 -1.883 . . . . 2.7999999999999998 105.916 165.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.1 t -60.5 149.77 33.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 119.009 -0.52 . . . . 2.7200000000000002 109.994 169.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -37.61 -49.7 1.11 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.507 1.923 . . . . 4.79 113.26 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.439 ' H ' ' HD3' ' A' ' 32' ' ' LYS . 0.8 OUTLIER -70.06 -28.58 65.56 Favored 'General case' 0 CA--C 1.554 1.121 0 O-C-N 119.51 -1.994 . . . . 6.5800000000000001 115.032 -179.837 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -74.91 -38.37 61.84 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.42 1.488 . . . . 1.5800000000000001 109.921 174.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.7 tp -63.4 -39.63 95.02 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.878 0.871 . . . . 2.7400000000000002 111.462 173.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.2 ttmt -55.25 -40.41 70.88 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 119.094 0.861 . . . . 4.5099999999999998 112.005 175.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -60.6 -59.03 6.04 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.963 0.905 . . . . 3.5099999999999998 111.647 170.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.7 tp -56.34 -48.77 76.09 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.412 1.485 . . . . 3.3199999999999998 113.641 -172.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.2 mt -53.57 -61.32 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 CA-C-N 118.64 0.655 . . . . 2.0 110.246 -174.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.87 1.04 28.59 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 113.608 0.966 . . . . 6.0300000000000002 113.608 -172.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 43.6 mmtt -91.77 -33.58 14.94 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.012 1.325 . . . . 3.75 112.859 174.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -89.24 -51.66 5.46 Favored 'General case' 0 CA--C 1.532 0.25 0 O-C-N 124.265 0.978 . . . . 5.2400000000000002 110.303 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 46.7 mt -78.96 67.27 4.62 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.714 1.206 . . . . 3.8300000000000001 111.33 -176.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 98.9 m -63.78 -12.95 39.82 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.349 1.611 . . . . 4.7999999999999998 115.349 -163.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -99.69 0.59 42.21 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 126.789 2.036 . . . . 4.1500000000000004 114.733 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -82.51 121.77 5.54 Favored Glycine 0 CA--C 1.531 1.088 0 O-C-N 121.595 -0.691 . . . . 4.8300000000000001 114.109 -168.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -72.78 60.17 0.5 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.008 1.723 . . . . 6.2599999999999998 111.347 165.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.3 mmt -78.19 68.99 4.33 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 124.054 1.883 . . . . 3.4199999999999999 110.793 173.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -58.84 113.87 2.27 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 113.083 -1.871 . . . . 6.1799999999999997 108.301 174.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -52.35 -35.98 52.48 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 117.097 2.258 . . . . 4.7199999999999998 117.097 -136.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.9 t -57.62 -25.56 60.29 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 120.541 1.519 . . . . 3.79 113.597 177.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.1 t -69.34 -17.92 63.75 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.991 -1.068 . . . . 3.73 113.611 174.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 17.8 mm -61.08 -41.74 90.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 119.897 1.226 . . . . 2.6600000000000001 109.679 168.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.416 ' C ' ' HZ2' ' A' ' 57' ' ' LYS . 2.1 t70 -77.59 -39.05 46.9 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.61 1.164 . . . . 3.4300000000000002 111.89 -169.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.455 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 1.2 m-20 -79.33 -26.93 42.1 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.589 1.156 . . . . 3.9700000000000002 112.888 175.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 43.9 tp -59.88 -52.99 63.07 Favored 'General case' 0 C--N 1.344 0.326 0 CA-C-N 118.858 0.754 . . . . 3.1800000000000002 109.116 159.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -55.99 -48.62 75.52 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.295 1.038 . . . . 2.8500000000000001 111.544 -176.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.455 ' HE2' ' HA ' ' A' ' 54' ' ' ASP . 16.3 mtmm -51.92 -36.98 50.89 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.838 1.255 . . . . 5.9900000000000002 114.304 171.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 50.8 m -84.27 -18.82 35.17 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.177 1.391 . . . . 3.2200000000000002 113.882 -178.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 97.8 mt -83.93 -54.54 4.8 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 124.412 1.085 . . . . 3.1600000000000001 109.973 170.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -78.72 90.22 4.61 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.438 1.095 . . . . 1.6799999999999999 112.482 175.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -78.91 -2.39 39.72 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.95 0.722 . . . . 4.0300000000000002 112.95 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -83.03 -30.46 28.06 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 114.299 1.222 . . . . 2.8599999999999999 114.299 173.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 28.6 t 64.63 23.93 12.9 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.998 0.919 . . . . 3.75 113.131 -159.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 55.3 p-10 -81.8 -10.41 59.34 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.039 1.336 . . . . 2.3999999999999999 111.813 176.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 63.57 4.61 1.85 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 129.545 3.138 . . . . 4.25 114.247 -171.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -106.52 131.03 54.17 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 128.508 2.723 . . . . 2.5099999999999998 110.002 175.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 35.0 mm -87.9 113.97 25.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 O-C-N 120.62 -1.3 . . . . 2.9300000000000002 108.936 168.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -76.87 162.37 27.67 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.462 1.505 . . . . 2.6499999999999999 109.485 167.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.37 -43.3 79.06 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 119.91 -1.744 . . . . 4.6500000000000004 112.944 -176.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.1 pttm -70.19 -14.51 62.66 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.023 1.329 . . . . 3.7000000000000002 114.435 174.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -85.41 -41.76 15.14 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.506 1.123 . . . . 1.9399999999999999 110.666 168.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -57.48 -29.85 64.59 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.637 -1.289 . . . . 3.75 112.637 174.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.0 m -51.49 -32.42 27.37 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.678 1.191 . . . . 2.23 113.738 166.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 32.7 t -70.06 -39.91 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-N 119.652 1.115 . . . . 2.8999999999999999 109.597 179.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -64.76 -54.13 36.21 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 123.458 0.703 . . . . 3.5600000000000001 109.368 177.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.1 mt -58.58 -35.43 72.4 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.232 1.013 . . . . 3.04 112.075 178.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 86.3 m -63.99 -55.65 20.82 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.378 0.99 . . . . 1.8700000000000001 110.509 175.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 77.2 mtm -59.75 -43.88 94.09 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 118.921 0.782 . . . . 2.21 112.193 -175.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.01 -51.97 64.76 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.928 0.891 . . . . 3.7999999999999998 112.215 174.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 8.9 t -63.06 -32.3 73.64 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.38 0.511 . . . . 2.5 112.38 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 80.6 mtp -69.55 -32.67 71.61 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.11 0.782 . . . . 2.3100000000000001 113.11 171.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.64 -43.09 94.78 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.81 1.186 . . . . 1.9199999999999999 111.776 172.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -63.68 -28.17 69.72 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.077 1.14 . . . . 3.4700000000000002 114.077 176.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -61.12 -47.56 85.68 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.805 0.73 . . . . 2.4100000000000001 111.673 171.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -66.85 -43.94 82.36 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.322 0.649 . . . . 3.1899999999999999 111.414 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -51.08 61.71 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.73 1.612 . . . . 3.1299999999999999 111.609 175.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -66.55 -35.03 79.22 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.192 -0.942 . . . . 4.8700000000000001 111.789 -178.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.1 mt -68.55 -33.05 73.43 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.299 0.64 . . . . 3.1200000000000001 112.092 175.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -75.87 -35.62 59.83 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 114.054 1.131 . . . . 2.8199999999999998 114.054 177.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 . . . . . 0 CA--C 1.543 0.686 0 C-N-CA 126.17 1.788 . . . . 3.6299999999999999 112.678 178.367 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 72.3 p . . . . . 0 N--CA 1.482 1.168 0 N-CA-C 113.677 0.992 . . . . 2.6299999999999999 113.677 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -59.07 -31.02 94.81 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.47 2.113 . . . . 1.71 113.404 167.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.99 -48.41 71.31 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 119.642 1.11 . . . . 3.8399999999999999 111.409 178.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -64.77 -39.65 93.96 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 118.773 0.715 . . . . 3.7200000000000002 111.891 174.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -58.09 -31.14 66.83 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.354 -1.466 . . . . 5.54 112.632 172.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.35 -31.36 72.1 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.977 0.808 . . . . 1.8899999999999999 112.631 175.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 58.0 mt -65.82 -52.32 51.56 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.334 1.054 . . . . 3.1600000000000001 110.033 175.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 90.4 m -52.46 -43.64 65.06 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.998 1.319 . . . . 2.75 111.51 172.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 59.7 m -64.58 -40.67 95.95 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.764 1.226 . . . . 2.2599999999999998 112.534 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 1.5 tmm? -74.48 -43.81 54.32 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 118.624 0.647 . . . . 4.5700000000000003 112.598 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 16.4 m -61.76 -20.48 23.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 O-C-N 120.636 -1.29 . . . . 3.6200000000000001 112.065 174.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 98.4 m -63.59 -55.5 23.27 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 117.388 -1.291 . . . . 2.8900000000000001 111.782 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 17.0 p -66.79 -33.46 75.67 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 120.048 1.295 . . . . 2.6499999999999999 110.188 175.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -65.0 -46.52 81.06 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 120.803 -0.359 . . . . 3.3300000000000001 111.917 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 23.8 m-70 -64.21 -49.56 71.48 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.096 0.958 . . . . 5.0599999999999996 111.343 171.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -56.15 -43.5 78.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.664 0.785 . . . . 5.3399999999999999 112.763 -175.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -91.66 -31.42 15.85 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.611 1.164 . . . . 3.9100000000000001 113.174 -177.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 72.9 m -65.81 -42.07 91.09 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 121.271 1.85 . . . . 2.29 111.469 172.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.74 -3.39 90.35 Favored Glycine 0 CA--C 1.531 1.073 0 C-N-CA 126.632 2.063 . . . . 1.7 114.555 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -26.18 67.42 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.871 1.668 . . . . 4.0899999999999999 112.053 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.49 ' HG2' ' HE3' ' B' ' 32' ' ' LYS . 0.0 OUTLIER -149.91 167.53 26.38 Favored 'General case' 0 C--O 1.245 0.846 0 C-N-CA 125.676 1.59 . . . . 5.3200000000000003 113.107 159.673 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.11 -105.14 0.42 Allowed Glycine 0 N--CA 1.473 1.161 0 O-C-N 126.227 2.204 . . . . 3.8700000000000001 115.698 128.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -61.4 89.92 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 107.056 -1.461 . . . . 5.4900000000000002 107.056 163.198 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 37.7 mttm -93.09 -26.53 17.42 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 120.315 -1.491 . . . . 7.7199999999999998 114.695 -158.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -80.62 -26.2 37.9 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.904 0.882 . . . . 5.3399999999999999 112.242 172.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.1 p -103.76 151.23 23.28 Favored 'General case' 0 C--O 1.246 0.903 0 C-N-CA 126.932 2.093 . . . . 2.0800000000000001 113.18 -177.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 20.7 mt -76.65 101.54 5.79 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 106.189 -1.782 . . . . 2.5699999999999998 106.189 154.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 17.9 t -62.61 147.41 49.36 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.777 -0.823 . . . . 2.6699999999999999 108.777 165.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -41.75 -41.68 2.39 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.801 1.64 . . . . 4.7800000000000002 113.674 -174.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.49 ' HE3' ' HG2' ' B' ' 23' ' ' GLU . 0.2 OUTLIER -60.37 -49.26 78.3 Favored 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 117.167 2.284 . . . . 7.2000000000000002 117.167 168.439 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -64.69 -35.67 81.8 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.801 1.637 . . . . 2.3599999999999999 110.86 173.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 40.3 tp -62.6 -51.09 68.67 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.179 0.592 . . . . 3.04 110.531 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -52.32 -39.77 61.02 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.782 1.233 . . . . 4.8799999999999999 113.183 177.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -68.29 -57.64 5.64 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.147 1.379 . . . . 3.73 111.855 172.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 24.4 tp -52.6 -58.93 5.21 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.457 1.903 . . . . 3.8100000000000001 111.585 -174.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 54.0 mt -53.98 -42.82 55.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 CA-C-O 121.626 0.727 . . . . 2.4199999999999999 110.46 -177.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 65.2 tttt -64.15 -18.26 64.27 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 113.145 0.794 . . . . 5.4100000000000001 113.145 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 19.6 mmtp -97.44 -45.57 6.39 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.178 1.391 . . . . 5.1399999999999997 112.294 167.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -61.76 -35.97 79.67 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.605 1.962 . . . . 4.0899999999999999 112.038 -170.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -110.96 -70.52 0.81 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.72 1.208 . . . . 2.7599999999999998 109.766 167.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 2.2 t 67.24 -64.91 0.24 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.18 1.792 . . . . 6.3099999999999996 113.118 -169.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 4.2 mm? 30.36 -135.06 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 127.942 2.497 . . . . 4.0599999999999996 112.33 -171.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -89.0 -35.79 8.02 Favored Glycine 0 CA--C 1.528 0.874 0 O-C-N 120.303 -1.498 . . . . 3.9199999999999999 111.057 165.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -89.72 -27.77 19.85 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.369 1.868 . . . . 6.79 114.632 -159.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.77 68.69 7.11 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 123.951 1.834 . . . . 2.73 111.92 -175.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp -134.3 161.22 35.56 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 129.12 2.968 . . . . 8.3399999999999999 108.487 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -40.57 -64.29 0.54 Allowed 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 116.619 2.081 . . . . 3.3999999999999999 116.619 -131.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 13.5 m -65.83 -25.62 67.29 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.272 1.212 . . . . 3.0699999999999998 114.272 -173.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 5.3 m -62.41 -5.25 2.34 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.611 1.165 . . . . 3.2799999999999998 112.898 170.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 62.9 mt -110.33 -22.69 4.86 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 125.606 1.562 . . . . 2.5600000000000001 112.042 175.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -80.06 -48.76 12.77 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.262 0.937 . . . . 3.3100000000000001 112.313 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -68.67 -33.05 73.31 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 118.917 0.781 . . . . 2.7999999999999998 110.252 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 8.3 tt -62.12 -44.3 96.94 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 117.269 -1.348 . . . . 3.4199999999999999 111.073 172.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ttt -58.44 -48.91 79.17 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 121.943 2.156 . . . . 3.3700000000000001 112.133 169.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.23 -20.96 20.6 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 120.09 1.313 . . . . 6.1399999999999997 113.47 174.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 31.0 t -89.25 -38.1 14.47 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.967 1.707 . . . . 2.7000000000000002 112.738 176.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 7.3 mp -71.72 -59.7 2.62 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 126.504 1.921 . . . . 3.46 111.809 174.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -78.66 95.15 5.2 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 127.869 2.468 . . . . 1.4199999999999999 110.748 -170.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.2 -39.89 84.02 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 114.418 1.266 . . . . 3.3799999999999999 114.418 -169.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 53.2 p-10 -99.91 -6.21 27.07 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.045 1.498 . . . . 2.5 115.045 -173.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 17.9 t 64.02 26.41 14.06 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.776 1.23 . . . . 3.1299999999999999 113.742 -177.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 50.8 p30 -68.16 -15.98 63.81 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.406 1.482 . . . . 2.1000000000000001 111.493 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 64.58 22.32 12.62 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 129.273 3.029 . . . . 4.6200000000000001 113.563 -175.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -131.74 123.76 28.35 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 127.775 2.43 . . . . 2.98 107.562 175.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 18.8 mm -90.81 110.72 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 O-C-N 120.993 -1.067 . . . . 2.6000000000000001 111.662 -173.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -76.13 150.54 37.18 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.881 1.273 . . . . 2.6600000000000001 110.167 161.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.04 -33.11 72.77 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 119.96 -1.713 . . . . 4.1799999999999997 112.333 -174.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 19.1 pttm -74.32 -9.12 58.29 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.326 1.232 . . . . 4.0999999999999996 114.326 173.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -81.82 -53.19 6.39 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 108.011 -1.107 . . . . 1.78 108.011 157.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -61.37 -25.56 67.25 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 116.518 2.044 . . . . 5.3399999999999999 116.518 -172.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 94.4 p -65.53 -19.69 66.03 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.207 -1.558 . . . . 2.0299999999999998 111.886 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 1.2 p -69.36 -27.78 35.83 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 N-CA-C 113.0 0.741 . . . . 3.5800000000000001 113.0 170.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 45.8 t80 -61.03 -51.25 69.99 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 120.822 -1.174 . . . . 4.0 110.454 170.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 33.5 mt -59.71 -38.4 81.51 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.419 1.088 . . . . 2.2999999999999998 110.658 177.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.4 m -59.86 -54.21 48.82 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.725 1.21 . . . . 1.9399999999999999 111.417 174.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -55.31 -42.81 74.2 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.708 1.14 . . . . 2.9500000000000002 112.942 177.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 93.7 mt -63.83 -48.64 75.99 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.604 0.762 . . . . 2.8500000000000001 111.52 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 75.1 m -67.58 -32.93 74.03 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 113.038 0.755 . . . . 2.8199999999999998 113.038 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 88.6 mtp -68.71 -36.04 77.95 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.643 0.656 . . . . 2.98 112.082 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.91 -42.98 72.63 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 119.068 0.849 . . . . 2.0 112.049 172.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -63.0 -25.76 68.54 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 119.686 1.13 . . . . 4.4000000000000004 113.77 176.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -62.54 -51.51 67.11 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 120.0 1.273 . . . . 2.7599999999999998 111.854 168.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -71.65 -29.34 64.52 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.578 1.151 . . . . 3.4100000000000001 112.456 -174.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -58.86 -56.5 21.41 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.584 1.554 . . . . 4.8499999999999996 110.678 164.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -60.17 -27.18 66.91 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.684 1.194 . . . . 3.29 113.152 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 68.7 mt -66.37 -40.9 90.01 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 117.507 -1.235 . . . . 2.4399999999999999 112.021 171.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -86.89 -1.73 58.04 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.782 1.401 . . . . 4.0899999999999999 114.782 176.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -76.43 -33.58 58.78 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 120.79 -1.194 . . . . 3.3199999999999998 111.605 159.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -102.86 7.96 39.31 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.506 1.523 . . . . 2.8799999999999999 113.918 -170.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 N-CA-C 118.844 2.905 . . . . 5.7199999999999998 118.844 -161.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 17.6 mp0 . . . . . 0 N--CA 1.445 -0.725 0 N-CA-C 106.887 -1.524 . . . . 3.4100000000000001 106.887 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.9 p -151.03 162.73 25.98 Favored Pre-proline 0 N--CA 1.472 0.628 0 N-CA-C 113.828 1.048 . . . . 2.48 113.828 -138.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -63.65 -39.17 36.46 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.312 2.675 . . . . 3.25 113.131 179.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.2 tp -71.29 -49.98 37.27 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.136 1.335 . . . . 5.0999999999999996 111.423 -177.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -63.55 -37.57 87.83 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.546 0.738 . . . . 5.3899999999999997 109.868 -177.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -67.53 -35.71 79.6 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 120.878 -1.139 . . . . 5.7599999999999998 112.55 171.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.16 -41.7 85.57 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.832 1.196 . . . . 2.3100000000000001 112.428 173.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.4 mt -62.74 -44.6 95.77 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.154 1.382 . . . . 2.6400000000000001 110.211 172.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 68.4 m -53.45 -50.98 64.13 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.444 1.097 . . . . 2.8199999999999998 110.649 172.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 99.2 m -56.08 -48.96 75.11 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.727 0.811 . . . . 2.1000000000000001 110.866 175.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 40.3 ttm -60.85 -45.85 92.9 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.99 1.316 . . . . 3.9700000000000002 112.432 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.3 t -62.65 -41.15 91.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 126.157 1.783 . . . . 3.2200000000000002 110.021 175.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 88.2 m -64.37 -50.7 66.67 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 124.24 1.016 . . . . 2.0699999999999998 111.138 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.3 p -63.66 -36.67 84.62 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.153 0.888 . . . . 2.8100000000000001 110.603 174.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -66.05 -53.18 41.6 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.328 -0.549 . . . . 3.8500000000000001 111.094 -177.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -69.81 -37.24 76.19 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.073 -1.017 . . . . 5.29 112.887 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -70.74 -48.48 54.25 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 119.637 1.108 . . . . 4.9299999999999997 112.355 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -69.56 -23.54 63.57 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.17 0.896 . . . . 3.73 111.601 172.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.0 t -64.5 -21.37 66.66 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 120.126 1.33 . . . . 2.6299999999999999 112.973 169.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.9 -3.76 79.62 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.128 1.347 . . . . 1.71 114.946 174.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -67.11 -33.4 75.39 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.723 1.762 . . . . 5.8899999999999997 111.871 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -146.89 141.01 26.11 Favored 'General case' 0 C--O 1.249 1.03 0 C-N-CA 125.039 1.336 . . . . 3.9199999999999999 111.096 -178.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 45.53 -124.3 6.69 Favored Glycine 0 C--N 1.338 0.689 0 C-N-CA 126.232 1.873 . . . . 3.7200000000000002 112.131 165.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.4 m -41.77 114.33 0.52 Allowed 'General case' 0 C--O 1.245 0.857 0 C-N-CA 125.643 1.577 . . . . 3.04 111.949 173.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 44.7 mtpt -86.75 109.94 19.58 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.518 1.527 . . . . 5.3899999999999997 107.648 151.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.8 mt 152.03 -61.12 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 130.971 3.709 . . . . 4.8300000000000001 107.431 -164.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.3 p -111.64 160.07 17.58 Favored 'General case' 0 C--O 1.246 0.918 0 C-N-CA 127.022 2.129 . . . . 1.9199999999999999 112.685 -171.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.2 mt -92.15 108.31 19.85 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 114.285 -1.325 . . . . 2.6499999999999999 108.382 160.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.85 162.48 24.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.25 0.547 . . . . 2.75 111.908 167.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.1 tpt85 -45.87 -27.69 0.93 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 127.682 2.393 . . . . 4.1200000000000001 114.829 -169.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.1 -28.89 12.07 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.552 1.141 . . . . 5.8499999999999996 113.244 177.412 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -58.0 -50.06 74.69 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.455 0.702 . . . . 2.6099999999999999 109.288 171.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.3 tp -62.42 -51.31 68.03 Favored 'General case' 0 C--N 1.344 0.369 0 C-N-CA 123.709 0.804 . . . . 3.1200000000000001 111.223 175.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.3 ttmm -55.77 -38.84 70.42 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 118.547 0.612 . . . . 4.2300000000000004 112.261 -176.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -70.79 -41.8 71.18 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 117.724 -1.132 . . . . 3.7599999999999998 113.228 176.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.02 -54.09 50.07 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.709 1.604 . . . . 3.6200000000000001 111.065 177.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.7 mt -53.25 -47.39 56.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 CA-C-O 122.167 0.984 . . . . 1.9299999999999999 109.221 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -67.59 -8.49 34.76 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 125.246 1.418 . . . . 6.7400000000000002 113.522 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -94.22 -50.33 5.32 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 119.848 -1.782 . . . . 4.4000000000000004 110.646 160.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 73.5 tt0 -52.25 -65.79 0.5 Allowed 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 128.999 2.92 . . . . 4.6200000000000001 111.862 -171.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -77.81 115.61 17.69 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 125.777 1.631 . . . . 3.2999999999999998 108.397 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 21.6 p -83.24 1.1 42.52 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.988 1.107 . . . . 6.2000000000000002 113.988 171.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -150.54 -172.56 4.22 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.07 0.948 . . . . 4.0800000000000001 112.7 -155.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.71 9.1 50.8 Favored Glycine 0 N--CA 1.472 1.099 0 C-N-CA 124.207 0.908 . . . . 6.25 114.996 170.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.4 ' C ' ' H ' ' A' ' 48' ' ' LYS . 51.7 mm-40 54.32 32.61 16.65 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.431 1.492 . . . . 6.1100000000000003 112.703 -169.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.87 23.85 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.034 1.734 . . . . 2.8100000000000001 114.899 -177.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.4 ' H ' ' C ' ' A' ' 46' ' ' GLU . 15.0 mtpt -78.94 -168.09 1.34 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 127.895 2.478 . . . . 5.9699999999999998 112.133 -175.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -44.5 -62.32 1.23 Allowed 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 116.649 2.092 . . . . 4.8600000000000003 116.649 -161.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.6 t -71.77 -25.44 62.03 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.592 1.087 . . . . 3.0499999999999998 112.788 -175.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.3 m -68.41 -21.53 64.67 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.025 1.33 . . . . 3.48 112.045 174.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 81.8 mt -80.9 -31.75 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 123.857 0.863 . . . . 2.4900000000000002 111.939 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -73.56 -33.03 64.48 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.762 1.165 . . . . 3.5899999999999999 113.67 -174.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -70.77 -40.86 72.38 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 118.708 0.685 . . . . 2.3700000000000001 111.185 163.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.12 -47.82 82.12 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 118.474 -0.774 . . . . 2.96 110.296 178.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.5 mtp -53.42 -50.27 65.56 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 120.114 1.325 . . . . 3.0899999999999999 111.332 177.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.65 -35.11 67.99 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.245 1.418 . . . . 4.2000000000000002 113.064 174.56 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.7 m -84.58 -32.71 23.64 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.949 1.3 . . . . 3.8500000000000001 112.656 -175.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 88.8 mt -76.34 -46.93 25.29 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 125.848 1.659 . . . . 3.6800000000000002 112.271 175.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -70.31 141.18 52.37 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.842 1.657 . . . . 1.6100000000000001 112.984 -172.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -112.44 -26.29 8.78 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 126.295 1.838 . . . . 4.7400000000000002 113.468 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.28 -23.02 57.35 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 120.349 1.431 . . . . 2.9700000000000002 111.652 175.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.8 t 70.53 41.64 0.94 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.701 2.4 . . . . 2.8799999999999999 111.862 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -116.09 -117.24 0.32 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.94 1.296 . . . . 3.0600000000000001 109.249 -160.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -146.63 -10.35 0.47 Allowed 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 116.269 1.951 . . . . 4.6600000000000001 116.269 163.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -105.99 140.01 39.66 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 127.682 2.393 . . . . 3.1000000000000001 110.937 177.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.2 mm -94.24 112.93 27.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 113.018 -1.901 . . . . 2.5299999999999998 109.938 177.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -61.21 157.08 16.98 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.674 1.19 . . . . 3.5099999999999998 111.01 163.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.76 -27.74 60.04 Favored 'General case' 0 CA--C 1.553 1.063 0 O-C-N 120.518 -1.364 . . . . 3.1899999999999999 111.697 164.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -69.93 -38.81 76.32 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.32 1.848 . . . . 4.2999999999999998 111.983 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 64.4 mt-10 -73.16 -51.86 16.31 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.761 1.624 . . . . 1.6699999999999999 109.246 173.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -49.98 -32.36 14.86 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.647 1.579 . . . . 3.5 113.289 174.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.1 m -62.3 -30.81 71.41 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.466 -1.396 . . . . 2.4500000000000002 113.743 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.6 m -79.71 -25.05 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 CA-C-N 120.897 1.68 . . . . 3.3900000000000001 112.282 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -65.72 -64.07 0.95 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.329 0.651 . . . . 2.98 111.279 172.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -53.82 -44.83 70.55 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 125.319 1.447 . . . . 3.73 111.139 -178.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 48.6 m -59.2 -41.41 88.46 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 118.233 -0.889 . . . . 2.5600000000000001 113.082 176.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 67.1 mtm -64.24 -36.04 82.8 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.12 1.327 . . . . 2.5699999999999998 112.204 175.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 78.3 mt -64.77 -43.65 92.58 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 118.866 0.757 . . . . 2.1499999999999999 111.752 173.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 79.8 m -58.57 -42.43 87.96 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 112.903 0.705 . . . . 2.2799999999999998 112.903 171.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 80.2 mtp -64.42 -32.97 74.81 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.687 0.676 . . . . 3.0800000000000001 112.559 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.09 -43.51 57.42 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.769 1.168 . . . . 1.8500000000000001 112.514 173.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -61.47 -31.82 71.8 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.298 0.954 . . . . 3.71 113.152 175.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -57.41 -49.68 75.42 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.572 0.749 . . . . 2.6499999999999999 112.866 169.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.93 -32.68 65.46 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.149 0.58 . . . . 3.3999999999999999 111.697 -174.015 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.81 -48.65 79.11 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.388 1.475 . . . . 3.9199999999999999 111.152 166.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -63.65 -36.59 84.32 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.551 1.54 . . . . 4.0999999999999996 111.959 176.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 19.8 mt -72.33 -13.05 61.39 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.635 1.174 . . . . 2.6099999999999999 114.029 -178.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -93.87 -1.75 54.37 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 114.782 1.401 . . . . 3.6699999999999999 114.782 168.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 16.6 t70 . . . . . 0 CA--C 1.543 0.682 0 C-N-CA 124.11 0.964 . . . . 4.4100000000000001 110.568 165.408 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 64.3 p . . . . . 0 N--CA 1.469 0.518 0 N-CA-C 111.797 0.295 . . . . 2.6200000000000001 111.797 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -66.39 -9.16 22.94 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.507 2.138 . . . . 1.8 112.576 165.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tt -75.45 -58.64 3.16 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.186 -1.388 . . . . 3.7999999999999998 109.586 169.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -48.1 -52.39 20.6 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.864 1.211 . . . . 4.3499999999999996 110.613 170.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 2.2 tptm -64.7 -31.69 73.02 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 113.645 0.98 . . . . 5.0099999999999998 113.645 -175.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.34 -31.29 72.4 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.775 0.83 . . . . 2.23 112.418 170.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 22.3 mt -75.15 -34.62 61.64 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.818 0.735 . . . . 3.1299999999999999 111.255 173.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.4 m -59.52 -46.67 88.18 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.326 0.65 . . . . 2.1699999999999999 110.959 166.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 30.1 m -60.56 -42.0 95.72 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.921 1.289 . . . . 2.1800000000000002 111.463 174.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 41.6 ttm -57.66 -49.98 74.67 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.372 0.669 . . . . 3.8700000000000001 111.331 172.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 10.5 t -59.52 -35.9 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 124.675 1.19 . . . . 2.8100000000000001 112.389 174.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 89.0 m -65.68 -47.75 74.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.72 1.608 . . . . 1.9099999999999999 111.819 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.55 -50.21 73.85 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.769 0.713 . . . . 2.29 109.579 167.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -62.19 -46.01 90.83 Favored 'General case' 0 N--CA 1.463 0.218 0 O-C-N 124.192 0.933 . . . . 3.8100000000000001 111.489 -164.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -74.23 -34.77 63.76 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.131 0.789 . . . . 2.6000000000000001 113.131 176.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 16.6 ttmm -69.8 -23.96 63.41 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.021 -1.049 . . . . 5.1900000000000004 113.218 177.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 49.4 m-85 -77.73 -39.61 43.88 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.59 1.156 . . . . 3.2000000000000002 112.235 160.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 17.5 t -59.78 -19.23 49.23 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 116.032 1.864 . . . . 2.3399999999999999 116.032 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.85 -13.3 83.56 Favored Glycine 0 CA--C 1.54 1.649 0 CA-C-O 118.759 -1.023 . . . . 1.55 114.803 170.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -86.67 73.81 9.96 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.067 1.934 . . . . 6.1900000000000004 110.83 176.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 88.72 -178.16 0.02 OUTLIER 'General case' 0 C--O 1.247 0.946 0 C-N-CA 127.378 2.271 . . . . 3.0099999999999998 111.624 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.51 -150.54 21.08 Favored Glycine 0 C--N 1.339 0.718 0 C-N-CA 124.994 1.283 . . . . 2.8599999999999999 111.538 -177.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 2.3 m -80.3 170.15 16.79 Favored 'General case' 0 C--O 1.251 1.155 0 O-C-N 121.967 -0.725 . . . . 3.75 111.412 166.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 61.5 mttt -63.9 162.48 13.68 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 125.082 1.353 . . . . 7.8300000000000001 109.5 144.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 9.3 tp 66.61 -24.77 0.11 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.702 2.001 . . . . 4.5700000000000003 114.486 -174.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' THR . . . . . 0.517 ' HG1' ' CD ' ' B' ' 66' ' ' GLU . 57.7 p -110.01 152.85 25.4 Favored 'General case' 0 C--O 1.245 0.845 0 C-N-CA 124.445 1.098 . . . . 1.78 113.673 178.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 51.9 mt -107.48 99.22 8.75 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.868 -1.06 . . . . 2.6400000000000001 110.717 163.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 35.0 t -55.67 160.16 2.66 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.578 1.151 . . . . 2.48 113.381 161.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -45.59 -24.77 0.37 Allowed 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 117.302 2.334 . . . . 4.71 117.302 -175.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.29 -50.53 5.77 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-N 120.392 1.451 . . . . 4.5 114.096 174.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -54.64 -37.18 65.35 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.314 0.646 . . . . 2.5699999999999998 110.68 179.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 49.9 tp -76.05 -47.19 25.65 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.322 0.86 . . . . 3.3399999999999999 113.322 172.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 17.4 ttmt -52.54 -47.55 66.66 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 120.693 1.588 . . . . 3.7799999999999998 110.986 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.6 tp10 -67.5 -36.0 80.24 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 116.871 -1.538 . . . . 3.7200000000000002 114.253 -178.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 tt -57.82 -54.81 42.69 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 125.672 1.589 . . . . 3.1899999999999999 111.86 173.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 mt -56.67 -39.92 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 N-CA-C 108.849 -0.797 . . . . 2.0600000000000001 108.849 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 52.8 tttt -70.97 3.13 3.57 Favored 'General case' 0 CA--C 1.559 1.316 0 N-CA-C 114.7 1.37 . . . . 5.04 114.7 177.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 17.5 mmtm -112.24 -57.98 2.2 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 126.097 1.759 . . . . 4.6600000000000001 110.487 166.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -53.5 -49.96 66.4 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.211 1.805 . . . . 4.5099999999999998 111.894 179.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -84.22 53.48 2.64 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 120.255 -1.528 . . . . 3.3300000000000001 111.182 176.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 13.1 t -58.81 -13.34 5.91 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.837 1.255 . . . . 3.5 113.531 171.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -48.12 -36.78 13.94 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 127.747 2.419 . . . . 3.8100000000000001 112.57 164.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.77 9.27 81.38 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.127 0.87 . . . . 3.8599999999999999 115.058 166.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -63.59 -49.12 74.63 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.218 1.009 . . . . 7.3899999999999997 110.696 170.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.92 110.64 1.61 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.74 0.816 . . . . 2.4700000000000002 112.097 172.224 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -128.57 146.7 50.77 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.444 1.498 . . . . 4.6200000000000001 109.616 172.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -6.0 -87.96 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 128.243 2.617 . . . . 3.8900000000000001 116.762 -158.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.9 m -57.59 -23.05 48.74 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.297 1.592 . . . . 3.5499999999999998 115.297 -173.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 29.2 t -66.94 -18.62 65.47 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.121 -0.987 . . . . 2.5800000000000001 113.133 173.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 13.8 mm -72.78 -37.3 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 123.923 0.889 . . . . 2.3700000000000001 110.534 171.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -80.13 -37.87 32.65 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.215 1.006 . . . . 3.9399999999999999 111.859 -170.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.459 ' CG ' ' HZ2' ' B' ' 57' ' ' LYS . 9.2 t70 -67.16 -35.45 79.72 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.492 0.553 . . . . 2.2999999999999998 112.492 167.183 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 9.6 tt -63.64 -44.78 92.85 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 118.01 -0.995 . . . . 3.5 111.035 171.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 26.9 mtp -56.94 -45.59 82.67 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 120.127 1.33 . . . . 3.2999999999999998 110.936 175.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . 0.459 ' HZ2' ' CG ' ' B' ' 54' ' ' ASP . 8.3 tttm -52.06 -38.02 55.69 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.425 1.09 . . . . 4.6399999999999997 113.001 168.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.8 t -67.36 -33.61 75.58 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 120.818 -1.176 . . . . 2.6000000000000001 112.731 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 20.6 mt -83.03 -45.52 13.94 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 120.943 -1.098 . . . . 2.8799999999999999 113.486 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -79.39 87.8 5.02 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.51 1.924 . . . . 1.8100000000000001 111.33 -156.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.88 -30.33 70.08 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 115.05 1.5 . . . . 4.0199999999999996 115.05 178.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . 0.286 0.0 OUTLIER -78.41 -22.86 47.13 Favored 'General case' 0 CA--C 1.558 1.274 0 CA-C-N 119.273 0.942 . . . . 2.8300000000000001 111.959 167.183 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 8.1 m 53.21 62.71 2.53 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 126.82 2.048 . . . . 4.3499999999999996 113.146 175.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -141.05 -60.53 0.49 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 118.512 -0.756 . . . . 2.6200000000000001 112.171 -140.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 161.73 -35.81 0.0 OUTLIER 'General case' 0 C--N 1.345 0.374 0 C-N-CA 131.511 3.924 . . . . 6.3300000000000001 115.004 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . 0.517 ' CD ' ' HG1' ' B' ' 28' ' ' THR . 4.0 mm-40 -106.87 135.85 47.7 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 126.358 1.863 . . . . 2.29 108.888 -178.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . 0.41 ' HA ' ' OE1' ' B' ' 71' ' ' GLU 0.257 14.6 mt -99.7 109.85 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.599 0.76 . . . . 2.3100000000000001 111.47 169.98 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -54.23 153.44 5.25 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.491 1.916 . . . . 3.6099999999999999 111.049 166.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.33 -35.13 62.37 Favored 'General case' 0 CA--C 1.552 1.03 0 O-C-N 120.533 -1.354 . . . . 3.4500000000000002 110.942 165.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.434 ' HE3' ' HA ' ' B' ' 70' ' ' LYS . 0.1 OUTLIER -70.19 -35.81 74.19 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 120.548 -1.345 . . . . 8.2200000000000006 113.122 176.965 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . 0.41 ' OE1' ' HA ' ' B' ' 67' ' ' ILE . 57.1 mt-10 -65.03 -51.23 62.71 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 119.143 0.883 . . . . 1.71 108.734 168.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -56.8 -32.78 66.02 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 120.396 -1.44 . . . . 2.9100000000000001 113.898 -177.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 63.9 p -57.45 -21.95 40.31 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 119.748 -1.845 . . . . 3.0600000000000001 114.466 171.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 59.6 t -64.94 -36.88 78.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 119.71 1.141 . . . . 2.46 111.547 171.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -61.83 -47.26 85.87 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.809 0.843 . . . . 2.5800000000000001 109.86 173.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 47.1 mt -58.54 -50.53 73.46 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 117.406 -1.283 . . . . 2.8900000000000001 110.698 178.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 98.6 m -58.66 -46.92 86.13 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.983 1.265 . . . . 2.2200000000000002 111.333 176.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 59.1 ttp -58.01 -47.74 82.14 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.547 0.739 . . . . 3.7599999999999998 112.321 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 94.4 mt -69.84 -46.75 64.92 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.869 0.692 . . . . 2.3100000000000001 112.869 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.76 -33.79 76.45 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.503 1.047 . . . . 2.6800000000000002 111.646 -178.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 61.5 mtp -75.11 -30.39 60.84 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 118.054 -0.974 . . . . 3.1200000000000001 113.1 172.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.0 -39.46 94.16 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 120.7 1.591 . . . . 1.8 111.863 171.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -67.98 -13.08 61.9 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.491 1.293 . . . . 3.54 114.491 173.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -69.43 -45.53 68.92 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.268 0.94 . . . . 3.02 111.912 170.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.0 -44.13 93.57 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.108 1.763 . . . . 3.71 111.643 174.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -54.26 -45.27 72.35 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.646 1.578 . . . . 3.0699999999999998 112.242 175.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -66.23 -27.33 67.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.756 1.223 . . . . 4.5999999999999996 112.804 176.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 49.0 mt -74.32 -21.62 59.63 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 120.893 -1.129 . . . . 2.9199999999999999 112.235 175.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -88.8 3.21 51.85 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.488 1.515 . . . . 3.4100000000000001 114.411 168.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -92.89 -46.2 7.62 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.74 1.216 . . . . 4.5099999999999998 111.027 162.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.35 20.73 0.52 Allowed 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 125.29 1.436 . . . . 4.3099999999999996 114.234 -178.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.256 1.444 0 C-N-CA 128.06 2.544 . . . . 4.7599999999999998 117.736 -166.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 . . . . . 0 CA--C 1.542 0.646 0 CA-C-O 123.463 1.601 . . . . 4.0499999999999998 109.26 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.2 p -99.12 175.54 2.4 Favored Pre-proline 0 C--N 1.316 -0.864 1 C-N-CA 132.644 4.378 . . . . 2.8700000000000001 111.011 -151.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -77.07 -29.91 4.78 Favored 'Trans proline' 0 C--N 1.351 0.668 0 CA-C-N 121.076 1.42 . . . . 1.8200000000000001 112.886 -168.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 18.0 tp -85.71 -39.2 17.46 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 117.007 -1.473 . . . . 3.5600000000000001 112.519 -174.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -58.28 -37.93 75.98 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 120.487 1.494 . . . . 4.6799999999999997 109.915 172.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 ttmp? -65.41 -39.1 91.76 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.532 1.133 . . . . 4.2999999999999998 112.663 171.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.71 -40.66 69.32 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.043 0.937 . . . . 1.99 113.106 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.3 mt -62.34 -42.78 99.67 Favored 'General case' 0 C--O 1.238 0.486 0 O-C-N 121.286 -0.884 . . . . 2.8100000000000001 109.969 170.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 92.5 m -56.05 -44.35 78.77 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 117.042 -1.456 . . . . 2.48 110.748 170.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.0 m -56.54 -52.13 65.96 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 121.481 1.946 . . . . 1.99 112.329 178.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.08 -29.08 69.93 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 113.994 1.109 . . . . 4.0099999999999998 113.994 178.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 80.2 t -76.19 -32.22 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 123.954 0.901 . . . . 3.7000000000000002 112.741 171.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 56.8 m -61.34 -55.37 32.44 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.423 1.489 . . . . 1.97 110.176 175.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.33 -25.26 64.12 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.862 1.265 . . . . 3.25 111.504 -177.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -59.77 -37.65 79.64 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.256 -0.902 . . . . 2.73 111.675 167.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -76.99 -27.9 54.89 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 120.196 -1.565 . . . . 2.6499999999999999 112.954 175.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -56.44 -59.62 4.71 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.725 1.148 . . . . 6.1200000000000001 110.715 164.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -86.51 -45.71 10.85 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 114.298 1.222 . . . . 3.4700000000000002 114.298 -167.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.3 m -67.02 -31.03 71.3 Favored 'General case' 0 C--O 1.249 1.056 0 CA-C-N 120.605 1.548 . . . . 3.3700000000000001 111.362 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.39 2.07 88.21 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 126.873 2.178 . . . . 1.6799999999999999 114.582 173.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.4 ttt85 -74.69 -46.08 40.18 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.749 1.775 . . . . 5.8300000000000001 111.264 175.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -133.0 147.98 52.27 Favored 'General case' 0 C--O 1.252 1.224 0 CA-C-O 122.663 1.22 . . . . 5.5199999999999996 112.845 -174.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.49 -122.96 14.07 Favored Glycine 0 C--N 1.343 0.936 0 C-N-CA 128.308 2.861 . . . . 3.0499999999999998 112.395 168.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.7 m -44.27 109.18 0.14 Allowed 'General case' 0 C--O 1.246 0.877 0 C-N-CA 125.065 1.346 . . . . 4.3700000000000001 110.995 161.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 40.4 tptt -72.71 -27.57 62.15 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.606 1.562 . . . . 6.7300000000000004 112.949 -172.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -90.29 -17.3 27.65 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.503 1.521 . . . . 5.9500000000000002 114.253 178.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.8 p -106.26 152.6 23.31 Favored 'General case' 0 C--O 1.254 1.326 0 C-N-CA 123.921 0.888 . . . . 2.5800000000000001 111.293 178.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 12.2 mt -82.98 107.28 15.47 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 113.306 -1.77 . . . . 3.1000000000000001 106.912 148.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.2 t -66.56 162.69 20.34 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.552 -0.717 . . . . 2.5499999999999998 109.969 162.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -46.74 -36.62 7.42 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.89 1.223 . . . . 4.1200000000000001 113.226 -177.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -79.74 -30.79 40.95 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 120.728 -1.233 . . . . 6.6500000000000004 113.858 177.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -69.36 -33.95 73.84 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.867 1.212 . . . . 1.5700000000000001 110.887 170.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -64.75 -53.47 46.64 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.606 1.162 . . . . 4.21 109.597 174.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.1 mttm -50.87 -47.15 60.52 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.406 -0.809 . . . . 5.1100000000000003 112.49 170.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -53.91 -66.72 0.34 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.575 1.55 . . . . 3.2599999999999998 112.257 173.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.4 tp -49.09 -51.38 31.97 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.571 1.948 . . . . 3.25 111.466 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 84.2 mt -61.21 -57.83 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 N-CA-C 109.321 -0.622 . . . . 2.1600000000000001 109.321 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -60.53 -30.99 70.1 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 121.491 -0.755 . . . . 5.1600000000000001 112.399 -174.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.2 mmtm -76.11 -57.95 3.57 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.25 1.82 . . . . 4.4500000000000002 112.761 176.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -108.66 6.6 25.95 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 113.519 0.933 . . . . 6.25 113.519 -163.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.8 mt -142.91 50.21 1.44 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 127.557 2.343 . . . . 4.71 108.171 168.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 24.7 t -73.19 51.34 0.31 Allowed 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 127.394 2.278 . . . . 3.75 115.9 -166.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -86.74 151.62 23.23 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.579 -1.325 . . . . 4.4699999999999998 111.67 178.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.11 -23.51 73.03 Favored Glycine 0 N--CA 1.48 1.625 0 N-CA-C 116.219 1.248 . . . . 3.9500000000000002 116.219 -167.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.459 ' CD ' ' HZ2' ' A' ' 48' ' ' LYS . 1.5 tp10 -98.26 0.69 46.16 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.558 1.143 . . . . 6.3300000000000001 112.37 174.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.9 tpt -82.65 78.38 9.28 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.679 1.591 . . . . 2.5899999999999999 107.808 171.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.459 ' HZ2' ' CD ' ' A' ' 46' ' ' GLU . 23.8 ttpt -143.87 167.9 21.21 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.849 1.66 . . . . 4.8300000000000001 110.577 -151.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -60.67 -42.37 96.92 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 119.44 -2.037 . . . . 3.6699999999999999 114.504 -161.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.9 m -72.37 -3.78 26.07 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.268 1.581 . . . . 3.77 115.268 176.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.8 p -109.3 -34.81 6.45 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.688 1.131 . . . . 2.8700000000000001 112.106 166.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.1 mt -76.29 -38.98 34.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.409 1.484 . . . . 2.7400000000000002 113.498 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -71.02 -34.46 71.34 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 120.114 1.324 . . . . 2.5899999999999999 112.898 -173.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.466 ' CG ' ' HZ2' ' A' ' 57' ' ' LYS . 4.9 m-20 -87.42 -26.34 23.34 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.815 1.646 . . . . 4.7800000000000002 113.068 175.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 62.3 tp -59.24 -44.57 92.35 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 118.312 -0.852 . . . . 3.3500000000000001 109.846 158.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -48.18 81.35 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 119.795 1.18 . . . . 2.6899999999999999 110.06 179.229 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.466 ' HZ2' ' CG ' ' A' ' 54' ' ' ASP . 32.2 mttp -58.11 -33.26 68.92 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.123 0.969 . . . . 6.6699999999999999 113.172 172.392 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.8 t -79.17 -27.02 42.65 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 114.368 1.247 . . . . 2.8100000000000001 114.368 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.5 mt -81.56 -25.87 35.49 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.734 2.014 . . . . 3.2599999999999998 111.373 174.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.511 ' C ' ' HE2' ' A' ' 61' ' ' LYS . 36.8 t0 -69.12 120.65 15.3 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.478 1.111 . . . . 1.8600000000000001 109.748 166.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.511 ' HE2' ' C ' ' A' ' 60' ' ' ASP . 0.8 OUTLIER -84.38 6.3 23.74 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 119.909 -1.745 . . . . 4.2300000000000004 114.29 -172.635 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.421 ' CG ' ' H ' ' A' ' 63' ' ' SER . 14.2 p-10 -153.03 -86.06 0.07 Allowed 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 124.83 1.252 . . . . 3.75 110.516 -170.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.421 ' H ' ' CG ' ' A' ' 62' ' ' ASN . 12.0 m 156.82 92.73 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 130.191 3.396 . . . . 3.1400000000000001 108.004 -174.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.3 p30 -152.23 -6.45 0.22 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.976 1.31 . . . . 2.21 113.399 -177.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 63.91 1.71 1.2 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 128.238 2.615 . . . . 4.5 114.288 -170.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -106.19 138.3 42.62 Favored 'General case' 0 C--O 1.246 0.872 0 C-N-CA 127.319 2.248 . . . . 3.3599999999999999 110.435 178.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 41.2 mm -103.85 98.37 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 113.709 -1.587 . . . . 2.1600000000000001 107.894 159.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.99 157.33 25.36 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.612 1.165 . . . . 2.73 111.64 163.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -55.95 -25.26 42.73 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 115.159 1.54 . . . . 3.8999999999999999 115.159 -178.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 mtmp? -87.35 -35.17 18.53 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 117.267 -1.349 . . . . 4.4699999999999998 111.893 170.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -54.2 -49.84 68.44 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 120.382 1.446 . . . . 1.98 108.979 166.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -49.93 -32.3 14.48 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 128.09 2.556 . . . . 4.1500000000000004 114.953 -178.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 72.5 p -57.93 -27.4 63.34 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.041 -1.037 . . . . 3.25 112.809 174.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 p -73.99 -30.0 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.217 -0.927 . . . . 3.4399999999999999 112.015 179.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -64.98 -49.96 68.24 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.944 -0.762 . . . . 3.1099999999999999 108.944 169.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.0 mt -61.04 -36.6 79.99 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.177 0.591 . . . . 3.1699999999999999 111.695 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.2 m -59.99 -53.16 61.12 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.714 1.206 . . . . 2.1899999999999999 111.402 174.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.9 mtm -66.94 -37.64 84.69 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 119.121 -0.466 . . . . 2.75 112.192 -177.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 92.9 mt -60.53 -47.52 85.82 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 119.095 -0.479 . . . . 3.1600000000000001 111.331 171.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 19.6 m -55.47 -39.79 70.84 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.691 0.796 . . . . 3.9199999999999999 112.795 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 36.1 mtp -70.12 -33.54 71.95 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 119.003 -0.523 . . . . 2.8799999999999999 112.235 176.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.53 -46.76 68.69 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 119.211 0.914 . . . . 1.99 113.176 -178.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -68.34 -24.25 64.79 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.333 -0.854 . . . . 4.4199999999999999 112.613 175.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -71.8 -33.37 68.5 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 114.036 1.124 . . . . 2.4900000000000002 114.036 174.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.0 -32.27 51.08 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.131 0.572 . . . . 3.1000000000000001 111.324 179.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -54.73 29.33 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.804 0.842 . . . . 3.3999999999999999 110.782 161.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -59.22 -14.96 12.58 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.277 1.431 . . . . 3.4399999999999999 113.89 177.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 41.0 mt -90.42 -12.54 37.15 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 117.273 -1.346 . . . . 2.71 114.624 172.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -102.41 -38.28 7.66 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.738 1.215 . . . . 2.8399999999999999 113.931 167.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 . . . . . 0 N--CA 1.474 0.76 0 C-N-CA 126.274 1.829 . . . . 4.1200000000000001 113.287 -177.222 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 119.211 -0.423 . . . . 3.6099999999999999 111.792 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -63.54 -26.62 69.73 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 121.643 1.562 . . . . 2.6499999999999999 112.94 178.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.91 -37.71 39.23 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.174 0.897 . . . . 3.7000000000000002 111.08 174.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -58.76 -42.04 87.98 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.314 0.961 . . . . 3.9300000000000002 111.369 170.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -62.56 -36.69 83.44 Favored 'General case' 0 N--CA 1.463 0.188 0 O-C-N 121.433 -0.792 . . . . 4.7800000000000002 111.714 176.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.29 -47.12 71.56 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 118.937 0.789 . . . . 1.8899999999999999 112.554 172.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -55.84 -50.0 71.75 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.769 1.628 . . . . 4.0199999999999996 113.346 173.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 22.0 p -66.95 -35.91 81.04 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 117.461 -1.257 . . . . 3.3900000000000001 110.821 178.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 95.9 m -59.59 -43.41 93.68 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 119.688 1.131 . . . . 2.23 110.641 170.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -60.58 -55.08 37.63 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.073 0.549 . . . . 4.9800000000000004 111.248 175.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 51.7 t -58.33 -31.79 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 CA-C-N 118.698 0.681 . . . . 3.1499999999999999 111.879 178.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 92.5 m -65.73 -57.6 7.64 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 117.614 -1.184 . . . . 2.02 110.876 175.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.7 p -57.04 -37.55 71.93 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 119.744 1.157 . . . . 2.2599999999999998 111.611 175.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -66.8 -57.9 6.13 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 123.661 0.601 . . . . 3.23 109.969 -176.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.23 -33.62 67.69 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.65 -0.656 . . . . 2.2999999999999998 112.67 -175.213 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -64.55 -34.38 78.11 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.585 1.084 . . . . 6.1500000000000004 112.198 174.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -85.85 -30.11 23.2 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.077 0.853 . . . . 3.5299999999999998 111.833 176.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' SER . . . . . 0.462 ' HG ' ' C ' ' B' ' 27' ' ' LEU . 35.3 t -69.45 -25.6 64.18 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 114.206 1.187 . . . . 2.0600000000000001 114.206 174.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.66 12.19 67.87 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.853 1.692 . . . . 2.0600000000000001 114.702 172.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -75.66 -36.73 60.05 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 118.757 1.278 . . . . 5.7999999999999998 111.935 172.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -157.34 156.87 33.07 Favored 'General case' 0 C--O 1.248 0.985 0 CA-C-O 121.637 0.732 . . . . 2.9900000000000002 111.519 -163.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.94 -128.13 46.46 Favored Glycine 0 C--N 1.338 0.689 0 N-CA-C 109.185 -1.566 . . . . 2.4300000000000002 109.185 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 38.7 m -79.02 153.51 30.21 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-O 122.345 1.069 . . . . 3.96 111.975 164.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -57.3 174.18 0.21 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 115.174 -0.921 . . . . 8.2699999999999996 110.669 142.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.462 ' C ' ' HG ' ' B' ' 20' ' ' SER . 23.6 mt 73.34 -56.99 0.64 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.603 1.561 . . . . 4.0800000000000001 109.405 -169.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 40.6 p -103.38 146.65 28.16 Favored 'General case' 0 C--O 1.255 1.367 0 N-CA-C 115.863 1.801 . . . . 1.96 115.863 -170.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 64.9 mt -102.44 103.46 13.85 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 128.484 2.714 . . . . 2.8100000000000001 111.601 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.5 p -65.77 170.76 4.92 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 115.111 1.522 . . . . 3.6600000000000001 115.111 178.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -47.6 -11.41 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 128.147 2.579 . . . . 6.1799999999999997 115.659 167.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.43 -47.91 3.14 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.812 1.245 . . . . 4.9100000000000001 112.275 168.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -52.91 -38.45 61.83 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.743 0.817 . . . . 2.29 111.428 179.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.6 tp -71.9 -45.66 60.44 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.605 0.762 . . . . 3.21 112.539 178.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -71.58 -37.19 71.04 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 120.609 -1.307 . . . . 6.2199999999999998 111.145 -176.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -54.24 -52.15 62.27 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.157 1.383 . . . . 2.8799999999999999 111.982 164.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 42.9 tp -58.24 -53.17 61.32 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.988 1.267 . . . . 3.1200000000000001 112.376 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 27.4 mt -54.64 -55.07 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 N-CA-C 109.131 -0.692 . . . . 2.0099999999999998 109.131 176.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -68.2 -11.84 59.94 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.08 1.141 . . . . 4.8899999999999997 114.08 -173.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 12.8 mmtp -92.59 -29.64 16.05 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 125.057 1.343 . . . . 4.6299999999999999 114.034 178.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -100.28 -49.93 4.1 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.635 0.774 . . . . 5.7400000000000002 111.733 177.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -81.1 56.19 2.74 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.857 1.263 . . . . 3.6200000000000001 110.383 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 72.3 m -79.24 -7.31 58.17 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.382 1.473 . . . . 4.2300000000000004 113.432 176.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -83.94 137.56 33.58 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.847 1.259 . . . . 3.5899999999999999 112.015 -176.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.1 -108.14 2.44 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.414 -0.674 . . . . 4.5199999999999996 111.414 178.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -169.08 118.46 0.68 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.08 1.752 . . . . 6.0599999999999996 106.947 -174.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.66 -13.61 60.04 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 122.231 1.015 . . . . 3.8199999999999998 112.871 -173.026 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.4 mtpp 71.93 45.8 0.39 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 128.123 2.569 . . . . 6.1699999999999999 110.215 170.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . 0.268 7.3 pt-20 -63.4 2.96 0.34 Allowed 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 119.893 3.294 . . . . 4.5199999999999996 119.893 -138.537 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 29.4 t -53.47 -29.92 38.25 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 119.129 -2.232 . . . . 3.1299999999999999 111.488 149.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 8.6 t -68.63 -15.38 63.51 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.041 1.336 . . . . 3.3900000000000001 114.003 171.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 5.9 mm -68.96 -21.68 25.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 CA-C-N 120.512 1.506 . . . . 3.02 111.461 173.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -77.36 -44.79 28.15 Favored 'General case' 0 C--O 1.224 -0.247 0 N-CA-C 113.754 1.02 . . . . 3.4399999999999999 113.754 164.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.35 -30.86 66.68 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.422 1.465 . . . . 2.54 114.086 -178.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -51.81 -39.45 58.75 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 117.997 -1.001 . . . . 3.48 110.399 162.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 23.1 mtp -63.32 -55.74 22.17 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-O 116.912 -1.518 . . . . 2.79 112.383 173.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -61.13 -32.78 72.47 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 122.238 2.29 . . . . 5.3200000000000003 112.995 -175.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 21.2 m -72.49 -42.68 64.61 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.142 1.377 . . . . 2.8300000000000001 112.183 177.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 8.8 mp -74.41 -31.89 62.48 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 117.992 -1.004 . . . . 3.6400000000000001 112.858 173.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -108.4 56.06 0.63 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 128.568 2.747 . . . . 1.99 110.863 178.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . 0.597 ' H ' ' HE2' ' B' ' 61' ' ' LYS . 0.0 OUTLIER -58.17 -19.7 35.19 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 115.453 1.649 . . . . 4.29 115.453 -173.536 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -89.34 -6.61 56.54 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.121 1.526 . . . . 2.5800000000000001 115.121 173.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 57.8 m 63.06 22.96 13.72 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.903 1.681 . . . . 3.0699999999999998 114.635 174.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 37.0 p30 -89.8 -2.33 58.2 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.505 1.122 . . . . 2.8999999999999999 111.913 177.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 74.71 -31.41 0.21 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 129.935 3.294 . . . . 4.1900000000000004 114.559 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -73.41 135.55 44.21 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 122.629 1.204 . . . . 3.0099999999999998 110.188 176.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 77.9 mt -124.42 106.23 16.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 124.8 1.24 . . . . 2.75 108.551 -176.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -90.23 160.96 15.92 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 127.043 2.137 . . . . 3.71 109.919 165.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -39.18 -42.56 0.98 Allowed 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.985 1.714 . . . . 3.8900000000000001 113.892 170.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -80.16 -10.56 59.77 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.182 0.993 . . . . 5.1399999999999997 113.471 -171.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -91.08 -47.3 7.63 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.3 1.04 . . . . 1.8999999999999999 109.509 161.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -63.57 -28.06 69.67 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 129.083 2.953 . . . . 4.2000000000000002 115.546 -171.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 13.4 p -54.48 -24.04 18.73 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.674 -1.266 . . . . 2.5499999999999998 113.033 175.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . 0.412 HG13 ' HZ2' ' B' ' 61' ' ' LYS . 2.8 p -58.1 -34.82 50.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 N-CA-C 113.009 0.744 . . . . 4.1399999999999997 113.009 171.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -66.3 -51.27 58.98 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.015 1.326 . . . . 2.6499999999999999 109.972 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 28.9 mt -61.16 -43.2 99.25 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.764 0.825 . . . . 2.52 110.123 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 24.1 m -57.49 -51.45 69.4 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.41 1.084 . . . . 2.1400000000000001 111.469 176.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 3.8 mmm -56.97 -44.7 82.88 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.568 0.747 . . . . 3.6400000000000001 112.638 178.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 96.8 mt -68.23 -43.31 78.22 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.604 0.762 . . . . 2.4100000000000001 111.668 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 80.0 m -61.64 -33.0 73.18 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.274 -0.891 . . . . 2.46 112.554 175.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 41.1 mtp -69.14 -37.91 78.53 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.163 0.892 . . . . 3.9900000000000002 112.925 171.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.54 -46.34 88.84 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.207 0.912 . . . . 2.27 112.121 174.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -64.62 -27.72 69.13 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.094 1.146 . . . . 3.77 114.094 174.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.67 -39.6 73.47 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.281 0.946 . . . . 3.4700000000000002 111.338 174.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -68.29 -40.41 81.77 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.906 0.882 . . . . 4.1799999999999997 111.475 177.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -52.68 -50.87 62.43 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.566 1.546 . . . . 4.3799999999999999 111.481 172.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -59.23 -25.72 64.26 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.256 1.422 . . . . 3.7599999999999998 113.144 -178.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 60.1 mt -77.37 -22.25 52.02 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 117.842 -1.075 . . . . 3.25 112.787 177.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -99.53 0.8 43.1 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.043 1.337 . . . . 4.1500000000000004 113.567 169.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -84.2 -36.28 22.9 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.815 1.246 . . . . 3.71 111.78 164.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -100.49 28.3 5.15 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.46 1.504 . . . . 3.2200000000000002 113.409 -170.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 3.7 ptmm? . . . . . 0 C--O 1.246 0.901 0 N-CA-C 118.011 2.597 . . . . 6.1299999999999999 118.011 -156.338 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.445 -0.724 0 N-CA-C 106.594 -1.632 . . . . 5.0800000000000001 106.594 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' THR . . . . . 0.408 ' H ' ' HB2' ' B' ' 43' ' ' CYS . 75.6 p -53.17 162.78 1.02 Allowed Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 124.289 1.036 . . . . 2.6400000000000001 111.225 164.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.75 -19.49 36.1 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 121.952 1.768 . . . . 1.6399999999999999 111.965 168.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -79.06 -41.41 28.84 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.977 0.911 . . . . 5.2000000000000002 112.24 178.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -58.06 -46.21 85.8 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.347 1.059 . . . . 4.0300000000000002 110.094 176.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -60.53 -31.86 70.92 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 114.078 1.14 . . . . 4.46 114.078 172.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.14 -34.04 75.6 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.274 0.943 . . . . 2.1299999999999999 111.655 -175.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 71.4 mt -57.86 -51.81 68.06 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.055 0.942 . . . . 3.0699999999999998 110.476 170.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 m -58.77 -43.84 90.5 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.026 1.331 . . . . 2.7200000000000002 112.004 175.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 51.2 m -60.83 -38.78 86.63 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.668 1.587 . . . . 2.2999999999999998 110.853 178.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.86 -52.8 47.29 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.171 0.988 . . . . 4.9400000000000004 111.453 172.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t -54.73 -28.8 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 O-C-N 120.555 -1.341 . . . . 3.0299999999999998 112.503 174.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 94.4 m -68.56 -46.55 69.15 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.033 1.333 . . . . 2.52 113.372 -177.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.0 p -69.41 -42.96 74.36 Favored 'General case' 0 CA--C 1.504 -0.817 0 CA-C-N 119.724 1.147 . . . . 2.8700000000000001 108.85 172.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -60.92 -57.22 13.57 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 124.622 1.201 . . . . 3.1499999999999999 110.729 -171.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -64.76 -40.84 95.95 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 122.244 -0.285 . . . . 2.5699999999999998 110.554 -175.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -67.24 -41.74 85.16 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.359 -0.838 . . . . 4.5599999999999996 112.776 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -68.8 -37.04 78.99 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.421 1.01 . . . . 3.3700000000000001 112.297 173.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.5 m -62.71 -27.31 69.17 Favored 'General case' 0 C--O 1.25 1.114 0 N-CA-C 114.934 1.457 . . . . 2.96 114.934 172.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.29 -4.63 80.73 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 126.703 2.097 . . . . 1.4099999999999999 114.071 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -54.67 -37.37 65.66 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.395 1.598 . . . . 4.6500000000000004 112.608 178.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 173.12 -155.57 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 128.858 2.863 . . . . 7.04 109.539 176.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 72.92 -142.09 31.39 Favored Glycine 0 C--N 1.336 0.582 0 C-N-CA 127.131 2.3 . . . . 2.3599999999999999 110.181 176.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.9 t -64.43 142.3 58.47 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 122.882 1.325 . . . . 3.0099999999999998 110.153 149.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -97.49 137.64 36.13 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.885 1.674 . . . . 9.9600000000000009 107.609 174.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.6 mt 92.47 -31.16 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 129.219 3.008 . . . . 5.1399999999999997 111.416 -161.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 81.5 p -116.7 161.97 18.4 Favored 'General case' 0 C--O 1.251 1.142 0 N-CA-C 114.638 1.347 . . . . 2.8399999999999999 114.638 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -120.45 102.81 8.7 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.647 1.179 . . . . 3.6899999999999999 112.162 -179.336 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.4 p -77.75 173.64 11.86 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 120.776 -1.202 . . . . 3.3999999999999999 112.381 165.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -39.51 -42.86 1.19 Allowed 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 116.857 2.169 . . . . 4.2599999999999998 116.857 -163.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.57 -26.99 45.67 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 119.632 -1.917 . . . . 5.96 114.057 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -72.95 -51.19 19.4 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 107.339 -1.356 . . . . 2.1699999999999999 107.339 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.21 -32.45 74.13 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.737 0.643 . . . . 2.8999999999999999 112.737 175.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.415 ' HZ2' ' CG ' ' A' ' 53' ' ' ASP . 43.0 mttm -67.13 -38.81 86.22 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 120.11 -1.619 . . . . 5.6699999999999999 112.784 173.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -64.66 -29.29 70.29 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-O 117.794 -1.098 . . . . 4.4800000000000004 113.634 171.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.1 tt -73.27 -66.79 0.64 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.203 1.401 . . . . 3.1299999999999999 112.358 177.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.9 mt -56.26 -43.94 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 124.647 1.179 . . . . 1.97 110.525 -168.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.3 tttp -70.97 -3.85 21.64 Favored 'General case' 0 N--CA 1.439 -1.012 0 N-CA-C 113.994 1.109 . . . . 4.7599999999999998 113.994 -176.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -108.76 -21.63 12.59 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.196 1.798 . . . . 4.5700000000000003 113.387 168.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -76.84 -62.08 1.76 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.855 2.062 . . . . 4.6200000000000001 110.047 178.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 60.3 mt -92.57 101.05 13.47 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.514 -1.366 . . . . 3.5099999999999998 113.241 -163.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 77.8 m -88.03 48.81 1.69 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.626 2.371 . . . . 4.79 112.315 -169.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 38.8 mt -129.27 -1.21 5.09 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.55 1.94 . . . . 4.0 113.791 -163.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 140.81 33.69 0.13 Allowed Glycine 0 N--CA 1.472 1.07 0 C-N-CA 125.763 1.649 . . . . 3.3900000000000001 112.752 -170.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 26.78 65.08 0.08 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 130.209 3.404 . . . . 9.5299999999999994 113.355 172.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 52.1 mmm -20.82 117.27 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.797 2.439 . . . . 3.0 117.122 -158.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.3 tmtt? -48.41 122.84 5.79 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.604 1.962 . . . . 8.2699999999999996 110.297 178.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.31 -39.66 87.8 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.019 1.489 . . . . 5.0099999999999998 115.019 -157.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.2 t -76.35 -21.41 56.15 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.525 1.057 . . . . 3.54 113.507 174.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.0 m -73.66 -9.64 58.88 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.774 -1.204 . . . . 3.6899999999999999 112.527 173.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 20.1 mm -67.59 -25.96 34.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 123.608 0.763 . . . . 3.0499999999999998 112.076 165.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.415 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 59.7 m-20 -78.04 -46.45 20.88 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 114.223 1.194 . . . . 2.7000000000000002 114.223 -163.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.28 -33.22 73.96 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.005 0.821 . . . . 3.25 110.762 166.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 67.9 tp -61.48 -39.36 90.65 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 117.982 -1.009 . . . . 2.8300000000000001 113.33 177.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 18.0 ptm -74.94 -34.5 62.09 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 120.2 1.364 . . . . 2.8900000000000001 112.973 169.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -73.83 -23.35 59.63 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 120.781 -1.199 . . . . 7.4400000000000004 112.735 -178.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.1 t -58.43 -36.89 74.31 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.958 1.703 . . . . 2.8399999999999999 111.348 163.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.6 mt -74.17 -33.69 63.55 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.128 0.971 . . . . 3.3300000000000001 111.306 178.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -80.8 94.02 6.35 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.107 1.763 . . . . 2.52 114.131 -175.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.566 ' HZ3' ' CG2' ' A' ' 74' ' ' VAL . 12.0 mptt -63.02 -34.1 76.84 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.6 1.16 . . . . 4.4400000000000004 111.594 174.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.87 -34.86 51.45 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.706 1.202 . . . . 2.5299999999999998 111.491 175.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.0 m 55.66 61.68 2.73 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.024 2.13 . . . . 4.6799999999999997 111.509 -164.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -105.77 -55.35 2.34 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 117.399 -1.286 . . . . 2.7599999999999998 112.036 -167.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 152.29 -32.35 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.73 1 C-N-CA 133.368 4.667 . . . . 5.1600000000000001 116.091 175.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -90.87 143.5 26.66 Favored 'General case' 0 C--O 1.244 0.803 0 CA-C-O 123.079 1.419 . . . . 2.5299999999999998 108.314 169.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 35.6 mm -110.45 111.43 36.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 126.302 1.841 . . . . 2.52 107.051 173.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.71 175.32 8.04 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.315 1.046 . . . . 2.9100000000000001 112.991 169.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -46.92 -48.56 21.3 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.122 1.369 . . . . 3.6499999999999999 113.682 170.233 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -80.67 -31.81 36.2 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.862 1.265 . . . . 6.9699999999999998 112.226 -171.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -55.58 -65.88 0.51 Allowed 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 123.98 0.912 . . . . 1.8 110.217 159.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -59.42 -32.6 70.33 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.26 2.224 . . . . 3.6800000000000002 114.619 -172.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 69.5 m -62.85 -14.87 51.13 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 119.909 -1.744 . . . . 2.9300000000000002 113.06 -176.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.566 ' CG2' ' HZ3' ' A' ' 61' ' ' LYS . 46.0 t -70.53 -24.22 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 O-C-N 120.893 -1.129 . . . . 3.1499999999999999 112.418 171.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -67.16 -50.0 62.76 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.473 1.109 . . . . 3.1200000000000001 110.356 171.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -56.15 -44.54 79.37 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.226 1.01 . . . . 3.4700000000000002 111.411 172.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.4 m -53.43 -57.41 10.76 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 118.544 -0.741 . . . . 1.6399999999999999 111.578 174.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 14.3 ptp -66.58 -29.09 69.08 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 118.924 0.784 . . . . 3.2599999999999998 112.864 -177.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.1 mt -67.21 -50.86 59.25 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-N 119.011 0.823 . . . . 2.3300000000000001 111.44 171.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.2 m -62.18 -34.71 76.94 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 119.056 0.843 . . . . 2.3700000000000001 112.151 177.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 35.5 mtp -65.56 -37.79 87.73 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.03 0.832 . . . . 2.7000000000000002 112.732 172.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.38 -34.71 54.9 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 119.632 1.106 . . . . 1.72 113.152 175.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.21 -28.42 69.73 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.018 0.826 . . . . 4.1200000000000001 112.993 175.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -56.41 -52.08 65.97 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.275 0.63 . . . . 2.6699999999999999 111.004 167.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.47 -32.96 66.65 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.094 1.357 . . . . 3.4700000000000002 112.509 -176.085 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -57.22 -48.94 77.53 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.476 1.51 . . . . 3.8300000000000001 110.889 170.186 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -61.41 -38.67 87.94 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.919 1.288 . . . . 4.1600000000000001 112.716 174.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.1 -20.97 64.08 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.484 0.92 . . . . 3.8300000000000001 113.484 176.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -95.02 -4.49 46.41 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.513 1.301 . . . . 4.3700000000000001 114.513 172.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.9 t70 . . . . . 0 N--CA 1.473 0.724 0 C-N-CA 125.114 1.366 . . . . 3.9300000000000002 111.685 172.73 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.542 0.661 0 N-CA-C 111.99 0.367 . . . . 4.2300000000000004 111.99 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.04 -16.6 32.17 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 121.966 1.778 . . . . 2.3599999999999999 115.097 -173.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -73.01 -49.68 27.47 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 120.671 1.578 . . . . 3.3700000000000001 110.038 177.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . 0.509 ' H ' ' CD ' ' B' ' 6' ' ' GLU . 18.7 mp0 -67.45 -45.47 75.91 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.244 1.818 . . . . 5.8799999999999999 108.748 -178.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.55 -36.4 69.24 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.098 1.359 . . . . 7.04 112.699 171.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.19 -48.78 64.33 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 117.515 -1.231 . . . . 3.6000000000000001 111.197 170.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . 0.274 0.3 OUTLIER -63.15 -24.11 67.74 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.68 1.582 . . . . 4.4500000000000002 112.962 179.674 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.1 m -52.16 -34.5 45.16 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.942 0.897 . . . . 2.1099999999999999 111.992 165.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.88 -22.04 58.88 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 117.222 -1.371 . . . . 4.0300000000000002 113.169 -179.015 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 19.9 mtp -72.02 -44.67 63.03 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 119.685 1.13 . . . . 4.5999999999999996 111.475 175.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 2.9 m -66.05 -23.84 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 O-C-N 121.055 -1.028 . . . . 3.4700000000000002 111.273 175.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 58.7 m -75.74 -49.49 18.06 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.501 1.52 . . . . 2.1600000000000001 111.707 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.2 p -66.57 -40.24 88.87 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 119.129 0.877 . . . . 2.4100000000000001 109.605 170.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -63.02 -58.88 5.81 Favored 'General case' 0 C--O 1.224 -0.284 0 O-C-N 123.872 0.732 . . . . 3.3399999999999999 110.488 -174.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -57.81 -46.43 84.7 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 118.004 0.365 . . . . 2.6099999999999999 110.588 -175.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.74 -30.53 65.7 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.333 0.864 . . . . 6.0999999999999996 113.333 -174.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -82.19 -19.69 39.32 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.104 0.866 . . . . 3.6600000000000001 112.811 169.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 21.3 p -81.22 -27.96 35.05 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.008 1.484 . . . . 2.29 115.008 178.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.06 -9.58 86.01 Favored Glycine 0 CA--C 1.538 1.504 0 O-C-N 120.506 -1.371 . . . . 2.3300000000000001 112.736 168.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.7 -23.16 63.39 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.136 1.774 . . . . 4.7800000000000002 113.923 -168.075 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -150.41 157.95 43.61 Favored 'General case' 0 C--O 1.245 0.852 0 C-N-CA 126.863 2.065 . . . . 4.1600000000000001 108.454 172.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.69 -3.91 0.21 Allowed Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.383 1.468 . . . . 2.9500000000000002 114.011 -170.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 8.5 t 41.66 -137.74 0.19 Allowed 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 124.877 1.271 . . . . 6.4299999999999997 112.9 -144.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . 0.316 0.0 OUTLIER 53.2 -176.15 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.658 1 C-N-CA 132.703 4.401 . . . . 12.359999999999999 114.893 -173.301 . . . . . . . . 4 3 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 14.4 tp -85.86 39.35 0.8 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.822 1.649 . . . . 5.4199999999999999 111.001 170.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' THR . . . . . 0.406 ' HG1' ' CD ' ' B' ' 66' ' ' GLU . 22.5 p -134.31 141.32 46.89 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.827 2.051 . . . . 2.0 112.446 -167.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 53.8 mt -97.75 98.16 9.62 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.917 1.687 . . . . 2.8900000000000001 111.2 172.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 29.1 t -54.09 151.9 6.51 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.167 1.387 . . . . 2.7599999999999998 110.893 158.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 25.4 ttm-85 -42.81 -37.56 1.84 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.52 1.928 . . . . 5.4199999999999999 115.229 -172.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 17.1 tptt -87.39 -21.81 25.41 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 118.099 2.629 . . . . 9.8699999999999992 118.099 175.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -60.29 -49.62 76.9 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 108.178 -1.045 . . . . 2.3999999999999999 108.178 164.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -56.48 -50.4 71.87 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.967 1.707 . . . . 3.7999999999999998 111.386 -177.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . 0.405 ' HZ1' ' CD ' ' B' ' 46' ' ' GLU . 0.0 OUTLIER -54.38 -42.52 70.44 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.056 1.132 . . . . 4.8799999999999999 114.056 -177.051 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -82.66 -35.53 26.79 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 118.251 -0.88 . . . . 4.9900000000000002 111.709 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.36 -42.29 81.77 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 118.096 -0.955 . . . . 3.29 111.211 175.324 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 47.3 mt -44.9 -53.84 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 CA-C-N 120.178 1.354 . . . . 2.6000000000000001 110.27 171.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 4.5 ttpm? -78.19 -0.9 30.23 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 125.346 1.458 . . . . 4.5099999999999998 114.401 -174.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.85 -33.64 6.67 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 127.1 2.16 . . . . 5.1299999999999999 111.831 175.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.14 -68.51 0.38 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.889 1.675 . . . . 4.6299999999999999 107.185 170.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.13 141.25 52.7 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 121.33 -0.856 . . . . 3.2799999999999998 109.079 170.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . 0.408 ' HB2' ' H ' ' A' ' 3' ' ' THR . 5.1 t -84.3 9.29 13.44 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.422 0.897 . . . . 4.8600000000000003 113.422 171.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 9.3 mp -89.71 153.38 20.75 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.372 1.469 . . . . 4.7199999999999998 111.688 -169.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.71 146.71 48.62 Favored Glycine 0 CA--C 1.532 1.146 0 N-CA-C 110.803 -0.919 . . . . 4.75 110.803 169.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . 0.482 ' HG2' ' H ' ' B' ' 48' ' ' LYS . 23.4 tt0 -57.26 145.38 32.06 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.845 1.054 . . . . 10.41 113.845 -164.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 76.3 mmm -40.49 -40.95 1.33 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.322 1.849 . . . . 4.6799999999999997 113.271 161.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.482 ' H ' ' HG2' ' B' ' 46' ' ' GLU . 0.8 OUTLIER 99.53 140.05 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.968 1 C-N-CA 134.613 5.165 . . . . 4.0899999999999999 108.117 -172.267 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -43.13 -47.76 6.21 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.973 1.709 . . . . 3.9199999999999999 113.579 -176.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -65.02 -15.29 62.16 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 115.39 1.626 . . . . 3.9100000000000001 115.39 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 40.5 t -92.71 -15.27 26.9 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 120.074 1.306 . . . . 3.3100000000000001 112.663 171.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 37.3 mm -65.02 -26.96 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 124.752 1.221 . . . . 3.3399999999999999 111.636 -177.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -63.72 -60.42 3.32 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 119.35 0.977 . . . . 5.96 112.417 178.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.484 ' CG ' ' HZ2' ' B' ' 57' ' ' LYS . 4.2 m-20 -72.35 -25.98 61.74 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.138 0.792 . . . . 3.4199999999999999 113.138 177.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -63.62 -58.21 7.64 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-O 118.766 -0.635 . . . . 3.6600000000000001 109.785 169.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ppp? -66.15 -36.28 82.69 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 118.935 0.789 . . . . 3.1299999999999999 110.873 -172.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . 0.484 ' HZ2' ' CG ' ' B' ' 54' ' ' ASP . 31.7 ttmt -60.1 -23.8 64.12 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 127.774 2.43 . . . . 4.6900000000000004 113.994 173.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 9.3 t -80.34 -21.82 42.07 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.939 -1.101 . . . . 3.1499999999999999 112.187 174.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.3 mt -90.67 -46.39 8.3 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.762 1.625 . . . . 3.2000000000000002 109.809 178.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -67.6 137.05 55.36 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.89 1.276 . . . . 2.4300000000000002 110.82 172.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.21 -43.08 7.52 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.545 -1.347 . . . . 3.6899999999999999 111.43 175.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -86.39 -15.1 41.44 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.294 0.85 . . . . 2.5800000000000001 113.294 -168.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 9.3 t 67.85 16.33 9.66 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.588 1.555 . . . . 2.6899999999999999 112.218 -169.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -73.47 -24.67 60.24 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 130.384 3.473 . . . . 2.1600000000000001 110.318 174.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 64.69 0.52 1.16 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 128.524 2.729 . . . . 6.54 115.573 169.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . 0.406 ' CD ' ' HG1' ' B' ' 28' ' ' THR . 1.5 mt-10 -77.14 130.67 37.64 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 108.088 -1.078 . . . . 2.1200000000000001 108.088 138.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 48.0 mt -100.54 112.97 34.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 124.999 1.32 . . . . 2.4700000000000002 108.516 173.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.94 164.31 25.9 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 122.444 0.298 . . . . 2.5800000000000001 111.466 172.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -43.83 -42.68 5.79 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.366 1.466 . . . . 3.75 113.537 179.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.425 ' HZ2' ' HB3' ' B' ' 70' ' ' LYS . 6.7 ttpm? -76.04 -25.47 55.67 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.406 2.282 . . . . 4.4199999999999999 113.842 -177.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -74.85 -50.4 17.18 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 107.77 -1.196 . . . . 1.6000000000000001 107.77 167.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -56.81 -36.04 69.46 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.618 1.967 . . . . 3.2400000000000002 115.14 -178.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 89.7 p -67.74 -15.28 63.56 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 118.684 -2.51 . . . . 2.6299999999999999 113.599 175.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 27.9 t -70.37 -30.42 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 O-C-N 120.668 -1.27 . . . . 3.1800000000000002 111.711 170.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -60.84 -53.44 57.37 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.528 -0.732 . . . . 3.8700000000000001 110.427 166.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 41.5 mt -57.23 -39.14 74.9 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.648 0.779 . . . . 2.2000000000000002 112.189 176.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 91.5 m -55.34 -56.19 22.94 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.793 1.637 . . . . 1.95 111.627 174.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 22.0 ptp -68.15 -35.83 78.7 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 112.917 0.71 . . . . 3.0899999999999999 112.917 -177.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 97.4 mt -61.84 -45.31 94.37 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 122.921 0.488 . . . . 2.8999999999999999 110.904 172.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 3.0 t -61.18 -32.19 71.93 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.173 0.897 . . . . 3.0499999999999998 112.817 177.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 68.3 mtp -71.57 -34.86 70.32 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.918 1.081 . . . . 2.8500000000000001 113.918 172.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.46 -44.2 83.4 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.763 1.165 . . . . 2.21 110.475 171.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -64.71 -22.02 66.88 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.009 0.744 . . . . 3.5800000000000001 113.009 -179.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -61.18 -62.12 2.07 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 119.245 0.929 . . . . 2.8199999999999998 112.59 162.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.97 -30.47 65.31 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 119.343 0.974 . . . . 3.6800000000000002 112.51 -172.05 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -58.44 -46.96 85.49 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.481 1.912 . . . . 4.7599999999999998 112.143 169.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -60.7 -29.7 69.49 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.443 -1.411 . . . . 4.5599999999999996 112.193 169.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 86.5 mt -83.99 -5.03 59.15 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 117.893 -1.051 . . . . 3.5 113.443 171.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . 0.474 ' HG3' ' HZ1' ' B' ' 92' ' ' LYS . 51.4 mt-10 -89.83 -23.9 21.57 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.874 1.67 . . . . 6.4699999999999998 112.618 170.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.44 -44.63 64.45 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.803 1.241 . . . . 3.52 110.682 163.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -90.34 4.02 52.02 Favored 'General case' 0 CA--C 1.558 1.265 0 N-CA-C 114.944 1.461 . . . . 3.0600000000000001 114.944 -176.105 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . 0.474 ' HZ1' ' HG3' ' B' ' 89' ' ' GLU . 1.1 tttp . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 117.969 2.581 . . . . 6.2800000000000002 117.969 -166.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 . . . . . 0 C--O 1.24 0.558 0 N-CA-C 108.702 -0.851 . . . . 4.8300000000000001 108.702 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.05 153.95 42.22 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 126.485 1.914 . . . . 2.8900000000000001 112.278 -175.086 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -65.93 -26.83 51.26 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.699 2.266 . . . . 2.4100000000000001 113.482 -167.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -65.31 -36.03 82.81 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.597 0.759 . . . . 4.21 111.238 171.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -73.11 -36.9 66.85 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.129 -0.982 . . . . 4.1200000000000001 111.321 174.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -61.93 -33.37 74.13 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.063 -1.023 . . . . 5.1799999999999997 112.491 169.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.31 -46.58 60.34 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.997 1.319 . . . . 2.4300000000000002 112.232 174.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 66.6 mt -72.41 -29.48 63.77 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 120.605 -1.309 . . . . 3.0800000000000001 113.026 177.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.8 p -71.1 -32.34 68.91 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 120.695 -1.253 . . . . 3.9500000000000002 112.669 169.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.1 m -53.96 -39.96 66.42 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.852 1.206 . . . . 2.1400000000000001 110.782 171.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -61.05 -44.24 97.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.072 0.949 . . . . 5.2400000000000002 113.48 176.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.8 m -71.5 -19.6 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 CA-C-N 119.969 1.259 . . . . 3.48 113.097 176.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 87.4 m -80.48 -33.36 36.65 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.715 2.006 . . . . 2.0699999999999998 113.211 -179.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 p -70.82 -39.78 72.85 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.216 0.916 . . . . 2.46 108.87 158.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -62.98 -57.37 10.96 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.407 0.549 . . . . 2.7200000000000002 112.326 -167.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 -54.79 -44.99 74.23 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.728 -0.608 . . . . 4.5199999999999996 111.812 174.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -67.62 -42.72 81.89 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.872 0.869 . . . . 4.9699999999999998 112.492 -171.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -78.35 -29.21 47.38 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.605 -0.685 . . . . 3.3199999999999998 112.457 174.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.4 t -56.98 -19.04 15.99 Favored 'General case' 0 C--O 1.247 0.939 0 N-CA-C 114.738 1.385 . . . . 2.5699999999999998 114.738 174.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.68 -5.04 88.61 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 116.823 -2.098 . . . . 1.8799999999999999 116.869 175.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 -76.94 -23.9 52.41 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 119.87 1.835 . . . . 5.5899999999999999 115.633 -174.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -162.65 162.29 26.95 Favored 'General case' 0 C--O 1.248 0.993 0 C-N-CA 126.861 2.065 . . . . 5.0899999999999999 109.805 -173.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 47.09 -137.58 9.7 Favored Glycine 0 N--CA 1.474 1.214 0 C-N-CA 125.836 1.684 . . . . 2.1200000000000001 113.877 174.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.2 t -73.6 167.97 20.25 Favored 'General case' 0 C--O 1.251 1.164 0 CA-C-O 123.121 1.439 . . . . 3.1600000000000001 112.982 173.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 38.9 mttp -117.07 67.47 0.73 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 130.604 3.562 . . . . 8.1999999999999993 109.501 -175.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 164.18 -10.77 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.969 1 C-N-CA 133.71 4.804 . . . . 4.7999999999999998 110.502 -174.458 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.412 ' HG1' ' CD ' ' A' ' 66' ' ' GLU . 49.6 p -107.76 160.46 15.7 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.466 2.307 . . . . 2.3999999999999999 112.282 167.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.8 mt -108.76 101.53 10.65 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.75 1.62 . . . . 2.54 111.307 162.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.4 m -71.1 160.8 32.23 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 125.102 1.361 . . . . 3.1600000000000001 113.138 -177.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -41.07 -47.03 3.08 Favored 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 115.472 1.656 . . . . 6.1100000000000003 115.472 -172.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.52 -30.29 13.41 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 121.122 1.783 . . . . 5.2599999999999998 113.271 -178.086 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -49.87 -41.73 46.09 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.665 1.186 . . . . 3.1699999999999999 110.32 163.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -68.55 -50.31 52.88 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.496 1.118 . . . . 3.8799999999999999 112.032 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -56.77 -38.52 72.59 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.223 -0.923 . . . . 4.9500000000000002 113.232 -178.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.0 tp10 -66.03 -44.17 85.44 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.36 0.664 . . . . 3.71 112.786 173.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.2 -51.65 69.06 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.664 1.185 . . . . 3.1800000000000002 111.94 -176.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 35.3 mt -54.21 -48.65 66.26 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 CA-C-O 121.925 0.869 . . . . 1.72 110.478 179.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? -69.35 -8.88 50.33 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.371 1.068 . . . . 6.0700000000000003 112.405 -176.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.61 -71.14 0.66 Allowed 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.738 1.615 . . . . 5.7800000000000002 112.805 157.474 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -40.61 -51.39 2.98 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.256 1.422 . . . . 4.3499999999999996 111.864 -172.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.32 9.76 17.0 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 115.608 1.707 . . . . 3.3599999999999999 115.608 -162.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 53.1 t -73.13 74.72 1.26 Allowed 'General case' 0 CA--C 1.551 1.012 0 CA-C-O 123.945 1.831 . . . . 3.5800000000000001 113.043 -177.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -80.5 -47.75 13.82 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 126.366 1.866 . . . . 5.9699999999999998 109.243 166.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -125.04 162.52 19.32 Favored Glycine 0 CA--C 1.534 1.281 0 N-CA-C 108.054 -2.018 . . . . 4.7999999999999998 108.054 139.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.07 120.42 31.24 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.686 1.743 . . . . 8.7899999999999991 110.591 -178.335 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.9 ptm -70.55 141.0 51.9 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.071 -1.018 . . . . 3.7999999999999998 110.825 168.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.41 166.91 22.08 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.93 1.085 . . . . 5.2300000000000004 113.93 -166.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.35 -45.33 69.11 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 127.06 2.144 . . . . 5.9900000000000002 114.087 -168.366 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.4 p -76.06 -40.41 53.3 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 126.099 1.76 . . . . 3.23 112.342 177.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.8 m -61.02 -28.6 69.17 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.43 -0.794 . . . . 3.48 112.597 174.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.3 mt -70.91 -35.09 58.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-O 117.612 -1.185 . . . . 2.2799999999999998 112.243 171.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.32 -29.0 57.13 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 120.432 1.469 . . . . 3.04 113.5 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -72.67 -38.01 67.75 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.103 0.865 . . . . 2.3700000000000001 112.025 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -58.67 -47.32 84.9 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.445 0.698 . . . . 3.5 109.666 169.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.26 -44.76 80.0 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.796 1.239 . . . . 2.54 111.93 173.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.12 -22.92 61.63 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 119.881 1.219 . . . . 4.79 113.047 173.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.1 t -80.84 -36.93 30.85 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 119.81 -1.806 . . . . 2.9900000000000002 112.714 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.5 mp -64.57 -49.08 72.58 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 121.073 -1.017 . . . . 4.1299999999999999 110.608 168.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -103.05 71.44 1.13 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.255 1.822 . . . . 2.4399999999999999 111.718 -164.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -50.97 -27.94 8.77 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.916 1.686 . . . . 3.8900000000000001 114.074 -168.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 41.4 p30 -100.69 -11.52 19.89 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.318 1.847 . . . . 2.9500000000000002 114.744 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.4 t 50.49 52.65 14.41 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.825 1.25 . . . . 4.8899999999999997 112.047 -168.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.5 p30 -83.9 -11.13 57.37 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.575 1.55 . . . . 2.48 111.1 174.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 70.28 13.72 7.6 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 130.256 3.423 . . . . 4.9900000000000002 113.997 -177.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.412 ' CD ' ' HG1' ' A' ' 28' ' ' THR . 5.2 mm-40 -131.65 120.97 23.55 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 127.209 2.204 . . . . 2.48 108.924 179.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 47.4 mt -101.72 108.14 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.004 -1.06 . . . . 2.7999999999999998 111.709 -178.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -64.34 155.74 31.34 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 127.71 2.404 . . . . 2.5499999999999998 111.571 164.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -34.68 68.33 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.477 -1.389 . . . . 3.1499999999999999 114.324 -179.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? -83.72 -24.66 31.12 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 120.497 -1.377 . . . . 4.0099999999999998 112.502 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -60.46 -54.25 47.85 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 108.777 -0.823 . . . . 1.9299999999999999 108.777 157.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -62.07 -33.05 73.69 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 126.706 2.003 . . . . 4.5899999999999999 115.77 -174.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.41 -21.65 65.56 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 120.872 -1.143 . . . . 2.4399999999999999 112.452 -171.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.1 p -57.45 -35.29 49.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 123.632 0.773 . . . . 3.29 112.573 170.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -61.79 -61.01 2.81 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 126.144 1.778 . . . . 3.5899999999999999 111.299 -173.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.5 mt -68.15 -24.54 65.0 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.451 -0.785 . . . . 3.2000000000000002 111.332 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 30.0 m -61.59 -54.88 37.07 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.199 0.909 . . . . 1.71 110.983 168.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 78.1 mtm -58.36 -37.66 75.66 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.258 0.935 . . . . 2.4300000000000002 112.888 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 43.6 mt -73.36 -46.24 50.25 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.853 0.686 . . . . 2.4399999999999999 112.853 178.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 1.7 t -71.11 -25.86 62.78 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.418 -0.801 . . . . 2.71 112.721 178.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 44.6 mmm -58.82 -48.51 81.06 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.807 1.243 . . . . 2.5099999999999998 111.657 165.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.67 -37.85 85.58 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.17 -0.957 . . . . 1.99 112.067 174.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -64.88 -33.11 75.24 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.161 1.171 . . . . 3.5299999999999998 114.161 173.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -58.25 -46.7 85.49 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.608 1.095 . . . . 2.8700000000000001 111.499 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -75.47 -35.36 60.87 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.086 1.354 . . . . 3.8500000000000001 111.984 -172.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.21 -46.02 79.63 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.991 1.716 . . . . 3.3300000000000001 110.981 167.02 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -69.02 -27.49 65.72 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.672 1.189 . . . . 3.9199999999999999 112.466 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 78.6 mt -70.33 -41.36 73.33 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.967 -1.083 . . . . 2.7200000000000002 111.546 171.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -71.47 -13.73 61.91 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.954 1.464 . . . . 3.21 114.954 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.5 t70 . . . . . 0 CA--C 1.537 0.452 0 O-C-N 121.377 -0.827 . . . . 4.6299999999999999 111.182 163.965 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 72.4 p . . . . . 0 C--O 1.237 0.42 0 N-CA-C 113.189 0.811 . . . . 3.8999999999999999 113.189 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -65.01 -14.51 45.7 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 121.571 1.514 . . . . 2.2000000000000002 112.489 168.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.2 -40.92 74.31 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-N 119.987 1.267 . . . . 4.0999999999999996 112.298 174.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -60.26 -27.6 67.38 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 120.676 1.58 . . . . 4.1500000000000004 112.58 171.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -74.7 -25.64 59.28 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.646 -1.284 . . . . 6.4500000000000002 111.869 171.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.45 -47.89 30.79 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.726 1.211 . . . . 1.8999999999999999 112.116 172.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mp -60.5 -41.63 94.71 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 120.552 1.523 . . . . 3.8199999999999998 112.086 176.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 17.6 p -65.68 -39.41 91.29 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 118.147 -0.93 . . . . 3.0800000000000001 112.231 174.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 87.8 m -57.3 -45.48 84.13 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.775 1.17 . . . . 1.96 110.893 169.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 4.4 tmm? -60.18 -53.08 61.91 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.089 1.355 . . . . 4.7800000000000002 111.584 -176.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 9.9 p -64.79 -25.06 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 O-C-N 121.241 -0.912 . . . . 3.2999999999999998 112.801 175.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 56.3 m -74.9 -45.42 42.82 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 117.978 -1.01 . . . . 1.55 111.276 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 8.6 p -58.48 -38.44 77.62 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.825 0.738 . . . . 2.2400000000000002 110.105 164.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -63.77 -51.98 62.41 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.927 -0.309 . . . . 3.6499999999999999 111.723 -173.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -78.16 -21.81 49.67 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 114.157 1.169 . . . . 2.5299999999999998 114.157 -177.276 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -68.6 -54.88 13.75 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.068 0.849 . . . . 5.0800000000000001 111.374 167.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -73.25 -27.49 61.61 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 121.577 -0.702 . . . . 3.75 112.412 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 10.5 p -68.74 -25.66 64.85 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.92 1.691 . . . . 2.5899999999999999 113.21 172.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.24 5.4 84.4 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 126.684 2.088 . . . . 1.6499999999999999 114.678 170.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -70.42 -29.11 65.63 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.166 1.483 . . . . 4.6799999999999997 112.171 172.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.414 ' CD ' ' HZ2' ' B' ' 32' ' ' LYS . 9.6 tt0 -156.75 153.84 29.03 Favored 'General case' 0 C--O 1.249 1.034 0 CA-C-O 121.899 0.857 . . . . 3.9500000000000002 112.255 176.542 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 58.08 -127.82 46.03 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 126.689 2.09 . . . . 2.7200000000000002 110.972 166.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.91 121.69 11.14 Favored 'General case' 0 C--O 1.249 1.027 0 O-C-N 122.267 -0.549 . . . . 3.6200000000000001 110.127 167.086 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -76.72 54.74 1.0 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 128.367 2.667 . . . . 8.4700000000000006 110.393 166.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 53.7 tp -161.28 -51.09 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 126.213 1.805 . . . . 3.4900000000000002 107.906 -178.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.6 p -92.28 157.42 16.67 Favored 'General case' 0 C--O 1.254 1.338 0 CA-C-O 123.513 1.625 . . . . 2.8599999999999999 112.626 175.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -103.4 107.21 17.95 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 111.636 -2.529 . . . . 4.3499999999999996 107.814 167.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 41.4 t -70.91 143.03 51.1 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 108.594 -0.891 . . . . 2.75 108.594 161.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -24.36 -51.51 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 128.727 2.811 . . . . 6.7999999999999998 116.352 -175.217 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.414 ' HZ2' ' CD ' ' B' ' 23' ' ' GLU . 0.0 OUTLIER -59.0 -44.18 91.63 Favored 'General case' 0 CA--C 1.554 1.112 0 N-CA-C 116.107 1.891 . . . . 5.75 116.107 174.134 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -59.95 -43.74 94.81 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.862 2.065 . . . . 1.8 109.514 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.38 -44.93 70.5 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.245 1.418 . . . . 4.3799999999999999 110.834 -179.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -54.96 -42.11 71.94 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.069 -1.02 . . . . 3.5 112.283 174.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -59.9 -49.06 79.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.532 0.733 . . . . 3.0299999999999998 111.805 174.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.5 tp -57.78 -44.52 86.29 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.144 0.978 . . . . 3.3599999999999999 112.715 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 73.8 mt -56.74 -55.4 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 N-CA-C 109.558 -0.534 . . . . 2.2799999999999998 109.558 171.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -63.5 -17.52 62.84 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 112.95 0.722 . . . . 5.2400000000000002 112.95 -175.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -87.25 -48.56 7.92 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 125.902 1.681 . . . . 5.7400000000000002 113.917 -178.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -116.09 -8.84 11.77 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 125.399 1.687 . . . . 6.5499999999999998 114.384 -159.254 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 24.0 tp -121.34 88.72 2.99 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.753 1.221 . . . . 3.8199999999999998 109.073 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 17.9 p -82.4 13.89 3.34 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 115.088 1.514 . . . . 4.96 115.088 -157.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 8.0 mp -75.98 134.16 40.24 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.121 0.968 . . . . 4.7000000000000002 111.173 -169.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.59 -20.97 59.86 Favored Glycine 0 CA--C 1.532 1.15 0 CA-C-O 119.625 -0.541 . . . . 3.4199999999999999 113.83 177.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . 0.421 ' C ' ' H ' ' B' ' 48' ' ' LYS . 23.2 mm-40 -87.39 -3.81 59.02 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.886 1.275 . . . . 5.6900000000000004 113.629 175.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 7.3 tpt -77.06 39.16 0.23 Allowed 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 124.309 2.004 . . . . 3.0 112.144 171.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.421 ' H ' ' C ' ' B' ' 46' ' ' GLU . 60.0 mttp -57.84 125.89 25.01 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 127.138 2.175 . . . . 4.6500000000000004 109.848 -174.329 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 65.1 tt0 -58.38 -29.37 65.97 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 115.267 1.58 . . . . 4.0999999999999996 115.267 -166.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -66.66 -14.39 62.41 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 120.556 1.525 . . . . 2.9199999999999999 113.789 173.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 9.4 t -97.19 -7.84 31.44 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.669 1.588 . . . . 2.9300000000000002 112.422 172.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 12.5 mt -65.28 -40.39 88.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 119.843 1.202 . . . . 2.1099999999999999 110.813 176.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -72.0 -23.89 61.48 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.206 0.817 . . . . 3.0800000000000001 113.206 -174.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -76.1 -37.22 58.38 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.467 0.707 . . . . 2.3900000000000001 111.809 172.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 10.3 tt -62.62 -49.39 75.38 Favored 'General case' 0 C--N 1.343 0.316 0 O-C-N 121.506 -0.746 . . . . 3.5800000000000001 110.184 168.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.09 -48.78 67.49 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 124.341 1.056 . . . . 3.5 111.72 177.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -58.4 -36.47 73.61 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.313 1.845 . . . . 4.7699999999999996 113.056 173.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 67.9 m -77.57 -19.43 55.67 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.317 1.847 . . . . 2.8199999999999998 114.315 177.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 20.4 mt -78.08 -54.37 6.34 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.338 -0.851 . . . . 2.96 109.568 159.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -82.88 53.43 2.41 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 129.699 3.2 . . . . 2.0600000000000001 112.197 -172.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -58.53 -19.17 35.42 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.049 1.74 . . . . 4.3799999999999999 113.642 -172.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 50.9 p30 -96.23 -8.33 33.23 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.39 1.876 . . . . 2.52 115.145 174.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 68.1 m 60.68 28.64 18.35 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.916 1.686 . . . . 2.8999999999999999 114.743 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 47.1 p30 -79.11 -8.54 59.06 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.173 -0.954 . . . . 2.29 111.562 177.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 71.12 -15.22 0.42 Allowed 'General case' 0 C--O 1.236 0.369 0 C-N-CA 131.038 3.735 . . . . 4.0800000000000001 115.282 171.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -78.3 150.14 33.37 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-O 122.752 1.263 . . . . 3.71 110.16 159.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 37.1 mm -113.72 112.14 39.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 125.824 1.649 . . . . 2.4500000000000002 108.561 164.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . 0.414 ' CG ' ' HZ1' ' B' ' 70' ' ' LYS . 0.0 OUTLIER -82.73 168.68 16.97 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.607 1.163 . . . . 2.8799999999999999 111.315 163.54 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -56.63 -33.27 66.14 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.508 0.929 . . . . 3.8700000000000001 113.508 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.414 ' HZ1' ' CG ' ' B' ' 68' ' ' ASP . 8.6 mtmp? -70.14 -44.28 69.19 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.555 -1.34 . . . . 4.8399999999999999 111.975 176.378 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -59.59 -47.91 83.74 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 118.838 0.744 . . . . 1.77 109.812 171.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -59.42 -31.91 69.71 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.849 1.66 . . . . 3.1400000000000001 114.851 179.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 38.3 t -56.43 -30.63 63.06 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.753 -1.217 . . . . 2.25 112.518 171.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 45.5 t -60.13 -44.47 95.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 O-C-N 121.394 -0.817 . . . . 2.6200000000000001 110.471 175.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -58.24 -53.3 59.88 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.659 0.784 . . . . 2.5600000000000001 111.384 176.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 59.8 mt -60.28 -40.2 89.6 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.131 0.973 . . . . 2.5099999999999998 111.604 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.9 m -62.02 -53.26 58.12 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.322 1.449 . . . . 1.79 110.981 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.9 mtm -57.43 -38.79 74.95 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.383 0.512 . . . . 2.2799999999999998 112.383 179.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 95.1 mt -70.39 -47.28 61.59 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 118.572 -0.728 . . . . 2.5099999999999998 111.699 178.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 65.0 m -64.4 -30.18 71.23 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 120.034 1.288 . . . . 2.6299999999999999 113.872 175.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 81.3 mtp -64.39 -48.69 74.49 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.074 0.852 . . . . 3.1400000000000001 111.242 165.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.76 -39.01 92.84 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.298 0.953 . . . . 1.8999999999999999 112.513 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -66.66 -33.31 75.36 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.427 1.012 . . . . 4.7699999999999996 112.803 174.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.96 -49.99 58.5 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.271 1.028 . . . . 2.4700000000000002 111.001 172.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -64.2 -46.69 82.8 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.802 1.241 . . . . 4.2000000000000002 110.725 -175.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -62.39 -41.26 98.53 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.234 1.813 . . . . 3.0499999999999998 112.509 174.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -64.26 -32.43 74.02 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 120.802 -1.186 . . . . 3.8700000000000001 111.104 174.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 66.0 mt -73.22 -17.25 61.37 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 117.934 -1.031 . . . . 2.8900000000000001 113.573 173.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -83.34 -15.01 51.66 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.905 1.23 . . . . 4.8700000000000001 113.679 168.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -85.57 -59.65 2.25 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.075 1.35 . . . . 3.1200000000000001 111.645 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.62 -4.67 32.3 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 115.064 1.505 . . . . 2.8599999999999999 115.064 -170.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.046 0 C-N-CA 126.649 1.98 . . . . 4.7800000000000002 114.969 175.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.4 mp0 . . . . . 0 CA--C 1.534 0.347 0 N-CA-C 107.169 -1.419 . . . . 4.9199999999999999 107.169 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 24.9 p -151.73 157.73 34.4 Favored Pre-proline 0 C--O 1.238 0.485 0 C-N-CA 128.569 2.747 . . . . 3.98 108.617 177.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.77 -25.98 16.43 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 122.926 2.418 . . . . 3.02 111.199 162.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.66 -47.01 85.55 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.676 1.59 . . . . 3.7799999999999998 112.351 -178.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -60.8 -34.73 74.95 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.258 0.481 . . . . 4.0599999999999996 111.746 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.33 -28.82 65.42 Favored 'General case' 0 CA--C 1.552 1.033 0 O-C-N 119.851 -1.781 . . . . 5.2999999999999998 112.17 175.424 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.16 -39.89 62.95 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.63 -0.669 . . . . 2.6400000000000001 111.657 173.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 97.6 mt -59.9 -47.0 87.55 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.859 0.754 . . . . 2.27 110.887 172.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 m -52.96 -54.52 33.76 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.424 1.49 . . . . 3.71 112.031 171.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.7 t -66.86 -28.48 68.37 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-N 120.5 1.5 . . . . 3.9100000000000001 112.879 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.98 -48.45 63.1 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 117.782 -1.104 . . . . 4.8200000000000003 112.365 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.0 p -63.74 -24.5 35.97 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-N 120.689 1.586 . . . . 3.52 111.848 175.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.9 m -73.9 -53.07 10.96 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.347 1.459 . . . . 1.9299999999999999 111.923 179.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.4 p -63.77 -35.01 79.18 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.701 1.137 . . . . 2.4700000000000002 110.533 171.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -59.05 -62.87 1.56 Allowed 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 108.925 -0.768 . . . . 2.9700000000000002 108.925 177.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.99 -31.13 69.74 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.647 1.112 . . . . 2.48 112.725 -172.165 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -57.77 -49.25 77.22 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.704 -0.623 . . . . 5.0499999999999998 112.358 169.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -83.94 -29.57 26.99 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.951 -1.093 . . . . 4.2999999999999998 113.397 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.9 p -69.46 -30.69 68.65 Favored 'General case' 0 C--O 1.242 0.689 0 O-C-N 120.82 -1.175 . . . . 2.9900000000000002 111.047 172.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.57 -1.15 70.04 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 127.518 2.485 . . . . 1.8799999999999999 115.467 171.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -72.23 -42.56 65.55 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.879 1.839 . . . . 6.6399999999999997 111.37 -177.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -149.56 166.44 29.22 Favored 'General case' 0 C--O 1.244 0.775 0 C-N-CA 125.781 1.633 . . . . 3.8500000000000001 113.011 -177.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.62 -132.77 51.62 Favored Glycine 0 C--N 1.339 0.735 0 C-N-CA 125.292 1.425 . . . . 2.5800000000000001 110.779 171.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.5 m -64.34 138.21 58.31 Favored 'General case' 0 C--O 1.249 1.051 0 O-C-N 121.934 -0.745 . . . . 2.9900000000000002 110.555 163.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 36.1 pttt -67.81 -24.81 65.33 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.31 0.644 . . . . 6.2699999999999996 111.929 171.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.0 mt -81.57 -23.74 36.95 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.931 1.292 . . . . 4.6200000000000001 113.683 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 61.1 p -109.26 146.15 34.74 Favored 'General case' 0 C--O 1.244 0.799 0 CA-C-N 119.934 1.243 . . . . 2.1800000000000002 111.276 175.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.84 83.37 2.54 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.245 -1.02 . . . . 3.3199999999999998 108.245 163.251 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.0 m -58.16 143.62 43.4 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 123.914 0.885 . . . . 4.1799999999999997 108.803 176.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 35.7 ptt-85 -47.47 -34.89 7.89 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 117.241 2.312 . . . . 7.7300000000000004 117.241 -158.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.5 ptmm? -51.76 -39.53 58.71 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 116.337 1.977 . . . . 5.5300000000000002 116.337 168.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -68.1 -52.57 33.49 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 128.334 2.654 . . . . 1.6599999999999999 108.747 169.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.6 tp -64.37 -33.95 77.03 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.799 0.666 . . . . 3.6499999999999999 112.799 -172.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -8.84 54.07 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 115.184 1.55 . . . . 5.8099999999999996 115.184 -179.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -74.96 -66.79 0.71 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 118.592 -0.718 . . . . 3.9500000000000002 109.758 156.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 31.8 tp -44.33 -54.49 5.76 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.319 1.448 . . . . 3.7400000000000002 113.26 -167.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 28.6 mt -48.14 -44.47 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 123.43 0.692 . . . . 2.0 112.102 -176.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.275 0.0 OUTLIER -84.45 -9.07 58.71 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-O 118.626 -0.702 . . . . 5.0 110.896 -167.769 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -67.28 -57.58 6.39 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.733 1.151 . . . . 3.4900000000000002 109.627 168.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -54.95 -69.16 0.14 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.885 2.074 . . . . 4.5099999999999998 110.421 171.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -79.23 65.23 4.34 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.66 1.219 . . . . 3.7400000000000002 108.402 176.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.8 p -59.96 -55.09 38.31 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.411 1.884 . . . . 3.98 111.647 176.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.4 mp -14.28 -110.82 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.737 1 C-N-CA 132.378 4.271 . . . . 5.04 115.876 -174.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -147.13 -28.63 0.07 OUTLIER Glycine 0 N--CA 1.473 1.119 0 O-C-N 121.473 -0.767 . . . . 4.3300000000000001 114.595 175.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 27.1 mp0 -63.24 -43.04 99.15 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 128.339 2.656 . . . . 5.5199999999999996 111.581 -177.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.17 67.59 6.04 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 123.961 1.838 . . . . 2.1200000000000001 110.333 165.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.3 tptp -72.5 160.23 32.64 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 111.49 -2.595 . . . . 7.7599999999999998 109.652 160.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.536 ' CD ' ' H ' ' A' ' 49' ' ' GLU . 4.4 mp0 -52.25 -45.85 65.53 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.624 1.57 . . . . 4.75 113.188 -170.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.8 t -80.02 -15.17 57.77 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.507 1.299 . . . . 3.4399999999999999 114.507 178.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.9 m -68.04 -19.27 64.87 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.129 1.332 . . . . 3.1699999999999999 111.712 173.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 70.6 mt -85.93 -24.12 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 125.548 1.539 . . . . 2.4500000000000002 112.808 -175.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -57.0 -58.08 9.74 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.698 -0.852 . . . . 3.6200000000000001 108.698 162.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -66.45 -38.61 87.74 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.339 0.866 . . . . 2.5299999999999998 113.339 -175.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.68 -51.35 70.32 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 118.582 -0.723 . . . . 3.5299999999999998 110.395 171.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.08 -33.26 70.03 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.236 0.925 . . . . 2.71 112.5 -176.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.3 mtpt -58.72 -39.38 80.67 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.446 1.021 . . . . 5.6900000000000004 112.489 170.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.7 t -77.41 -30.37 53.48 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.617 0.969 . . . . 2.73 113.617 173.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.52 -36.36 76.36 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 124.398 1.079 . . . . 3.79 112.143 178.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -72.45 77.48 1.04 Allowed 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.682 1.193 . . . . 1.6200000000000001 111.276 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 3.5 0.21 Allowed 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.863 1.665 . . . . 6.4100000000000001 114.974 -170.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 38.7 p30 -137.67 -0.79 2.11 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 127.298 2.239 . . . . 3.8799999999999999 114.525 173.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.9 m 60.73 37.48 18.92 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 115.182 1.549 . . . . 4.5800000000000001 115.182 168.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -88.11 -32.0 18.92 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 126.905 2.082 . . . . 2.7599999999999998 112.975 177.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 105.89 -1.17 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.043 1 C-N-CA 136.455 5.902 . . . . 4.6399999999999997 114.087 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -107.92 136.38 47.73 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 128.21 2.604 . . . . 2.5800000000000001 110.429 178.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 24.7 mm -112.05 114.34 46.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 124.173 0.989 . . . . 2.4100000000000001 108.468 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -103.48 156.92 17.4 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.558 2.343 . . . . 3.3199999999999998 108.589 173.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -37.82 -45.19 0.81 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.976 1.71 . . . . 3.8399999999999999 114.241 176.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.3 pttt -63.9 -18.31 64.07 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.965 1.306 . . . . 4.4299999999999997 114.025 -177.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -105.14 -53.17 2.71 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 127.797 2.439 . . . . 2.9100000000000001 108.147 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -45.25 -35.1 3.17 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 128.384 2.674 . . . . 3.4900000000000002 114.81 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.1 m -68.79 -15.3 63.47 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 120.657 -1.277 . . . . 2.2999999999999998 113.182 178.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 84.3 t -67.06 -31.37 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-N 119.348 0.977 . . . . 3.1299999999999999 110.637 169.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -59.33 -53.19 61.08 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 118.983 0.811 . . . . 2.8999999999999999 110.323 168.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 22.1 mt -62.73 -35.91 81.28 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.255 0.622 . . . . 2.6099999999999999 111.186 -176.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.4 m -63.2 -42.39 99.31 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 125.12 1.368 . . . . 2.3100000000000001 111.507 172.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 44.3 ttm -61.6 -42.6 99.1 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.499 1.12 . . . . 4.0999999999999996 111.431 178.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.34 -56.66 10.05 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.056 0.543 . . . . 3.9399999999999999 111.253 173.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.3 m -60.99 -34.34 74.65 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.8 1.037 . . . . 2.3999999999999999 113.8 -175.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 56.0 mtp -76.7 -24.99 53.11 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.927 1.24 . . . . 3.2799999999999998 113.918 173.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.3 -43.63 40.61 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 120.525 1.511 . . . . 2.1200000000000001 111.454 169.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -63.61 -28.73 70.12 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.494 1.043 . . . . 3.4399999999999999 112.914 173.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -54.38 -56.72 15.72 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.577 0.751 . . . . 2.7400000000000002 111.75 165.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.75 -42.35 81.93 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.855 0.862 . . . . 3.2400000000000002 111.661 -176.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.52 -44.44 69.14 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.589 1.956 . . . . 3.3100000000000001 112.347 172.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -70.62 -32.2 69.44 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.577 -1.327 . . . . 4.3300000000000001 111.723 176.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.3 mt -84.41 -1.52 55.69 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 125.466 1.507 . . . . 2.9700000000000002 113.546 174.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -74.11 -22.42 59.48 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 121.088 -1.007 . . . . 5.2300000000000004 112.348 162.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.2 t70 . . . . . 0 CA--C 1.545 0.777 0 C-N-CA 126.379 1.872 . . . . 5.0099999999999998 111.39 176.931 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 48.4 p . . . . . 0 N--CA 1.469 0.486 0 N-CA-C 112.629 0.603 . . . . 2.3799999999999999 112.629 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -63.41 -20.66 70.51 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 121.818 1.679 . . . . 2.4300000000000002 112.898 168.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -80.19 -43.39 21.62 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-O 117.136 -1.412 . . . . 3.4199999999999999 111.905 175.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.93 -46.98 81.67 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.436 1.471 . . . . 4.6200000000000001 110.922 168.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -57.97 -27.8 63.78 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.103 -0.998 . . . . 6.1600000000000001 112.959 172.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.09 -39.85 54.39 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 120.597 -1.314 . . . . 3.02 111.659 176.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 96.0 mt -66.22 -32.5 73.96 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.016 0.926 . . . . 2.7400000000000002 112.011 171.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.4 m -60.44 -55.98 26.96 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.087 0.858 . . . . 2.8199999999999998 110.777 161.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 83.4 m -53.07 -39.48 63.33 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.15 1.38 . . . . 3.3500000000000001 111.375 -174.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -48.25 -42.6 30.91 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.027 1.731 . . . . 4.7999999999999998 112.864 174.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 66.4 t -62.41 -28.64 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 124.967 1.307 . . . . 3.3900000000000001 112.674 178.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 14.5 m -66.07 -39.96 90.5 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.991 1.716 . . . . 1.9099999999999999 112.423 -179.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -44.94 68.34 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 126.548 1.939 . . . . 2.4100000000000001 108.713 169.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -67.73 -43.97 78.72 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 123.719 0.637 . . . . 3.29 111.721 -169.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.46 -47.84 83.93 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.895 0.878 . . . . 3.4100000000000001 111.479 170.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.419 ' HZ2' ' HB2' ' B' ' 18' ' ' LYS . 3.7 ttmp? -73.19 -40.61 64.63 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.667 0.988 . . . . 4.6299999999999999 113.667 -171.222 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -70.67 -26.07 63.27 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.047 -0.978 . . . . 3.5800000000000001 112.187 166.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 32.3 m -68.19 -40.54 82.19 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 120.702 1.592 . . . . 2.2799999999999998 113.118 167.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.59 -12.88 83.78 Favored Glycine 0 CA--C 1.532 1.153 0 C-N-CA 125.769 1.652 . . . . 1.78 112.9 -178.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.06 97.83 0.53 Allowed 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 105.832 -1.914 . . . . 5.4800000000000004 105.832 153.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 65.17 175.45 0.21 Allowed 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 126.175 1.79 . . . . 5.4400000000000004 114.655 167.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.66 -140.03 30.56 Favored Glycine 0 N--CA 1.474 1.231 0 C-N-CA 125.919 1.723 . . . . 2.6800000000000002 113.036 174.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 67.6 m -78.36 162.42 26.47 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.517 -0.99 . . . . 3.9700000000000002 112.553 171.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 19.2 ttmt -85.65 128.24 34.72 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 127.187 2.195 . . . . 7.7699999999999996 107.363 156.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.0 tt 91.59 -24.66 0.06 Allowed 'General case' 0 N--CA 1.492 1.625 0 C-N-CA 128.819 2.848 . . . . 4.6200000000000001 112.321 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.55 137.1 47.06 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 125.287 1.435 . . . . 2.5099999999999998 109.623 170.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 75.7 mt -98.29 98.39 9.65 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.928 1.291 . . . . 2.5499999999999998 110.627 175.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 3.6 m -52.43 153.56 2.93 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 122.102 0.953 . . . . 2.8900000000000001 112.493 163.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 19.1 ttp85 -48.52 -39.55 23.7 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.893 1.277 . . . . 4.3099999999999996 114.162 -172.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -68.59 -40.72 80.37 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 119.58 -1.95 . . . . 7.0700000000000003 111.7 178.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -53.77 -51.13 64.39 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.638 1.575 . . . . 1.76 109.245 177.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 15.0 tp -64.77 -45.61 85.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.477 1.111 . . . . 3.0099999999999998 112.657 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 2.1 tmpt? -58.17 -34.31 70.18 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 118.883 0.765 . . . . 5.9900000000000002 111.711 175.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -68.64 -54.54 15.75 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.624 0.769 . . . . 4.4000000000000004 111.676 172.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.43 -52.74 64.17 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 126.16 1.784 . . . . 3.2200000000000002 112.294 -176.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 29.0 mt -59.72 -44.44 93.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 119.338 0.972 . . . . 2.3700000000000001 110.092 178.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.446 ' HZ1' ' CD ' ' B' ' 49' ' ' GLU . 13.8 tppt? -66.65 -11.79 55.36 Favored 'General case' 0 CA--C 1.557 1.23 0 O-C-N 121.512 -0.743 . . . . 5.8200000000000003 112.488 178.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmtm -105.46 -35.59 7.43 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.796 2.038 . . . . 6.1399999999999997 114.591 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -69.71 -63.26 1.11 Allowed 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 124.8 1.24 . . . . 5.04 109.668 170.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -86.32 56.83 4.16 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.022 0.929 . . . . 3.2799999999999998 108.976 179.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 4.8 t -70.09 24.78 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 125.588 1.555 . . . . 3.7799999999999998 114.868 -173.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 38.6 mt -77.41 -3.86 42.41 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 128.746 2.818 . . . . 4.4199999999999999 113.516 -177.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.14 -49.24 4.19 Favored Glycine 0 N--CA 1.47 0.945 0 C-N-CA 125.042 1.306 . . . . 4.75 112.692 179.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -60.48 -10.16 4.61 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.583 1.553 . . . . 5.46 114.381 176.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 8.0 tpt -71.31 69.05 0.54 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.106 1.762 . . . . 2.5699999999999998 111.203 170.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -88.94 153.41 21.05 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.656 1.982 . . . . 4.46 112.845 -166.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.446 ' CD ' ' HZ1' ' B' ' 39' ' ' LYS . 5.3 mp0 -49.64 -57.32 7.42 Favored 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 127.12 2.168 . . . . 4.25 112.096 -165.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 12.0 m -73.12 -0.21 13.45 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.317 1.599 . . . . 3.2599999999999998 115.317 -179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 15.7 t -97.27 -33.39 11.47 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.437 1.095 . . . . 3.2400000000000002 111.451 164.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 38.8 mt -58.81 -35.33 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 124.677 1.191 . . . . 2.5899999999999999 110.015 166.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -61.66 -25.04 67.14 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.515 1.126 . . . . 3.8399999999999999 113.829 170.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.5 ' HA ' ' HE2' ' B' ' 57' ' ' LYS . 7.8 t70 -89.93 -32.95 16.6 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 121.021 1.737 . . . . 4.1799999999999997 113.051 173.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -52.0 -41.72 62.41 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 118.646 -0.693 . . . . 3.5699999999999998 109.42 158.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -53.49 52.56 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 120.139 1.336 . . . . 3.04 111.55 175.389 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . 0.5 ' HE2' ' HA ' ' B' ' 54' ' ' ASP . 30.0 mtmm -51.1 -44.1 61.21 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 118.988 0.813 . . . . 4.3499999999999996 112.9 176.119 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 38.9 m -76.06 -40.39 53.37 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.895 1.278 . . . . 2.5099999999999998 113.279 -176.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 9.6 mp -71.36 -35.8 71.26 Favored 'General case' 0 C--O 1.225 -0.194 0 O-C-N 120.959 -1.088 . . . . 3.4300000000000002 111.808 178.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -100.11 98.49 9.2 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 119.612 1.096 . . . . 1.4299999999999999 113.897 -163.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -98.14 -14.8 20.22 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.933 1.693 . . . . 4.0599999999999996 115.278 -176.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.88 -21.27 60.15 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 119.448 1.022 . . . . 2.8300000000000001 110.303 152.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 50.6 m 60.78 66.69 0.89 Allowed 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.04 1.736 . . . . 4.8399999999999999 111.165 168.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -147.3 -116.49 0.07 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.665 1.586 . . . . 3.5600000000000001 109.5 -148.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -149.74 -5.18 0.36 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 116.57 2.063 . . . . 4.54 116.57 169.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -115.37 139.13 50.27 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.89 1.276 . . . . 2.46 111.527 167.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 8.0 mm -94.27 110.78 24.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 126.24 1.816 . . . . 2.1699999999999999 109.858 172.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -58.22 156.26 10.1 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.593 1.157 . . . . 3.3999999999999999 110.705 166.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.99 -39.52 66.1 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.164 -1.585 . . . . 3.5499999999999998 111.525 169.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -76.59 -18.07 58.84 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.751 1.389 . . . . 4.9400000000000004 114.751 178.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -73.97 -50.33 20.46 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 108.322 -0.992 . . . . 1.8799999999999999 108.322 163.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -61.1 -26.28 67.56 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 128.814 2.845 . . . . 2.9500000000000002 115.338 -177.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 68.6 m -47.91 -34.55 9.17 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 120.851 -1.156 . . . . 2.5499999999999998 113.441 172.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 6.6 m -69.22 -22.45 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 O-C-N 121.208 -0.933 . . . . 3.8100000000000001 113.155 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -64.97 -59.54 4.05 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.101 0.96 . . . . 2.8300000000000001 110.031 175.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 58.6 mt -55.19 -37.65 67.34 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.792 0.837 . . . . 2.54 110.839 176.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 30.8 m -57.95 -61.84 2.25 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.619 1.168 . . . . 2.02 111.677 173.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 24.3 ptp -68.08 -32.21 72.37 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 118.949 0.795 . . . . 3.1400000000000001 112.848 -174.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -46.02 81.22 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.923 0.889 . . . . 4.2800000000000002 110.529 175.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.6 t -69.9 -27.67 64.98 Favored 'General case' 0 CA--C 1.545 0.786 0 O-C-N 121.736 -0.602 . . . . 3.1200000000000001 112.5 175.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 61.6 mtp -67.19 -40.38 86.53 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.837 -1.164 . . . . 2.7999999999999998 112.768 168.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.81 -37.3 78.76 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.566 1.076 . . . . 1.6000000000000001 111.397 172.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 5.0 m-30 -65.7 -24.16 66.93 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.955 1.094 . . . . 3.3799999999999999 113.955 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -70.28 -41.3 73.59 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 119.82 1.191 . . . . 3.2999999999999998 111.866 174.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -65.61 -44.56 86.19 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.375 1.07 . . . . 3.3199999999999998 110.519 176.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.82 -47.05 77.88 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.14 1.776 . . . . 3.1099999999999999 111.884 174.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -63.66 -21.37 66.34 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.192 1.397 . . . . 3.9500000000000002 112.382 175.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 85.5 mt -88.27 -7.19 57.16 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 114.305 1.224 . . . . 2.7000000000000002 114.305 176.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -70.18 -35.2 73.79 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.171 0.896 . . . . 5.1399999999999997 111.779 161.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -100.75 -65.34 0.97 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.538 1.935 . . . . 3.54 112.681 -168.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -79.91 34.36 0.29 Allowed 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 125.594 1.558 . . . . 3.9100000000000001 112.501 175.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.875 0 C-N-CA 131.521 3.928 . . . . 7.4500000000000002 117.518 -172.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 . . . . . 0 CA--C 1.537 0.445 0 N-CA-C 108.633 -0.877 . . . . 3.75 108.633 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.2 p -153.26 179.61 1.25 Allowed Pre-proline 0 N--CA 1.478 0.965 0 C-N-CA 127.03 2.132 . . . . 2.3599999999999999 109.123 169.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -76.9 -9.31 18.12 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 121.471 1.447 . . . . 1.6399999999999999 113.7 171.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -76.92 -49.63 15.15 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.022 1.329 . . . . 3.8100000000000001 112.67 -178.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -56.66 -34.96 67.86 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.574 1.079 . . . . 4.5 110.876 169.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.7 mtpm? -73.24 -26.65 61.21 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.575 -1.328 . . . . 5.7000000000000002 113.415 173.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.0 -49.99 39.11 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.756 1.222 . . . . 2.5099999999999998 109.921 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.3 mt -56.16 -45.49 79.65 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.319 1.048 . . . . 2.8500000000000001 111.258 171.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.4 m -54.42 -53.34 55.48 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.091 0.956 . . . . 2.77 111.736 171.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 t -67.39 -32.76 73.9 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 120.094 1.315 . . . . 3.5099999999999998 112.172 -178.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 95.4 mtp -59.0 -51.65 69.16 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.412 1.085 . . . . 3.8100000000000001 112.452 169.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.2 m -68.82 -28.55 40.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 CA-C-N 119.153 0.888 . . . . 3.3199999999999998 112.745 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 90.9 m -60.84 -57.02 14.41 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.88 1.272 . . . . 2.0800000000000001 110.089 173.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -57.94 -40.06 79.59 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 122.789 0.436 . . . . 3.0 110.736 172.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -64.14 -47.86 78.29 Favored 'General case' 0 C--N 1.334 -0.077 0 C-N-CA 119.901 -0.719 . . . . 3.0099999999999998 112.078 -171.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -40.67 74.57 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.881 1.218 . . . . 2.8799999999999999 111.759 178.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -58.37 -47.33 84.17 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.684 1.993 . . . . 4.3499999999999996 113.427 178.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -70.78 -37.38 73.33 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.827 0.851 . . . . 3.5099999999999998 112.481 168.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.3 m -64.22 -20.59 66.13 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.816 -1.178 . . . . 2.7599999999999998 113.771 178.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -98.33 40.35 2.51 Favored Glycine 0 CA--C 1.533 1.186 0 C-N-CA 127.501 2.477 . . . . 1.99 113.11 171.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.1 mmp_? -105.08 -17.89 14.34 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.275 1.03 . . . . 5.6900000000000004 113.169 167.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.497 ' CD ' ' HZ3' ' A' ' 32' ' ' LYS . 28.2 tt0 -175.03 172.41 2.84 Favored 'General case' 0 C--O 1.248 0.984 0 C-N-CA 127.172 2.189 . . . . 4.7000000000000002 110.737 -173.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.57 -135.48 50.57 Favored Glycine 0 C--N 1.337 0.629 0 C-N-CA 124.915 1.245 . . . . 2.4199999999999999 111.726 171.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.1 m -84.89 164.46 18.38 Favored 'General case' 0 C--O 1.246 0.872 0 CA-C-O 121.494 0.664 . . . . 2.98 112.079 163.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -84.64 156.31 21.6 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.18 0.992 . . . . 5.7699999999999996 110.224 157.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.2 tp 73.15 -2.74 2.64 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.745 2.018 . . . . 4.8099999999999996 112.392 -159.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 61.3 p -138.89 150.41 45.93 Favored 'General case' 0 C--O 1.253 1.272 0 C-N-CA 125.342 1.457 . . . . 1.8899999999999999 113.798 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.1 mt -114.87 109.79 18.68 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.711 2.004 . . . . 2.6699999999999999 111.631 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.9 t -84.42 173.76 10.63 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.042 1.337 . . . . 2.7799999999999998 112.042 167.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -51.36 -41.72 60.83 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 114.724 1.379 . . . . 4.5999999999999996 114.724 -163.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.497 ' HZ3' ' CD ' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -82.68 -28.94 30.27 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 120.332 1.424 . . . . 4.2400000000000002 113.414 178.545 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -56.45 -46.09 80.5 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.281 0.946 . . . . 1.7 109.81 166.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -73.09 -41.86 63.61 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.124 0.97 . . . . 3.6499999999999999 111.016 -173.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.74 -41.16 77.04 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.253 -0.905 . . . . 7.5700000000000003 113.28 167.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -70.61 -31.43 68.41 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.943 0.72 . . . . 3.2599999999999998 112.943 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 tt -64.75 -63.48 1.11 Allowed 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.47 -0.937 . . . . 3.46 108.47 174.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.7 mt -56.28 -56.72 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-N 119.044 0.838 . . . . 2.2400000000000002 112.305 -172.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 mmmm -79.26 4.22 15.67 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.496 1.295 . . . . 5.9400000000000004 114.496 -171.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -112.37 -36.5 5.26 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 117.718 -1.134 . . . . 4.0899999999999999 113.656 166.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -66.27 -34.15 77.35 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.104 1.361 . . . . 3.9399999999999999 112.81 172.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -105.82 108.72 20.38 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 107.974 -1.121 . . . . 3.73 107.974 168.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 28.2 p -80.13 51.99 1.47 Allowed 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.101 0.96 . . . . 4.7699999999999996 113.227 -178.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.5 mp -111.11 153.51 25.59 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.773 2.029 . . . . 4.54 112.722 -170.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -82.91 -17.95 66.44 Favored Glycine 0 CA--C 1.536 1.355 0 O-C-N 121.219 -0.926 . . . . 4.54 112.59 166.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -79.34 -157.18 0.12 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 129.561 3.144 . . . . 5.9000000000000004 111.024 178.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.8 tpt 55.86 22.01 5.29 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 123.494 1.616 . . . . 3.1800000000000002 113.589 -178.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.6 tttm -72.03 154.44 41.13 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 113.732 -1.576 . . . . 6.6100000000000003 114.136 -141.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.423 ' CD ' ' H ' ' A' ' 49' ' ' GLU . 21.7 mp0 -66.02 -22.17 66.43 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 116.058 1.873 . . . . 5.5999999999999996 116.058 -134.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.7 t -67.09 -15.23 63.59 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.3 -1.5 . . . . 2.6200000000000001 113.783 171.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.7 t -82.98 -12.23 57.46 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.667 1.187 . . . . 3.8700000000000001 113.4 170.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 18.0 mm -74.87 -35.05 34.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 124.568 1.147 . . . . 3.0499999999999998 110.924 -176.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.92 -33.23 75.23 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.661 1.584 . . . . 3.0600000000000001 110.899 176.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -75.23 -47.39 28.35 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-O 118.397 -0.811 . . . . 2.4199999999999999 111.79 165.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.23 -45.12 68.58 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.581 1.082 . . . . 3.6699999999999999 110.87 -172.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.6 ppp? -62.88 -48.67 77.97 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 122.149 -0.344 . . . . 2.5899999999999999 111.701 175.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -18.95 47.81 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.406 2.282 . . . . 5.04 114.342 173.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.9 m -94.98 -27.63 15.55 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 127.411 2.284 . . . . 3.6800000000000002 112.934 177.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 96.9 mt -76.91 -33.46 57.75 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.366 1.066 . . . . 2.9100000000000001 112.002 165.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -73.35 68.65 1.09 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.985 2.114 . . . . 1.78 112.582 -173.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.1 tttt -54.29 -23.84 16.68 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 127.97 2.508 . . . . 5.46 114.009 -175.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -85.06 -23.13 28.69 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.472 1.286 . . . . 2.9900000000000002 114.472 173.057 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.3 t 57.73 63.75 1.73 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.043 1.337 . . . . 3.21 112.432 -167.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -120.12 -108.75 0.35 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.427 2.291 . . . . 2.7400000000000002 109.338 -172.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -142.45 -19.9 0.69 Allowed 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 115.231 1.567 . . . . 6.1299999999999999 115.231 167.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -132.7 145.5 51.1 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 122.599 1.19 . . . . 2.6499999999999999 110.815 -169.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 8.8 mm -86.88 113.48 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 125.713 1.605 . . . . 2.1099999999999999 107.666 174.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.34 174.12 11.92 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.767 0.827 . . . . 3.0899999999999999 111.702 167.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -54.5 -38.24 66.25 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-O 122.564 1.173 . . . . 3.4300000000000002 112.163 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -78.45 -22.06 48.17 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.107 2.163 . . . . 3.79 113.577 -173.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -79.01 -54.11 6.35 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.213 1.805 . . . . 1.72 109.005 161.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -53.7 -37.72 63.55 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 128.122 2.569 . . . . 3.7000000000000002 115.005 -173.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -20.23 56.7 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 120.988 -1.07 . . . . 2.5299999999999998 113.755 174.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 53.3 t -70.13 -28.24 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 120.875 -1.141 . . . . 2.8900000000000001 110.973 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -64.58 -53.56 45.93 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.369 -0.832 . . . . 3.1800000000000002 110.928 171.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -54.64 -45.79 73.84 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.427 1.091 . . . . 3.2799999999999998 110.548 177.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 88.1 m -53.6 -49.28 68.12 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.373 1.069 . . . . 1.8100000000000001 112.263 176.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 50.4 mtm -62.18 -47.48 84.29 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 118.684 0.675 . . . . 2.3199999999999998 112.596 178.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.8 mt -65.56 -36.75 84.7 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.737 -0.602 . . . . 2.52 112.125 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 4.3 t -68.44 -32.34 72.3 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 118.467 -0.777 . . . . 2.3799999999999999 112.477 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -47.72 85.12 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 118.855 0.752 . . . . 4.8099999999999996 110.921 171.185 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.26 -38.02 89.04 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.196 0.907 . . . . 2.3399999999999999 113.086 -175.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -68.68 -29.93 68.5 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.134 0.79 . . . . 3.8500000000000001 113.134 174.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -73.79 -44.27 56.45 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.943 0.792 . . . . 2.3799999999999999 111.669 171.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -72.44 -16.7 61.82 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.435 1.094 . . . . 4.4900000000000002 111.664 -173.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -50.91 -57.83 7.52 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.624 1.97 . . . . 4.1299999999999999 111.682 166.037 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -55.18 -28.9 56.22 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.973 0.909 . . . . 5.04 112.584 176.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 71.6 mt -83.39 -18.47 38.69 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.782 0.833 . . . . 2.6400000000000001 111.324 -172.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -90.4 -15.32 31.22 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.905 1.446 . . . . 3.7999999999999998 114.905 164.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 . . . . . 0 CA--C 1.55 0.963 0 C-N-CA 124.607 1.163 . . . . 3.4700000000000002 111.818 163.573 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 71.6 p . . . . . 0 N--CA 1.476 0.854 0 CA-C-O 119.692 -0.194 . . . . 2.5600000000000001 111.52 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -62.46 -20.06 69.36 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.005 1.803 . . . . 1.52 112.738 174.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -83.13 -41.72 18.19 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.736 1.215 . . . . 4.1900000000000004 111.949 174.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -58.29 -31.88 67.9 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.606 1.094 . . . . 3.6099999999999999 110.923 164.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.81 -30.46 62.73 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.106 -1.621 . . . . 4.9699999999999998 112.921 172.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.16 -43.35 92.08 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.206 -0.934 . . . . 1.78 111.027 168.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 81.6 mt -61.36 -44.77 96.6 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.429 1.091 . . . . 2.5499999999999998 111.84 169.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 85.7 m -53.43 -47.2 69.84 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.73 1.212 . . . . 2.9900000000000002 110.543 174.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 27.3 m -59.42 -52.5 65.36 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.041 0.937 . . . . 2.1600000000000001 109.326 174.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 4.3 tpp -50.13 -53.56 26.71 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.943 1.697 . . . . 4.5199999999999996 112.299 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 21.2 m -70.99 -21.27 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 112.706 0.632 . . . . 3.7000000000000002 112.706 -175.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 61.5 m -83.42 -45.29 13.84 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.034 1.333 . . . . 1.8899999999999999 111.283 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -54.61 -41.08 69.52 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.497 -0.557 . . . . 2.1299999999999999 109.497 164.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -71.75 -35.22 70.05 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 120.326 -0.55 . . . . 3.5800000000000001 111.662 -176.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -64.42 -51.12 64.74 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 120.444 -1.41 . . . . 3.1299999999999999 112.095 170.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -55.93 -51.84 66.23 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.924 0.889 . . . . 7.0300000000000002 111.788 177.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -83.43 -34.99 25.35 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 117.372 -1.299 . . . . 3.0899999999999999 112.504 -172.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 60.2 p -68.39 -28.68 67.31 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 121.351 1.887 . . . . 2.4500000000000002 111.733 174.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.27 17.37 5.08 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 125.81 1.671 . . . . 1.7 114.516 170.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 5.6 mmp_? -92.45 62.88 4.03 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 120.372 2.086 . . . . 7.6399999999999997 109.608 166.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 71.2 -177.91 0.21 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.195 1.398 . . . . 4.3300000000000001 112.123 -175.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.72 -146.0 50.14 Favored Glycine 0 CA--C 1.53 0.988 0 N-CA-C 109.829 -1.309 . . . . 2.8199999999999998 109.829 -156.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 73.3 m -78.67 153.97 30.54 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.277 -1.131 . . . . 3.7799999999999998 111.405 161.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 15.4 ttpt -68.24 55.81 0.07 Allowed 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 125.344 1.458 . . . . 8.4399999999999995 111.153 160.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -170.88 -31.99 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 126.42 1.888 . . . . 4.4299999999999997 111.658 -165.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 20.7 p -119.34 151.58 38.22 Favored 'General case' 0 C--O 1.242 0.694 0 C-N-CA 125.764 1.626 . . . . 1.8400000000000001 113.422 -175.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 87.4 mt -114.53 119.44 36.82 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.274 2.23 . . . . 2.8900000000000001 112.243 178.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 4.8 t -104.18 179.22 4.34 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 113.506 0.928 . . . . 3.79 113.506 162.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 31.0 ttp180 -56.16 -36.02 67.84 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.71 1.744 . . . . 4.6200000000000001 115.71 -161.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -29.04 64.0 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 120.457 -1.402 . . . . 6.0700000000000003 113.452 173.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -72.22 -51.68 19.93 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 108.006 -1.109 . . . . 2.1000000000000001 108.006 177.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 mt -67.71 -33.15 74.33 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-O 117.475 -1.25 . . . . 3.6499999999999999 113.884 176.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.7 ttmt -53.13 -48.63 67.75 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 120.816 1.644 . . . . 4.1299999999999999 111.788 170.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -66.38 -45.54 79.7 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.378 0.881 . . . . 3.8599999999999999 113.378 176.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 55.1 tp -74.05 -45.24 50.72 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 117.682 -1.152 . . . . 3.2400000000000002 112.572 -175.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 28.6 mt -57.25 -52.43 56.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 CA-C-N 121.041 1.746 . . . . 2.1400000000000001 107.999 176.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . 0.344 0.0 OUTLIER -70.49 8.46 0.82 Allowed 'General case' 0 CA--C 1.558 1.268 0 CA-C-O 122.022 0.915 . . . . 6.5300000000000002 113.106 -178.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 10.1 mmtm -118.99 -29.6 5.23 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 127.158 2.183 . . . . 6.7599999999999998 115.696 170.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -67.86 -29.73 68.94 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.964 1.256 . . . . 5.6100000000000003 109.706 160.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -111.49 63.86 0.62 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 126.391 1.877 . . . . 3.4900000000000002 109.015 170.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.9 t -62.72 -33.69 75.64 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 120.443 -1.411 . . . . 4.3099999999999996 111.945 -178.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -90.49 -5.0 56.57 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.022 1.729 . . . . 5.04 114.996 172.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -103.79 10.98 52.97 Favored Glycine 0 N--CA 1.475 1.296 0 CA-C-O 118.401 -1.222 . . . . 4.0599999999999996 115.915 -162.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 70.87 -83.52 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.339 1.855 . . . . 6.3099999999999996 112.663 169.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 1.1 mmt 70.71 87.91 0.11 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 128.455 2.702 . . . . 3.3599999999999999 113.309 -168.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 mttp -61.59 133.61 55.85 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.655 -1.278 . . . . 4.3600000000000003 110.951 166.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -36.06 -56.89 0.72 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 127.12 2.168 . . . . 3.7999999999999998 114.998 -177.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 29.3 t -67.28 -15.01 63.44 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.389 1.255 . . . . 3.6299999999999999 114.389 -176.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 10.5 t -85.43 -12.51 51.82 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.405 1.002 . . . . 3.0699999999999998 112.796 171.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 71.3 mt -77.74 -37.53 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 CA-C-N 119.316 0.962 . . . . 4.0499999999999998 109.871 179.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -70.79 -39.93 72.85 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.718 1.207 . . . . 2.9100000000000001 113.108 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -68.77 -40.25 79.8 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 118.489 0.586 . . . . 2.9900000000000002 111.4 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 25.4 tp -59.23 -48.42 81.68 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 117.429 -1.272 . . . . 3.1000000000000001 110.437 172.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 58.0 mmm -50.18 -48.83 53.86 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 120.158 1.344 . . . . 2.6899999999999999 111.823 173.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -16.82 48.83 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.107 1.763 . . . . 5.1699999999999999 113.994 175.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.13 -31.9 12.23 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.399 1.48 . . . . 2.6000000000000001 113.659 171.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 13.1 mt -76.21 -24.13 54.65 Favored 'General case' 0 N--CA 1.463 0.186 0 O-C-N 120.933 -1.104 . . . . 2.8399999999999999 111.56 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -94.04 149.05 21.58 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.504 1.122 . . . . 1.98 113.664 168.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -99.78 -11.76 20.53 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.734 1.614 . . . . 4.5199999999999996 113.169 172.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.63 -62.79 1.53 Allowed 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.342 0.868 . . . . 2.5600000000000001 113.342 -157.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 58.6 m 109.98 12.57 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.116 1 C-N-CA 132.332 4.253 . . . . 3.54 111.667 -157.146 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 48.0 p-10 -83.82 8.18 15.62 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 119.377 -2.077 . . . . 2.71 112.289 -165.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 55.18 2.05 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 130.564 3.546 . . . . 4.3300000000000001 115.923 -166.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -131.88 121.14 23.57 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 125.499 1.52 . . . . 2.8100000000000001 111.342 -168.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 2.8 mp -93.06 103.84 15.1 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.398 1.479 . . . . 3.0699999999999998 107.736 177.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.24 160.18 32.65 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.268 1.427 . . . . 3.3599999999999999 111.517 169.51 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -47.69 -46.93 29.89 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.579 1.551 . . . . 3.6400000000000001 112.512 -179.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -69.2 -17.45 63.8 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.817 0.847 . . . . 5.4100000000000001 112.776 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -84.44 -51.96 6.53 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.592 1.157 . . . . 2.1899999999999999 109.966 170.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -53.13 -25.81 14.54 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.89 2.476 . . . . 2.8100000000000001 114.14 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.27 -20.17 65.22 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.776 -1.202 . . . . 2.5499999999999998 111.426 177.53 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.3 p -70.45 -31.32 46.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 O-C-N 120.79 -1.194 . . . . 3.2999999999999998 112.252 172.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -63.36 -56.16 18.61 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 108.682 -0.858 . . . . 2.8300000000000001 108.682 174.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 96.2 mt -53.88 -39.56 65.81 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.832 1.253 . . . . 2.3500000000000001 112.385 175.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 97.8 m -62.16 -53.58 53.28 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.294 1.038 . . . . 1.9299999999999999 111.862 176.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 19.7 ptp -68.82 -32.87 72.88 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 118.604 0.638 . . . . 3.27 112.64 -177.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -65.64 -49.69 67.77 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.043 0.937 . . . . 3.6800000000000002 112.277 170.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 12.8 t -65.45 -32.0 73.38 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.035 0.383 . . . . 3.02 112.035 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -45.9 92.84 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.837 0.744 . . . . 3.7400000000000002 112.255 167.034 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.02 -40.73 94.68 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.176 0.898 . . . . 1.72 111.89 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -60.95 -24.8 66.35 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.431 1.271 . . . . 3.2999999999999998 114.431 176.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -70.03 -42.55 72.8 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.636 1.107 . . . . 2.71 111.909 174.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -69.8 -41.3 75.23 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.959 0.904 . . . . 3.02 110.315 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -51.45 -53.09 40.62 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.581 1.552 . . . . 3.3100000000000001 110.9 169.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -61.96 -24.25 66.89 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.54 1.536 . . . . 4.3600000000000003 113.705 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 47.0 mt -79.7 -23.44 42.4 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.529 -1.357 . . . . 2.7400000000000002 112.456 174.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . 0.529 ' CD ' ' HZ2' ' B' ' 92' ' ' LYS . 29.2 mm-40 -94.55 -6.69 43.09 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.74 1.385 . . . . 4.04 114.74 170.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -86.38 -37.57 18.28 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 127.35 2.26 . . . . 3.7400000000000002 113.488 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -82.33 49.55 1.45 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.193 1.797 . . . . 3.8399999999999999 113.244 -167.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . 0.529 ' HZ2' ' CD ' ' B' ' 89' ' ' GLU . 1.1 mptm? . . . . . 0 C--O 1.252 1.219 0 C-N-CA 128.095 2.558 . . . . 7.71 114.334 178.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 . . . . . 0 CA--C 1.54 0.594 0 N-CA-C 112.821 0.674 . . . . 3.75 112.821 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 66.2 p -153.17 162.43 26.47 Favored Pre-proline 0 N--CA 1.472 0.665 0 C-N-CA 124.893 1.277 . . . . 3.0 111.61 -161.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -64.5 -11.75 30.06 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 122.426 2.084 . . . . 1.8 113.128 166.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.91 -38.05 15.94 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.104 1.362 . . . . 3.4300000000000002 111.471 178.29 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -55.44 -50.5 69.67 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 108.961 -0.755 . . . . 4.8499999999999996 108.961 159.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.43 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -59.18 -31.08 68.68 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.665 -0.647 . . . . 4.7599999999999998 112.6 177.063 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.34 -53.69 39.95 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.429 0.692 . . . . 2.1699999999999999 110.861 172.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 44.8 mt -54.77 -44.75 73.95 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.058 0.943 . . . . 3.1299999999999999 112.234 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.8 p -69.37 -36.87 77.25 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 117.844 -1.074 . . . . 3.48 112.447 176.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.4 m -62.32 -39.92 94.62 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 120.292 1.405 . . . . 2.0699999999999998 111.564 171.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 72.8 mtp -60.59 -51.92 67.37 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.067 0.947 . . . . 4.21 112.173 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.3 p -63.46 -34.37 67.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 CA-C-N 118.692 0.678 . . . . 3.5899999999999999 111.506 173.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 85.3 m -61.74 -53.71 52.31 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 117.923 -1.037 . . . . 1.8600000000000001 111.067 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.5 p -55.97 -43.29 77.43 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.036 0.835 . . . . 2.9500000000000002 109.559 172.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -64.64 -54.63 28.84 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.302 0.376 . . . . 3.0299999999999998 111.51 -169.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.7 -32.65 73.45 Favored 'General case' 0 CA--C 1.548 0.869 0 O-C-N 121.544 -0.723 . . . . 2.75 111.831 179.221 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -76.81 -12.87 60.04 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.453 1.279 . . . . 4.96 114.453 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -92.43 -33.24 14.61 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 119.527 1.058 . . . . 3.8799999999999999 112.56 155.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.8 p -42.76 -48.3 5.6 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 117.389 2.366 . . . . 4.7699999999999996 117.389 -163.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -88.01 4.82 85.49 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 125.393 1.473 . . . . 1.95 114.319 -173.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 35.3 mtp180 -92.6 50.26 1.57 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.663 1.232 . . . . 6.8700000000000001 108.957 175.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.429 ' CD ' ' HZ3' ' A' ' 32' ' ' LYS . 19.7 tt0 115.34 151.76 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.877 1 C-N-CA 131.832 4.053 . . . . 4.4000000000000004 111.455 -177.928 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.86 -159.99 48.51 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 120.752 -1.218 . . . . 2.8300000000000001 113.391 -179.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.4 t -75.22 161.91 28.93 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.885 -0.773 . . . . 4.3499999999999996 111.981 172.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.0 mmtp -49.96 -24.92 2.84 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.279 1.432 . . . . 5.2800000000000002 112.404 155.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 18.9 tp -93.47 -13.64 27.65 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 117.35 -1.309 . . . . 4.7800000000000002 114.095 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 53.7 p -128.04 145.04 51.11 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-N 120.714 1.597 . . . . 2.1800000000000002 114.983 -168.012 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.8 mt -101.19 120.44 40.23 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.772 1.629 . . . . 2.6600000000000001 111.876 170.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.4 p -78.37 171.81 14.53 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.961 1.467 . . . . 3.5800000000000001 114.961 -177.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -45.43 -27.6 0.73 Allowed 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 115.021 1.489 . . . . 4.3499999999999996 115.021 167.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.429 ' HZ3' ' CD ' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -104.93 -38.97 6.43 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.863 1.265 . . . . 4.4400000000000004 113.148 -178.593 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -67.63 -30.06 69.53 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.062 1.345 . . . . 3.6299999999999999 111.584 175.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.2 tp -75.33 -47.97 25.3 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.097 0.959 . . . . 2.8999999999999999 112.417 173.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -15.2 57.59 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.95 1.463 . . . . 5.8700000000000001 114.95 -172.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -94.87 -39.23 10.34 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.951 1.093 . . . . 4.6299999999999999 113.951 175.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 39.6 tp -58.33 -50.78 72.43 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.469 1.031 . . . . 3.5499999999999998 111.558 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.1 mt -52.51 -57.09 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-O 121.628 0.728 . . . . 2.0099999999999998 109.081 175.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.406 ' HE2' ' OE1' ' A' ' 49' ' ' GLU . 25.9 ttpp -67.11 -8.3 29.71 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.254 1.205 . . . . 4.7400000000000002 114.254 -176.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.9 mmtm -95.27 -33.43 12.57 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 125.358 1.463 . . . . 4.79 112.212 172.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.421 ' C ' ' H ' ' A' ' 43' ' ' CYS . 40.1 tt0 -68.61 -66.96 0.51 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.086 1.754 . . . . 4.9500000000000002 110.045 169.465 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -70.52 22.54 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 126.667 1.987 . . . . 3.79 113.667 176.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.421 ' H ' ' C ' ' A' ' 41' ' ' GLU . 12.9 t -67.36 2.27 1.78 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.708 2.003 . . . . 3.4399999999999999 113.951 177.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -68.96 -10.99 60.23 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.638 0.775 . . . . 5.0999999999999996 112.639 167.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 145.38 13.08 0.22 Allowed Glycine 0 CA--C 1.528 0.889 0 CA-C-O 117.909 -1.495 . . . . 4.2000000000000002 116.709 169.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -124.49 -175.13 3.18 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.674 1.737 . . . . 5.0700000000000003 113.282 -176.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 63.35 33.84 13.59 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-O 123.552 1.644 . . . . 2.48 113.686 169.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -59.77 151.75 24.61 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 113.359 -1.746 . . . . 5.9299999999999997 110.429 166.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.406 ' OE1' ' HE2' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -44.31 -44.12 7.9 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.941 1.46 . . . . 4.3799999999999999 114.941 -165.93 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.0 t -63.73 -15.57 58.89 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 115.061 1.504 . . . . 3.3799999999999999 115.061 -178.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 43.4 m -90.02 -7.8 53.08 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.371 0.987 . . . . 2.5899999999999999 113.091 172.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 45.2 mt -88.25 -35.75 8.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 117.745 -1.122 . . . . 2.75 113.326 -166.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.87 -25.75 64.78 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.427 1.467 . . . . 2.6699999999999999 113.197 -176.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.55 -44.09 71.61 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.899 0.772 . . . . 3.3999999999999999 111.169 164.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 tp -62.54 -43.49 98.68 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 118.611 -0.709 . . . . 3.1499999999999999 109.922 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.5 tpt -53.93 -53.96 45.49 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 125.914 1.686 . . . . 2.3799999999999999 110.791 170.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.83 -35.67 64.19 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.008 1.323 . . . . 5.0899999999999999 113.147 176.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 61.3 m -86.69 -33.3 20.09 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 126.15 1.78 . . . . 2.5899999999999999 111.964 -173.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -69.57 -42.78 74.07 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 126.776 2.03 . . . . 3.5299999999999998 112.015 169.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -74.72 63.09 1.11 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 123.384 1.564 . . . . 1.51 110.77 -176.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -69.84 -4.95 22.5 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.83 1.252 . . . . 6.21 113.427 -164.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -110.5 -5.69 15.08 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.85 2.46 . . . . 3.2200000000000002 113.785 171.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 37.7 t 58.69 64.55 1.41 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.074 1.35 . . . . 3.3900000000000001 112.797 172.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.45 ' CG ' ' H ' ' A' ' 65' ' ' GLN . 5.0 p-10 -115.07 -88.97 0.56 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.384 1.473 . . . . 2.8100000000000001 108.67 176.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.45 ' H ' ' CG ' ' A' ' 64' ' ' ASP . 20.6 pt20 -173.19 -26.32 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.746 2.419 . . . . 6.1799999999999997 114.724 -176.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -124.78 163.22 22.6 Favored 'General case' 0 C--O 1.243 0.729 0 CA-C-O 123.249 1.5 . . . . 3.1000000000000001 111.944 175.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.6 mm -104.95 100.08 9.8 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.882 2.473 . . . . 2.2400000000000002 110.401 -178.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -66.16 163.13 18.31 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.538 0.735 . . . . 3.7999999999999998 111.636 167.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -47.13 -42.32 19.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.603 0.761 . . . . 3.25 112.882 -178.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 -30.39 67.03 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 120.895 -1.128 . . . . 8.5700000000000003 112.649 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -68.3 -54.36 18.02 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 107.855 -1.165 . . . . 1.96 107.855 171.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -51.2 -37.34 46.13 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.864 2.066 . . . . 3.7999999999999998 114.401 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.0 p -66.17 -14.89 62.6 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 120.307 -1.496 . . . . 2.8599999999999999 114.647 173.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 44.7 t -71.82 -33.02 46.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 CA-C-N 120.441 1.473 . . . . 3.2799999999999998 111.212 171.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -56.32 -54.72 42.09 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.466 1.03 . . . . 2.8999999999999999 110.637 172.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 67.0 mt -64.07 -30.49 71.56 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.165 0.986 . . . . 2.75 111.864 -178.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 15.3 m -68.13 -50.98 51.22 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.284 0.947 . . . . 1.6899999999999999 111.942 170.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 65.3 mtp -51.87 -48.01 64.23 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.182 0.901 . . . . 2.5299999999999998 111.088 177.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 99.6 mt -65.45 -48.68 71.88 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.086 0.955 . . . . 2.0499999999999998 112.599 176.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.414 ' HG ' HG23 ' B' ' 13' ' ' VAL . 34.6 t -64.84 -33.04 75.06 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.352 0.978 . . . . 2.3399999999999999 113.213 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 88.7 mtp -63.39 -46.59 85.73 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 118.687 0.676 . . . . 2.6099999999999999 110.813 168.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.94 -42.94 97.18 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.626 0.602 . . . . 2.3599999999999999 112.626 -178.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -65.39 -25.71 67.68 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.574 -0.704 . . . . 4.0999999999999996 112.346 178.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -69.56 -37.21 76.94 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.103 0.865 . . . . 4.29 112.351 173.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -70.65 -47.46 59.88 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.979 1.312 . . . . 2.8100000000000001 110.703 172.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -52.41 -47.42 66.32 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 126.09 1.756 . . . . 4.3499999999999996 110.98 177.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -53.53 -33.1 53.32 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.504 1.522 . . . . 3.7999999999999998 113.045 177.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 24.7 mt -81.86 -20.73 38.31 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.99 0.916 . . . . 2.5800000000000001 112.506 -177.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -96.5 -7.85 33.61 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.641 1.348 . . . . 2.9399999999999999 114.641 172.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 23.7 t70 . . . . . 0 CA--C 1.538 0.496 0 C-N-CA 126.89 2.076 . . . . 3.71 112.686 -174.081 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.483 1.213 0 CA-C-O 118.77 -0.633 . . . . 2.77 109.769 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -81.8 -15.04 9.73 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 121.759 1.639 . . . . 2.1299999999999999 113.139 166.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.26 -39.31 68.49 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.604 1.093 . . . . 3.3199999999999998 111.967 -174.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -50.69 -55.46 16.42 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.604 0.762 . . . . 5.1200000000000001 110.522 167.496 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 43.4 mttm -67.54 -19.23 65.26 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.221 -0.924 . . . . 4.4400000000000004 112.365 -176.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.59 -43.17 39.83 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.018 1.327 . . . . 1.8799999999999999 111.891 171.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 56.7 mt -61.47 -44.62 96.78 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.177 1.391 . . . . 2.5899999999999999 111.69 169.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 88.2 m -58.26 -48.99 78.7 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.542 1.537 . . . . 2.3700000000000001 110.445 171.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 23.2 m -54.92 -49.96 70.0 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 119.539 1.063 . . . . 2.48 110.897 175.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 14.9 mmm -50.68 -51.46 49.18 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.684 1.194 . . . . 3.6499999999999999 112.623 174.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.414 HG23 ' HG ' ' A' ' 80' ' ' CYS . 4.0 t -59.31 -40.7 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.848 0.859 . . . . 2.7200000000000002 112.34 175.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 87.9 m -72.28 -44.12 63.25 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.766 1.627 . . . . 1.8799999999999999 111.753 -173.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 19.2 p -67.74 -44.88 76.53 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 108.913 -0.773 . . . . 2.3500000000000001 108.913 172.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -63.57 -53.65 48.41 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 123.597 0.561 . . . . 3.7400000000000002 110.518 -173.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -66.19 -30.01 70.4 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 112.506 0.558 . . . . 2.77 112.506 -178.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 19.4 ttmm -70.91 -47.06 61.22 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 120.868 -1.145 . . . . 4.8499999999999996 112.117 176.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -73.18 -32.95 65.14 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.351 -0.843 . . . . 3.6099999999999999 112.486 176.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 53.1 p -68.44 -29.02 67.58 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-N 119.666 1.121 . . . . 2.5899999999999999 113.012 176.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.35 -5.91 84.59 Favored Glycine 0 C--N 1.342 0.88 0 C-N-CA 127.625 2.536 . . . . 1.5 114.756 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -64.48 -41.68 96.33 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.896 1.848 . . . . 4.1900000000000004 111.392 175.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -147.93 156.02 42.22 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 123.252 1.501 . . . . 3.48 114.799 -173.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.43 -126.79 43.21 Favored Glycine 0 C--N 1.34 0.765 0 C-N-CA 127.156 2.313 . . . . 2.2799999999999998 111.123 171.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 2.3 m -54.53 116.31 2.6 Favored 'General case' 0 C--O 1.249 1.035 0 CA-C-O 121.207 0.527 . . . . 4.6699999999999999 109.736 162.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -18.81 60.65 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.445 0.906 . . . . 7.0899999999999999 113.445 -176.061 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -91.27 -13.71 32.2 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.622 1.569 . . . . 5.2199999999999998 113.58 177.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -127.86 162.27 27.09 Favored 'General case' 0 C--O 1.249 1.042 0 N-CA-C 114.226 1.195 . . . . 2.9700000000000002 114.226 -178.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 91.8 mt -107.16 108.51 20.0 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.89 2.476 . . . . 2.8300000000000001 111.592 -178.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 95.9 p -70.72 163.37 27.31 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 121.26 -0.9 . . . . 2.7400000000000002 113.211 164.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -42.28 -38.16 1.72 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 125.642 1.577 . . . . 7.4900000000000002 114.545 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.63 -28.0 25.06 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 116.438 2.014 . . . . 4.6200000000000001 116.438 176.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -67.53 -48.64 66.41 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 120.103 1.32 . . . . 1.6699999999999999 109.221 166.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 24.6 tp -58.07 -42.95 86.63 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.679 1.191 . . . . 2.9199999999999999 111.827 177.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -51.37 -40.79 59.91 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.915 0.886 . . . . 4.4199999999999999 111.885 177.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -64.33 -51.98 60.7 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.948 0.499 . . . . 2.9700000000000002 110.364 177.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 29.6 tp -57.65 -55.24 37.35 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 117.067 -1.444 . . . . 3.3599999999999999 111.0 -178.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 30.7 mt -54.46 -51.44 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-N 120.201 1.364 . . . . 1.9399999999999999 110.469 178.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 44.1 tttm -65.89 -18.53 65.4 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.755 1.02 . . . . 5.1399999999999997 113.755 -176.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm -85.78 -59.75 2.22 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.752 1.621 . . . . 3.8700000000000001 110.609 168.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 72.3 tt0 -43.54 -62.52 1.06 Allowed 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 130.97 3.708 . . . . 5.1600000000000001 112.846 -177.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -82.22 -37.65 25.69 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.296 1.038 . . . . 3.4300000000000002 111.939 178.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 8.2 t 70.33 -44.44 0.57 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 127.691 2.396 . . . . 3.25 114.998 175.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -63.31 -4.24 2.46 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 117.351 2.352 . . . . 4.2199999999999998 117.351 -167.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.48 16.55 77.71 Favored Glycine 0 N--CA 1.474 1.215 0 O-C-N 120.812 -1.18 . . . . 4.9000000000000004 115.105 173.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -46.05 -71.36 0.08 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 127.45 2.3 . . . . 7.9800000000000004 112.204 176.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.84 125.46 26.89 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.944 0.878 . . . . 4.25 111.431 173.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -87.18 173.88 8.96 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.836 -0.54 . . . . 4.2199999999999998 109.809 166.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.01 -37.5 74.41 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 115.062 1.504 . . . . 3.4700000000000002 115.062 -169.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 13.1 t -72.59 -11.15 60.53 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 114.148 1.166 . . . . 3.04 114.148 172.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 1.7 m -94.17 -31.68 14.04 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.992 1.717 . . . . 3.71 111.544 172.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 86.6 mt -65.99 -32.96 60.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.293 0.637 . . . . 2.8999999999999999 110.718 170.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.0 -66.12 0.56 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.232 1.013 . . . . 3.0800000000000001 111.207 176.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.61 -24.64 62.78 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 113.885 1.068 . . . . 3.9199999999999999 113.885 -173.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.77 -52.96 63.46 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.52 0.728 . . . . 3.3199999999999998 109.992 164.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -60.89 -49.47 77.34 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.377 1.071 . . . . 2.77 111.922 -179.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 24.8 mtpt -57.16 -36.22 70.5 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.44 1.096 . . . . 6.1399999999999997 113.011 173.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 52.1 m -75.07 -30.64 61.02 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 120.956 -1.09 . . . . 3.2599999999999998 113.479 177.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 mp -65.34 -52.8 51.41 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 118.031 -0.985 . . . . 4.0199999999999996 110.504 167.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -73.93 74.91 1.66 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.322 2.249 . . . . 1.45 114.343 -169.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . 0.401 ' HZ1' HG11 ' B' ' 74' ' ' VAL . 14.8 mptt -53.96 -27.57 32.12 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 115.113 1.523 . . . . 4.1699999999999999 115.113 -176.542 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -88.25 -15.28 36.29 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.723 1.209 . . . . 2.4100000000000001 113.379 177.529 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 29.4 t 58.17 32.05 21.54 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.473 1.109 . . . . 2.96 112.552 -176.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -84.47 -0.24 52.19 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.378 1.471 . . . . 2.3500000000000001 112.02 -175.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 82.3 -0.96 1.42 Allowed 'General case' 0 C--O 1.238 0.477 0 C-N-CA 130.36 3.464 . . . . 4.4800000000000004 113.204 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -126.38 135.21 51.16 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 123.045 1.403 . . . . 2.27 113.106 178.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 21.3 mm -74.58 100.0 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-N 115.016 -0.993 . . . . 2.6000000000000001 109.232 170.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.35 158.31 31.91 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.293 1.037 . . . . 4.9900000000000002 109.846 169.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.57 -35.17 53.36 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 120.517 -1.364 . . . . 4.2300000000000004 113.496 175.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.18 -25.96 66.4 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.862 0.865 . . . . 6.2199999999999998 112.48 177.45 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -88.03 -40.74 13.6 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.246 1.418 . . . . 2.5600000000000001 110.35 174.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -54.78 -23.67 19.05 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 120.39 -1.444 . . . . 3.1499999999999999 113.059 173.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 36.1 t -65.8 -30.61 71.28 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.518 1.527 . . . . 2.8599999999999999 112.989 174.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . 0.401 HG11 ' HZ1' ' B' ' 61' ' ' LYS . 0.9 OUTLIER -86.85 -28.57 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.714 0.805 . . . . 3.6200000000000001 111.544 -176.974 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -58.93 -67.03 0.41 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.945 1.298 . . . . 2.5899999999999999 111.396 179.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -59.92 -36.77 77.71 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.452 1.101 . . . . 4.9900000000000002 112.0 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 31.5 m -51.19 -54.35 26.33 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.664 0.786 . . . . 1.97 110.492 173.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.4 mtm -58.68 -46.11 87.94 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 118.544 0.611 . . . . 2.1800000000000002 111.593 179.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.08 -45.54 94.32 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.147 0.579 . . . . 2.4500000000000002 112.436 178.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.4 t -72.68 -29.41 63.38 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.328 -0.857 . . . . 3.2200000000000002 113.1 -178.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 91.5 mtp -69.9 -39.45 76.2 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 118.79 -0.624 . . . . 2.9700000000000002 110.948 170.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.65 -36.16 81.93 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.493 1.042 . . . . 1.79 112.524 173.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -68.26 -35.43 77.89 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.083 1.142 . . . . 3.9100000000000001 114.083 170.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 17.1 t30 -64.72 -42.38 95.28 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.521 1.055 . . . . 2.46 112.607 171.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -73.43 -24.7 60.28 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.11 0.964 . . . . 4.0199999999999996 111.186 -177.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -55.98 26.53 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.492 1.517 . . . . 3.6200000000000001 112.104 160.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -57.46 -26.62 61.51 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.862 1.665 . . . . 3.48 112.3 -179.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 55.0 mt -77.05 -7.89 56.48 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.728 1.381 . . . . 2.6699999999999999 114.728 174.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -94.78 -29.78 14.58 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 113.86 1.059 . . . . 4.4699999999999998 113.86 162.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -74.6 -46.91 35.49 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.956 1.302 . . . . 3.6099999999999999 112.464 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -136.77 41.36 2.52 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 127.723 2.409 . . . . 4.4500000000000002 110.874 -165.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 36.8 mttm . . . . . 0 C--O 1.253 1.239 0 C-N-CA 130.386 3.475 . . . . 8.5500000000000007 117.047 -175.607 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 CA--C 1.533 0.322 0 CA-C-O 121.148 0.499 . . . . 3.4199999999999999 111.421 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 67.3 p -110.49 165.2 13.14 Favored Pre-proline 0 N--CA 1.472 0.645 0 C-N-CA 126.474 1.909 . . . . 2.3500000000000001 110.652 -168.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -69.62 -23.09 31.81 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 121.118 1.212 . . . . 1.6000000000000001 112.26 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.34 -40.39 44.28 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.7 1.137 . . . . 3.6299999999999999 113.63 173.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -64.75 -34.44 78.33 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.114 1.325 . . . . 4.0599999999999996 110.625 172.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 59.1 mttt -68.21 -29.02 67.76 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 120.051 -1.656 . . . . 5.2599999999999998 112.255 170.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.13 -50.79 29.76 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.273 1.029 . . . . 2.2400000000000002 111.204 174.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.2 mt -55.9 -43.56 77.41 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.745 1.218 . . . . 2.7999999999999998 111.87 174.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 85.4 m -53.49 -54.71 33.16 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.342 1.057 . . . . 2.8199999999999998 111.366 168.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.3 m -58.55 -37.24 75.28 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.489 1.115 . . . . 1.97 111.924 -179.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 60.0 mtp -61.91 -52.54 63.67 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.032 0.933 . . . . 4.2599999999999998 111.113 174.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 19.2 m -67.77 -28.25 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 CA-C-N 119.803 1.183 . . . . 3.4199999999999999 113.299 177.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 57.2 m -58.64 -55.85 29.73 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.891 1.276 . . . . 1.8999999999999999 110.851 174.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -74.53 -34.45 63.01 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 119.304 -0.379 . . . . 3.3399999999999999 110.275 -176.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -61.66 -51.59 67.8 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 118.397 -0.811 . . . . 2.8300000000000001 110.999 176.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -66.29 -39.25 89.25 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 120.307 1.412 . . . . 2.6200000000000001 112.23 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -53.71 52.65 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.756 1.222 . . . . 5.96 113.097 176.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -74.13 -32.2 63.07 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.358 -0.839 . . . . 3.73 112.091 176.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.5 t -58.79 -38.6 78.91 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 120.429 1.468 . . . . 2.9300000000000002 114.145 178.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.55 -6.17 83.74 Favored Glycine 0 CA--C 1.528 0.85 0 CA-C-O 117.958 -1.468 . . . . 1.96 115.184 -171.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -69.0 -41.56 77.63 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.239 1.519 . . . . 7.7999999999999998 112.616 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -149.98 143.49 25.24 Favored 'General case' 0 C--O 1.247 0.93 0 C-N-CA 124.217 1.007 . . . . 4.6100000000000003 110.551 -154.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.39 -131.8 34.4 Favored Glycine 0 C--N 1.337 0.592 0 CA-C-N 114.522 -1.217 . . . . 2.1200000000000001 110.973 -178.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.9 m -65.4 155.02 36.72 Favored 'General case' 0 C--O 1.247 0.973 0 C-N-CA 123.896 0.878 . . . . 3.04 112.995 170.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -112.86 10.73 19.1 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 115.037 1.495 . . . . 5.4800000000000004 115.037 170.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.8 mp -93.11 -1.66 56.22 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.339 1.056 . . . . 5.2599999999999998 111.485 167.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -159.7 148.29 17.56 Favored 'General case' 0 C--O 1.247 0.972 0 C-N-CA 126.841 2.056 . . . . 2.4199999999999999 110.915 -157.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -96.21 103.14 15.02 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 113.859 -1.518 . . . . 3.9399999999999999 108.354 175.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.3 p -70.95 155.93 40.23 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.854 -1.066 . . . . 2.9199999999999999 110.348 171.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.1 ttm-85 -40.56 -50.9 2.98 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.665 1.186 . . . . 4.7199999999999998 113.897 -169.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -74.16 -30.33 62.21 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 115.39 1.626 . . . . 6.8399999999999999 115.39 -175.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -58.12 -44.93 88.02 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.165 0.586 . . . . 1.96 111.227 166.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.73 -46.48 65.81 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.246 1.018 . . . . 3.8199999999999998 110.854 -175.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.1 ttmt -60.31 -44.29 95.56 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.43 -1.419 . . . . 5.1500000000000004 112.702 177.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.12 -43.2 87.09 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 114.026 1.121 . . . . 5.1799999999999997 114.026 168.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.9 tp -62.01 -54.01 47.57 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.4 1.08 . . . . 3.27 111.149 179.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.7 mt -56.51 -44.52 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 CA-C-N 118.893 0.77 . . . . 1.6200000000000001 109.962 175.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -67.96 -18.98 64.91 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 114.149 1.166 . . . . 4.8200000000000003 114.149 -176.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -91.81 -40.48 11.19 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.57 1.548 . . . . 3.8700000000000001 112.498 -179.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -81.29 -26.38 35.77 Favored 'General case' 0 CA--C 1.552 1.041 0 O-C-N 124.413 1.071 . . . . 4.6600000000000001 111.815 176.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.0 mt -133.62 131.74 39.96 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 123.277 1.513 . . . . 3.7599999999999998 113.442 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 4.3 t -149.15 7.51 0.71 Allowed 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.508 1.67 . . . . 4.8099999999999996 115.508 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -87.43 170.35 11.45 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.327 1.051 . . . . 4.3799999999999999 111.556 170.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.55 -131.08 26.44 Favored Glycine 0 N--CA 1.472 1.079 0 N-CA-C 109.977 -1.249 . . . . 5.0800000000000001 109.977 -172.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -119.89 86.28 2.53 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.666 0.746 . . . . 7.29 109.137 148.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.0 tpt -74.65 78.47 2.02 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 120.51 -1.369 . . . . 2.6800000000000002 109.287 169.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.9 tttm -89.44 151.37 22.05 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.799 1.407 . . . . 7.0999999999999996 114.799 -157.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.3 -40.31 81.64 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.589 0.959 . . . . 4.5199999999999996 113.589 174.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.7 t -83.84 -41.76 17.15 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.134 0.974 . . . . 3.21 113.458 174.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.9 m -61.92 -24.82 67.21 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.492 1.117 . . . . 3.46 112.442 177.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 65.8 mt -69.51 -28.13 36.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 124.265 1.026 . . . . 2.2000000000000002 113.111 167.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.92 -30.19 68.61 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.958 1.708 . . . . 2.7799999999999998 112.123 -176.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -79.68 -35.77 38.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.747 0.819 . . . . 3.1699999999999999 112.401 168.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.9 tp -59.63 -32.42 70.42 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.559 -0.713 . . . . 3.0 111.236 170.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 6.0 tpt -55.16 -46.78 75.75 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.292 1.437 . . . . 2.6699999999999999 111.517 173.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -65.87 -29.28 69.71 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.799 1.24 . . . . 3.73 112.524 171.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.9 t -75.35 -31.29 60.49 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.041 0.936 . . . . 2.6899999999999999 112.794 177.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.0 mp -71.38 -55.55 7.75 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.39 1.076 . . . . 3.8399999999999999 111.348 167.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -70.78 148.5 47.84 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 113.07 0.767 . . . . 2.1200000000000001 113.07 -168.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm -125.44 7.54 7.69 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.758 1.223 . . . . 4.0300000000000002 113.0 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -122.17 -21.19 5.98 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.587 1.155 . . . . 3.4300000000000002 112.995 176.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 7.8 t 74.35 20.89 2.49 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.408 2.283 . . . . 2.96 112.584 -171.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 p30 -83.4 -23.75 32.24 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.928 2.091 . . . . 1.97 112.287 -163.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 73.59 19.23 3.35 Favored 'General case' 0 CA--C 1.548 0.874 1 C-N-CA 132.1 4.16 . . . . 4.21 113.736 -172.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -121.85 122.57 39.74 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 128.719 2.808 . . . . 3.71 109.211 169.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 18.2 mm -91.47 107.75 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 O-C-N 120.652 -1.28 . . . . 2.0699999999999998 110.441 175.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 59.1 t0 -74.85 151.81 38.98 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 127.07 2.148 . . . . 2.7599999999999998 109.66 164.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -46.33 -43.61 16.11 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 115.299 1.592 . . . . 3.5499999999999998 115.299 -177.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.98 -21.59 63.22 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 113.831 1.048 . . . . 3.7599999999999998 113.831 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -74.03 -53.36 10.19 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.718 1.207 . . . . 1.6699999999999999 108.634 165.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -52.9 -30.04 31.89 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 120.304 -1.497 . . . . 3.3999999999999999 114.401 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 33.1 t -40.76 -45.1 2.36 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.125 1.77 . . . . 4.2599999999999998 113.284 165.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.3 m -75.05 -27.99 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 CA-C-N 118.925 0.784 . . . . 3.6299999999999999 112.419 -172.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -59.25 -58.23 9.53 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 118.724 0.693 . . . . 2.9500000000000002 110.499 168.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 38.3 mt -65.42 -29.61 70.33 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.517 0.727 . . . . 2.46 111.902 -177.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.0 m -65.91 -46.64 77.53 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.331 1.052 . . . . 2.1099999999999999 111.196 174.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 59.0 mtm -61.45 -47.79 84.09 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.668 1.122 . . . . 2.0899999999999999 112.116 177.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 96.7 mt -62.21 -44.85 95.65 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.737 0.815 . . . . 2.27 112.002 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 16.3 t -66.49 -35.2 79.68 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 113.012 0.745 . . . . 2.3399999999999999 113.012 175.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.1 -41.3 96.41 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.009 0.744 . . . . 3.77 113.009 174.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.54 -38.1 86.41 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 118.53 -0.748 . . . . 2.3599999999999999 111.468 174.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -63.05 -28.17 69.91 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 120.011 1.278 . . . . 4.0999999999999996 114.059 176.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -60.55 -52.04 66.85 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.869 1.213 . . . . 2.7999999999999998 110.919 170.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -73.11 -30.42 63.62 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.063 1.345 . . . . 3.3900000000000001 112.107 -175.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.77 -54.03 51.1 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.7 1.6 . . . . 4.8300000000000001 110.132 168.192 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -55.76 -38.12 69.43 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.29 1.436 . . . . 3.7999999999999998 112.489 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 85.5 mt -70.66 -16.07 62.78 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.879 1.066 . . . . 2.7799999999999998 113.879 177.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -109.89 2.52 19.88 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.156 1.782 . . . . 3.25 113.621 175.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 15.6 t70 . . . . . 0 N--CA 1.474 0.775 0 C-N-CA 126.539 1.936 . . . . 2.9900000000000002 112.311 -174.825 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 3.9 t . . . . . 0 N--CA 1.472 0.631 0 CA-C-O 118.506 -0.759 . . . . 4.04 110.727 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -65.77 -24.52 54.38 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 122.079 1.853 . . . . 1.73 113.065 164.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 14.0 tp -65.69 -63.48 1.08 Allowed 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 121.135 1.788 . . . . 3.7400000000000002 111.451 -176.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -57.99 -37.85 75.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.234 1.016 . . . . 5.3200000000000003 110.646 178.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . 0.411 ' HA ' ' HE2' ' B' ' 7' ' ' LYS . 0.2 OUTLIER -63.92 -31.53 72.75 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 120.361 -1.462 . . . . 6.1799999999999997 112.997 174.994 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -79.38 -27.74 41.9 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.58 1.152 . . . . 2.3799999999999999 112.862 178.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 56.8 mt -60.31 -32.55 71.33 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 120.864 -1.148 . . . . 2.9500000000000002 111.799 168.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.7 m -60.35 -40.57 91.2 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.074 -1.016 . . . . 2.5299999999999998 111.722 167.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 5.9 m -57.74 -38.82 76.01 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.175 0.898 . . . . 2.2200000000000002 111.261 177.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 13.7 ttm -59.53 -37.42 78.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.447 0.906 . . . . 3.6699999999999999 113.447 173.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -75.06 -27.26 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 CA-C-N 119.911 1.232 . . . . 3.6099999999999999 112.092 172.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 85.5 m -71.94 -46.75 56.41 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.708 1.603 . . . . 1.8899999999999999 110.24 -171.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 38.1 p -69.9 -39.12 76.42 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 123.538 0.735 . . . . 2.1600000000000001 109.68 170.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -62.37 -53.63 52.14 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-O 118.455 -0.783 . . . . 3.5299999999999998 111.966 -175.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -19.44 62.62 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 120.269 1.395 . . . . 2.98 112.328 -178.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -72.63 -49.36 32.43 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.698 -1.251 . . . . 5.1799999999999997 112.519 168.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -74.54 -39.6 62.24 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.688 -1.258 . . . . 3.6899999999999999 112.886 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 18.2 m -55.96 -42.0 75.58 Favored 'General case' 0 C--O 1.245 0.831 0 C-N-CA 124.299 1.04 . . . . 2.1699999999999999 112.337 166.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.94 -9.03 86.86 Favored Glycine 0 C--N 1.343 0.928 0 C-N-CA 127.237 2.351 . . . . 1.3400000000000001 113.999 -176.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -56.75 -67.52 0.3 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.184 1.794 . . . . 4.6299999999999999 109.373 174.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -138.01 168.61 19.36 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 124.167 0.987 . . . . 3.5699999999999998 113.025 -168.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.2 -132.18 48.84 Favored Glycine 0 C--N 1.341 0.839 0 C-N-CA 125.785 1.66 . . . . 2.5600000000000001 111.816 176.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -50.51 121.78 6.21 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.176 0.991 . . . . 4.4900000000000002 110.227 158.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -85.17 -16.22 41.12 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 120.657 -1.277 . . . . 9.0099999999999998 114.411 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 60.8 tp -72.72 -36.62 67.83 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.504 1.121 . . . . 3.5600000000000001 112.226 168.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 3.2 p -119.23 166.5 12.91 Favored 'General case' 0 C--O 1.252 1.236 0 C-N-CA 126.283 1.833 . . . . 2.2999999999999998 114.553 -172.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.81 129.46 47.04 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 113.663 -1.608 . . . . 3.5699999999999998 113.83 176.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.64 175.51 5.47 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.712 1.605 . . . . 3.5800000000000001 110.698 175.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . 0.448 HH11 ' HG2' ' B' ' 31' ' ' ARG . 14.9 ttt-85 -44.77 -33.04 1.74 Allowed 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 116.738 2.125 . . . . 6.2800000000000002 116.738 -170.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -79.99 -36.49 35.92 Favored 'General case' 0 CA--C 1.549 0.931 0 O-C-N 120.337 -1.477 . . . . 4.5599999999999996 114.076 176.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -70.27 -48.2 57.85 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 108.831 -0.803 . . . . 1.8400000000000001 108.831 173.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 15.7 mt -52.09 -45.88 65.0 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.714 1.605 . . . . 4.1200000000000001 113.498 175.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -52.77 -41.95 64.54 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.373 0.533 . . . . 3.6899999999999999 111.518 178.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -71.91 -38.75 69.86 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.498 0.925 . . . . 3.2400000000000002 113.498 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 7.2 tt -57.13 -59.6 4.85 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.473 0.709 . . . . 2.98 109.876 173.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 41.8 mt -54.84 -54.57 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.957 0.903 . . . . 2.0 109.974 -172.077 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -72.61 -22.64 60.93 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 118.507 -1.277 . . . . 7.3899999999999997 114.135 -171.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -83.31 -34.89 25.61 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 117.457 -1.258 . . . . 5.1100000000000003 113.531 173.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 80.7 mt-10 -72.43 -58.12 3.64 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.736 1.153 . . . . 3.7400000000000002 111.143 172.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mp -91.97 91.47 7.87 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.72 -0.844 . . . . 4.6699999999999999 108.72 175.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 89.0 m -55.75 -37.61 68.74 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 121.599 -0.688 . . . . 4.0099999999999998 112.526 174.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.46 -156.93 0.29 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 127.492 2.317 . . . . 4.1500000000000004 114.354 -171.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.11 162.07 33.57 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.186 1.85 . . . . 5.1799999999999997 113.547 177.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -79.47 43.81 0.57 Allowed 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 122.498 1.142 . . . . 6.2000000000000002 109.995 165.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 4.2 tpt -80.49 65.55 5.68 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.519 1.527 . . . . 2.54 112.533 -157.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -71.16 164.79 24.93 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.089 1.755 . . . . 4.5 111.646 175.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -45.15 -53.53 7.97 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.789 1.636 . . . . 4.7599999999999998 112.581 175.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -66.32 -29.3 69.47 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.2 -0.938 . . . . 3.3799999999999999 113.104 -178.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 24.4 t -76.66 -18.06 58.78 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 118.089 -0.958 . . . . 3.1299999999999999 112.201 175.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 81.2 mt -86.39 -36.5 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 126.451 1.9 . . . . 2.5600000000000001 109.834 173.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -59.01 -58.4 8.82 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.704 2.002 . . . . 4.1399999999999997 111.248 168.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.402 ' CG ' ' HZ1' ' B' ' 57' ' ' LYS . 2.4 m-20 -67.63 -26.42 66.23 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.305 0.957 . . . . 2.9199999999999999 113.58 176.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.19 -56.59 19.66 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.209 0.913 . . . . 3.5099999999999998 110.282 165.278 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -69.26 -29.57 67.5 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 117.75 -1.119 . . . . 2.77 112.108 -172.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . 0.402 ' HZ1' ' CG ' ' B' ' 54' ' ' ASP . 18.5 mtpt -64.48 -36.64 84.84 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 120.397 1.453 . . . . 4.4500000000000002 113.076 164.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 22.7 t -69.18 -31.76 70.6 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.868 -1.145 . . . . 3.4100000000000001 112.599 175.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 10.4 mp -69.93 -55.62 9.19 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 120.666 -1.271 . . . . 3.7599999999999998 110.79 167.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -79.21 61.59 3.36 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 129.029 2.932 . . . . 1.3600000000000001 113.079 -173.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 22.8 mttp -54.85 -18.75 5.25 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 115.117 1.525 . . . . 4.0599999999999996 115.117 -172.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -105.79 -3.57 21.86 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.003 1.721 . . . . 3.0800000000000001 115.106 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 15.0 t 68.79 25.36 6.3 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 114.678 1.362 . . . . 2.7599999999999998 114.678 177.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 13.6 p30 -78.27 -14.31 59.48 Favored 'General case' 0 CA--C 1.552 1.022 0 O-C-N 120.682 -1.261 . . . . 2.2999999999999998 112.001 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 75.79 -6.13 2.04 Favored 'General case' 0 CA--C 1.543 0.705 1 C-N-CA 133.243 4.617 . . . . 4.6500000000000004 115.052 177.395 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -97.43 152.86 18.53 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 127.347 2.259 . . . . 3.7200000000000002 109.304 169.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 29.6 mm -115.22 97.07 5.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-O 122.322 1.058 . . . . 3.0499999999999998 109.816 171.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.92 153.4 43.63 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.297 1.839 . . . . 2.8300000000000001 110.771 159.433 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.97 -33.91 39.97 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.298 1.222 . . . . 3.8300000000000001 114.298 -174.312 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -25.83 61.77 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.778 -1.202 . . . . 4.6799999999999997 112.09 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -78.87 -47.58 16.26 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.892 1.277 . . . . 1.6799999999999999 109.342 169.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -52.92 -48.53 67.21 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 127.61 2.364 . . . . 4.3700000000000001 114.228 -174.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 97.2 p -61.17 -25.64 67.16 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.236 -0.915 . . . . 2.6400000000000001 113.149 -172.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 37.3 t -65.56 -21.74 29.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 123.784 0.834 . . . . 3.3900000000000001 111.964 178.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -57.48 -58.44 8.28 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.487 1.115 . . . . 4.3200000000000003 111.595 168.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -61.62 -40.6 95.41 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.788 0.835 . . . . 4.4000000000000004 111.037 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 52.3 m -53.39 -52.55 58.96 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 118.191 -0.909 . . . . 2.2200000000000002 112.358 172.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 74.6 mtm -57.74 -49.94 74.9 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 119.808 1.186 . . . . 2.7000000000000002 112.452 177.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 84.5 mt -62.49 -37.93 87.88 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.724 0.41 . . . . 2.4700000000000002 111.598 -179.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 8.5 t -69.22 -31.64 70.36 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.02 0.928 . . . . 2.98 112.921 175.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 67.3 mtp -61.46 -46.43 90.09 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 119.029 0.831 . . . . 2.7999999999999998 110.73 167.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.31 -45.63 90.42 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 118.728 0.695 . . . . 1.55 112.836 177.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -59.12 -27.03 65.23 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.651 -0.656 . . . . 3.77 112.759 176.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -72.86 -35.55 67.21 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.337 1.426 . . . . 2.5 112.685 176.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.79 -39.89 72.89 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.81 0.844 . . . . 2.8399999999999999 110.261 175.127 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.56 -50.87 68.9 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.167 1.387 . . . . 3.04 110.812 170.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -58.04 -29.85 65.69 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.175 1.39 . . . . 3.5299999999999998 113.123 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 24.8 mt -73.65 -24.44 60.0 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.324 1.05 . . . . 2.2599999999999998 113.547 177.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -97.74 -32.48 11.72 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 114.388 1.255 . . . . 4.1699999999999999 114.388 175.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -74.33 -27.42 60.69 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.365 1.466 . . . . 4.2800000000000002 113.568 -170.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -88.13 -1.85 58.25 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.898 0.879 . . . . 4.8799999999999999 112.853 176.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.042 0 C-N-CA 126.277 1.831 . . . . 6.1100000000000003 114.25 -159.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.4 mp0 . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 109.145 -0.687 . . . . 3.2200000000000002 109.145 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.4 p -118.27 163.99 22.41 Favored Pre-proline 0 C--O 1.238 0.481 0 C-N-CA 125.059 1.344 . . . . 2.9500000000000002 108.954 172.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -64.38 -12.75 34.59 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 121.985 1.79 . . . . 2.1699999999999999 113.516 175.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.8 tt -79.7 -35.09 39.53 Favored 'General case' 0 C--N 1.347 0.492 0 CA-C-N 120.238 1.381 . . . . 4.1600000000000001 112.512 170.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -52.69 52.68 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.339 1.427 . . . . 3.8599999999999999 108.7 167.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.494 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -57.5 -26.14 60.86 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 113.096 0.776 . . . . 5.2300000000000004 113.096 -179.137 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.64 -53.62 44.68 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-O 118.335 -0.841 . . . . 2.29 111.844 168.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 47.5 mt -54.45 -48.36 71.82 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 120.041 1.292 . . . . 2.8999999999999999 111.597 177.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.7 p -67.52 -36.31 80.79 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 117.636 -1.174 . . . . 3.8799999999999999 113.289 177.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.42 -29.12 66.77 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 121.149 1.795 . . . . 3.3700000000000001 112.078 170.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.96 -55.97 18.58 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.378 1.071 . . . . 4.5300000000000002 110.815 -178.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.7 m -62.56 -25.13 37.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 113.021 0.749 . . . . 3.3900000000000001 113.021 177.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.1 m -70.17 -49.22 52.63 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.697 1.599 . . . . 2.29 112.512 175.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -48.13 81.22 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.054 0.843 . . . . 3.1200000000000001 109.68 167.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -62.85 -50.96 68.9 Favored 'General case' 0 N--CA 1.465 0.319 0 O-C-N 124.222 0.951 . . . . 4.0599999999999996 111.1 -166.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 24.0 m170 -68.21 -34.81 76.95 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 118.394 -0.812 . . . . 3.3999999999999999 112.42 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -70.81 -43.02 69.49 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 120.056 1.298 . . . . 5.3300000000000001 113.315 177.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -70.53 -23.16 62.58 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.312 0.96 . . . . 3.3100000000000001 112.045 170.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.0 p -69.88 -36.67 75.66 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.326 -1.484 . . . . 3.7400000000000002 111.181 169.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.47 -15.37 75.17 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 125.871 1.7 . . . . 1.75 113.516 175.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -64.11 92.94 0.08 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 106.999 -1.482 . . . . 5.3799999999999999 106.999 157.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 60.63 178.08 0.1 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.764 2.026 . . . . 6.7800000000000002 115.635 169.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.36 -140.3 44.79 Favored Glycine 0 C--N 1.343 0.938 0 C-N-CA 126.294 1.902 . . . . 2.46 112.522 166.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.5 t -54.14 132.38 42.92 Favored 'General case' 0 C--O 1.241 0.613 0 O-C-N 121.817 -0.813 . . . . 3.0800000000000001 110.343 156.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.5 ptmm? -86.31 16.79 4.14 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.063 0.945 . . . . 4.8600000000000003 113.546 171.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.2 mt -128.85 -39.6 1.59 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.561 1.144 . . . . 5.1699999999999999 111.475 178.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 12.5 p -101.0 162.33 12.96 Favored 'General case' 0 C--O 1.248 0.995 0 C-N-CA 124.996 1.318 . . . . 2.4399999999999999 111.508 174.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 92.6 mt -90.48 98.17 11.62 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 112.304 -2.225 . . . . 2.5299999999999998 109.127 172.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.2 t -63.0 166.15 6.11 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 121.59 0.709 . . . . 2.3500000000000001 112.242 170.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.65 -40.61 1.99 Allowed 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 127.008 2.123 . . . . 4.5999999999999996 115.419 -175.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -79.71 -36.87 36.82 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.06 1.133 . . . . 7.21 114.06 176.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -66.09 -47.72 73.29 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.533 1.533 . . . . 1.54 109.615 -175.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 38.1 tp -53.93 -50.41 66.48 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.569 1.148 . . . . 2.8100000000000001 111.049 175.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.551 ' HZ3' ' CD ' ' A' ' 49' ' ' GLU . 38.0 ttmt -57.46 -44.74 85.04 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 112.958 0.725 . . . . 4.3300000000000001 112.958 176.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -58.31 -38.8 77.81 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 119.264 0.938 . . . . 3.77 112.488 174.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.413 HD13 ' HH ' ' A' ' 72' ' ' TYR . 3.4 tm? -68.7 -57.84 5.08 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.482 1.113 . . . . 3.7200000000000002 110.734 177.032 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.6 mt -58.27 -49.37 82.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 118.517 0.599 . . . . 1.9299999999999999 110.107 -175.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.62 -8.18 53.99 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 120.818 -1.176 . . . . 5.5499999999999998 111.874 -173.181 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -95.42 -39.03 10.21 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.998 1.319 . . . . 4.1500000000000004 113.455 166.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -72.72 -64.94 0.86 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.761 1.225 . . . . 4.5300000000000002 109.637 177.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -82.33 72.99 9.39 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 123.177 1.465 . . . . 3.1499999999999999 107.399 165.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.9 t -65.58 7.56 0.23 Allowed 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 114.877 1.436 . . . . 3.3199999999999998 114.877 178.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -49.71 157.19 0.59 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 129.452 3.101 . . . . 4.9699999999999998 114.322 -177.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -83.1 -19.64 62.43 Favored Glycine 0 N--CA 1.474 1.222 0 C-N-CA 124.313 0.959 . . . . 4.25 112.165 168.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -69.47 -29.45 67.12 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 128.806 2.842 . . . . 5.5 111.34 170.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.7 85.35 2.72 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.578 1.551 . . . . 2.9700000000000002 110.943 173.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.6 mmtp -111.53 170.71 7.94 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.728 2.411 . . . . 4.8300000000000001 110.081 176.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.551 ' CD ' ' HZ3' ' A' ' 35' ' ' LYS . 6.9 mm-40 -57.01 -42.11 79.73 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.637 -0.664 . . . . 4.3600000000000003 112.477 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -70.92 -4.2 23.31 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.824 1.416 . . . . 3.7200000000000002 114.824 173.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.4 m -101.56 -39.07 7.67 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.586 1.154 . . . . 3.0 110.715 172.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 34.8 mm -71.3 -36.24 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 125.213 1.405 . . . . 3.3500000000000001 112.242 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -66.55 -33.92 76.76 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.82 1.044 . . . . 4.04 113.82 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -83.57 -34.2 25.24 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 113.201 0.815 . . . . 2.8799999999999999 113.201 176.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.9 tt -54.51 -50.96 66.6 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.816 0.846 . . . . 3.3999999999999999 109.313 169.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.2 ttt -60.34 -40.42 90.62 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.254 1.022 . . . . 2.2599999999999998 113.009 172.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.2 ttmm -58.74 -35.25 72.41 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.206 1.002 . . . . 5.1500000000000004 112.553 176.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 68.1 m -80.44 -23.2 40.45 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.529 1.931 . . . . 2.4900000000000002 113.442 177.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.2 mt -73.66 -54.03 9.05 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.018 -1.051 . . . . 2.98 113.5 176.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -88.03 143.96 26.79 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.562 1.074 . . . . 1.9299999999999999 113.843 -167.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -115.83 7.08 14.45 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 125.252 1.421 . . . . 3.48 113.424 -177.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -118.8 -23.44 6.99 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.95 1.3 . . . . 3.4199999999999999 114.224 -170.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 54.3 m 58.77 39.55 24.05 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.448 2.299 . . . . 3.9700000000000002 112.577 -157.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.6 p30 -87.73 -26.02 23.14 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.018 1.327 . . . . 2.75 112.93 -173.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 75.35 4.4 4.09 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 130.693 3.597 . . . . 4.0499999999999998 114.346 -170.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -116.38 121.6 42.4 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.386 2.274 . . . . 2.7400000000000002 109.599 -179.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 29.0 mm -78.83 106.4 9.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 115.36 -0.836 . . . . 1.8999999999999999 109.431 177.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -58.67 147.99 30.81 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.037 1.335 . . . . 4.0999999999999996 109.468 169.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -57.29 -35.39 69.74 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 120.062 -1.649 . . . . 4.3899999999999997 111.726 173.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -50.38 -44.15 54.76 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.989 1.716 . . . . 4.6900000000000004 113.142 167.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -79.41 -40.96 28.78 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.284 1.834 . . . . 1.7 111.275 -177.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.413 ' HH ' HD13 ' A' ' 37' ' ' LEU . 6.3 t80 -58.16 -28.21 64.53 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.558 1.143 . . . . 3.1899999999999999 112.625 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 53.2 p -53.34 -33.23 52.72 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 121.025 -1.047 . . . . 3.3300000000000001 113.676 168.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.4 t -67.16 -41.63 87.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.298 1.039 . . . . 2.7799999999999998 109.725 -178.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -55.51 -57.15 13.12 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.648 0.779 . . . . 3.75 111.202 171.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.31 -33.91 73.05 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 113.06 0.763 . . . . 2.6800000000000002 113.06 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 63.7 m -70.32 -44.38 68.37 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.554 0.742 . . . . 1.74 111.481 -179.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 79.5 mtm -55.56 -41.01 72.67 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.482 0.583 . . . . 2.25 111.556 172.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.5 mt -73.23 -41.49 63.66 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.777 0.831 . . . . 2.1800000000000002 113.177 -179.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 3.5 p -67.75 -31.84 72.03 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 119.29 0.95 . . . . 4.1600000000000001 112.643 175.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 70.8 mtp -71.57 -37.73 71.03 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.791 -0.568 . . . . 2.7599999999999998 111.919 170.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.88 -36.6 83.87 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.461 1.028 . . . . 1.6899999999999999 113.213 176.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -66.76 -18.1 65.2 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.254 -0.904 . . . . 3.77 113.347 170.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -74.57 -39.85 62.0 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 119.938 1.245 . . . . 3.3300000000000001 112.915 174.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -58.53 -48.98 79.05 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.115 0.966 . . . . 4.3300000000000001 110.103 171.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.82 -46.09 64.19 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.468 1.507 . . . . 3.1699999999999999 112.876 174.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -67.09 -22.92 65.8 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.994 1.318 . . . . 3.6299999999999999 112.943 -179.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.1 mt -86.45 -24.99 25.45 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.425 1.09 . . . . 2.5 112.232 172.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -89.23 -20.8 23.71 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 115.479 1.659 . . . . 2.7599999999999998 115.479 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 . . . . . 0 N--CA 1.477 0.89 0 C-N-CA 124.55 1.14 . . . . 2.9199999999999999 112.39 167.026 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 2.6 t . . . . . 0 N--CA 1.47 0.557 0 N-CA-C 108.022 -1.103 . . . . 3.79 108.022 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -60.39 -11.51 16.83 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.186 1.924 . . . . 2.0600000000000001 113.677 175.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.21 -33.19 59.26 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 119.356 0.98 . . . . 3.7799999999999998 112.574 171.02 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -58.97 -46.28 88.47 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 121.144 -0.973 . . . . 4.8399999999999999 109.484 167.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 8.5 mmtm -65.43 -29.95 70.69 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.134 1.161 . . . . 5.0 114.134 175.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.46 -43.99 79.73 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.661 0.784 . . . . 2.1800000000000002 111.795 170.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 48.8 mt -62.7 -41.63 99.22 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.014 0.926 . . . . 2.5800000000000001 112.057 174.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -55.7 24.34 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 118.814 0.734 . . . . 2.0899999999999999 109.845 167.313 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 42.0 m -54.91 -38.8 68.08 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.202 1.801 . . . . 2.2200000000000002 112.623 -174.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 88.4 mtp -53.37 -43.49 67.84 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.973 0.806 . . . . 3.7999999999999998 111.602 175.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 19.5 t -71.36 -34.81 55.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.824 1.249 . . . . 3.2200000000000002 111.47 176.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.9 m -62.3 -47.37 84.61 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 121.123 -0.986 . . . . 2.0299999999999998 112.387 174.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 p -62.55 -28.53 69.93 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.404 1.082 . . . . 2.5699999999999998 112.065 170.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -63.56 -59.53 4.5 Favored 'General case' 0 C--O 1.225 -0.202 0 O-C-N 124.001 0.813 . . . . 3.6600000000000001 109.63 -178.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -74.67 -27.96 60.64 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 117.426 -1.273 . . . . 4.5599999999999996 114.139 -177.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 24.8 mtpt -41.05 -47.75 3.16 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.773 1.229 . . . . 7.5 112.322 167.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -108.09 -36.64 6.27 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.786 1.234 . . . . 3.2400000000000002 113.06 -175.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 29.2 t -58.47 -26.57 63.52 Favored 'General case' 0 C--O 1.246 0.874 0 O-C-N 120.824 -1.173 . . . . 2.0600000000000001 112.95 173.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.7 -7.25 87.3 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 127.61 2.529 . . . . 1.78 115.402 175.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 11.7 mmp_? -57.92 -73.33 0.07 Allowed 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 120.118 1.959 . . . . 5.4100000000000001 110.362 168.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -127.06 161.92 27.27 Favored 'General case' 0 C--O 1.246 0.909 0 C-N-CA 126.546 1.938 . . . . 3.7799999999999998 110.65 -156.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.06 -136.26 48.44 Favored Glycine 0 C--N 1.338 0.686 0 C-N-CA 125.709 1.623 . . . . 2.2200000000000002 110.978 174.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 46.1 t -63.09 141.21 58.85 Favored 'General case' 0 C--O 1.248 1.011 0 CA-C-O 123.207 1.48 . . . . 4.6399999999999997 110.828 162.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 55.4 mttm -85.86 1.29 50.41 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.902 1.281 . . . . 9.1600000000000001 112.695 173.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 76.3 mt -88.96 -33.85 17.08 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.662 1.585 . . . . 5.71 112.083 164.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 65.5 p -109.2 152.05 25.68 Favored 'General case' 0 C--O 1.249 1.032 0 C-N-CA 125.292 1.437 . . . . 2.8300000000000001 112.686 -176.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.7 pp -105.47 112.88 26.14 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 114.932 -1.031 . . . . 3.2400000000000002 111.492 170.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 2.3 p -77.74 171.01 15.6 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.853 1.261 . . . . 2.7599999999999998 112.229 170.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 -41.19 -32.69 0.29 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 117.026 2.232 . . . . 4.3099999999999996 117.026 174.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.65 -41.78 15.99 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 120.161 -1.587 . . . . 5.4199999999999999 112.196 179.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -57.85 -38.4 75.62 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.561 1.544 . . . . 1.9099999999999999 109.821 169.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 tt -68.47 -50.66 50.78 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.019 1.728 . . . . 4.1299999999999999 113.129 176.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 7.6 ptpt -71.19 -15.57 62.48 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 120.085 1.311 . . . . 3.5600000000000001 114.27 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -72.99 -56.46 5.1 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.925 0.89 . . . . 3.8999999999999999 110.974 163.108 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.1 tt -52.21 -58.99 4.94 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 126.197 1.799 . . . . 3.1800000000000002 112.598 -175.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 33.1 mt -56.55 -50.06 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 N-CA-C 109.084 -0.71 . . . . 1.9199999999999999 109.084 -172.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -71.24 -13.24 61.84 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 124.047 0.939 . . . . 4.8899999999999997 113.482 -171.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -99.59 -33.28 10.7 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 114.195 1.183 . . . . 4.79 114.195 174.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -79.95 -50.04 11.0 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.011 0.823 . . . . 4.8600000000000003 110.29 173.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 39.6 mt -81.07 64.31 5.76 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 122.955 1.359 . . . . 3.7000000000000002 109.606 160.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 8.2 p -65.64 37.19 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.034 2.534 . . . . 4.7300000000000004 112.772 164.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 98.5 mt -121.41 172.38 8.09 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 126.689 1.996 . . . . 5.29 111.178 -171.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -75.39 22.44 1.67 Allowed Glycine 0 CA--C 1.535 1.312 0 CA-C-O 117.738 -1.59 . . . . 3.5499999999999998 114.666 176.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.19 -128.65 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 126.005 1.722 . . . . 9.4299999999999997 112.181 -171.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 14.3 ptp -62.85 146.07 53.57 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.813 1.642 . . . . 4.9400000000000004 114.494 -172.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -121.59 161.21 22.82 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.547 1.139 . . . . 4.8899999999999997 109.364 -173.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -66.79 -12.83 60.36 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 117.783 2.512 . . . . 4.5199999999999996 117.783 -155.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 12.9 t -72.75 -12.16 60.9 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 120.617 1.553 . . . . 3.0 114.199 167.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 7.7 m -103.73 -16.21 15.51 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.055 1.342 . . . . 3.5699999999999998 112.534 175.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 10.7 mm -64.53 -34.28 68.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.793 1.237 . . . . 2.9300000000000002 111.757 177.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.25 -18.97 57.21 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.195 0.998 . . . . 2.9100000000000001 112.646 176.456 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -80.47 -42.63 22.23 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.272 -0.893 . . . . 3.0299999999999998 110.802 166.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -57.25 -46.9 82.59 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.931 1.293 . . . . 3.7999999999999998 109.967 175.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 6.9 tpt -48.31 -57.73 5.59 Favored 'General case' 0 C--O 1.217 -0.648 0 C-N-CA 125.782 1.633 . . . . 2.8300000000000001 111.134 167.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.04 -25.44 67.83 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.25 1.42 . . . . 5.0300000000000002 114.017 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 15.1 m -82.11 -39.6 23.12 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.44 1.896 . . . . 2.2999999999999998 111.764 -178.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 12.4 mt -57.33 -59.06 5.69 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.116 1.366 . . . . 4.0599999999999996 111.044 158.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -80.77 47.92 1.02 Allowed 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 127.574 2.349 . . . . 1.7 112.103 -173.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -51.57 -24.42 5.34 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.31 1.844 . . . . 6.5 112.954 170.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 52.5 p30 -88.74 -6.88 57.13 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 115.616 1.709 . . . . 2.8399999999999999 115.616 172.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 19.1 m 69.42 25.22 5.53 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.258 1.823 . . . . 3.9399999999999999 115.417 163.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 p30 -100.71 -2.87 31.39 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.818 1.647 . . . . 2.48 113.048 -177.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 63.99 -7.64 0.2 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 131.154 3.782 . . . . 4.25 115.989 -174.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -92.83 145.78 24.13 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 123.706 0.802 . . . . 4.2999999999999998 108.965 174.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 42.6 mm -117.63 113.14 41.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 125.313 1.445 . . . . 2.6000000000000001 108.875 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.28 173.23 9.31 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.615 1.166 . . . . 2.73 110.571 161.344 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -54.39 -38.4 66.12 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.933 1.086 . . . . 4.4400000000000004 113.933 175.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 18.1 mtpp -71.47 -25.2 62.18 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.492 0.717 . . . . 5.4800000000000004 112.447 -177.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -75.66 -53.45 8.54 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.073 0.949 . . . . 1.6799999999999999 110.188 161.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -51.58 -37.49 50.05 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.498 1.919 . . . . 3.8700000000000001 114.874 -173.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 4.8 m -59.44 -26.49 65.24 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 117.791 -1.1 . . . . 2.4500000000000002 113.848 173.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 68.0 t -62.46 -47.12 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 CA-C-N 120.679 1.581 . . . . 2.54 110.277 178.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -57.89 -50.75 72.27 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.488 1.115 . . . . 2.6499999999999999 112.219 172.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 82.9 mt -67.85 -29.0 68.03 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 118.693 -0.67 . . . . 2.8300000000000001 112.31 -176.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 31.5 m -65.16 -50.75 64.77 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.219 1.008 . . . . 1.76 110.538 167.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 72.8 mtp -55.78 -41.61 74.32 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.207 1.003 . . . . 3.0099999999999998 113.197 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 39.8 mt -69.16 -50.56 46.56 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 118.531 0.605 . . . . 2.5099999999999998 112.094 174.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -65.84 -26.7 67.78 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 121.513 -0.742 . . . . 2.3399999999999999 111.984 -177.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 60.7 mmm -63.19 -44.49 95.22 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.554 1.142 . . . . 3.1099999999999999 112.553 165.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.1 -36.92 80.99 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.863 1.21 . . . . 1.9299999999999999 112.455 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -69.96 -23.31 63.16 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.966 1.099 . . . . 3.52 113.966 171.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -63.26 -48.59 77.55 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.463 1.029 . . . . 3.5 111.452 175.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -63.27 -43.71 97.17 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.764 1.225 . . . . 3.1400000000000001 112.214 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -54.36 -50.93 66.33 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.363 1.465 . . . . 4.2800000000000002 111.649 176.694 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -63.76 -27.44 69.2 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.121 0.968 . . . . 3.9100000000000001 111.882 -176.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 82.3 mt -81.17 -14.27 57.77 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 117.749 -1.12 . . . . 2.8399999999999999 112.834 177.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -92.96 -21.45 19.78 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.405 1.261 . . . . 4.3499999999999996 114.405 166.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -73.99 -36.5 64.52 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.372 1.469 . . . . 3.9900000000000002 112.816 175.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -99.25 47.06 0.97 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.745 1.218 . . . . 2.7799999999999998 112.655 -167.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt . . . . . 0 C--O 1.249 1.052 0 C-N-CA 127.752 2.421 . . . . 4.9900000000000002 114.797 -174.864 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.473 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 24.2 mt-10 . . . . . 0 CA--C 1.548 0.887 0 N-CA-C 113.884 1.068 . . . . 6.3499999999999996 113.884 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 9.9 p -107.19 178.19 1.14 Allowed Pre-proline 0 N--CA 1.48 1.069 0 C-N-CA 127.169 2.187 . . . . 2.71 113.059 -159.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.34 -24.9 19.03 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 122.201 1.934 . . . . 1.8500000000000001 113.986 170.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.2 tt -75.12 -41.37 58.61 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 119.645 1.112 . . . . 4.0700000000000003 111.173 173.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.473 ' CD ' ' H ' ' A' ' 2' ' ' GLU . 1.6 tm-20 -59.29 -43.8 92.55 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.654 0.782 . . . . 4.4100000000000001 110.772 173.667 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.3 mttp -68.34 -32.86 73.27 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.453 -1.404 . . . . 3.9700000000000002 113.224 173.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.96 -50.25 74.17 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.81 0.732 . . . . 1.9199999999999999 112.016 174.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.5 mt -69.75 -33.49 72.5 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.179 0.9 . . . . 3.27 111.873 178.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 88.7 m -57.84 -45.34 86.37 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 118.055 -0.974 . . . . 2.4700000000000002 111.111 169.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.4 m -58.16 -40.08 80.5 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.742 1.156 . . . . 2.3300000000000001 111.648 175.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 16.3 mtp -62.67 -52.37 63.59 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 118.65 0.659 . . . . 4.3600000000000003 110.779 174.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.0 t -58.0 -37.24 60.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 121.217 -0.927 . . . . 3.1800000000000002 112.725 176.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.4 m -67.15 -57.0 7.58 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.587 1.555 . . . . 2.5699999999999998 110.73 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.4 p -58.79 -41.08 85.86 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.329 0.651 . . . . 2.75 109.976 176.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.43 -65.61 0.66 Allowed 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 118.687 -0.673 . . . . 3.54 109.241 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -58.07 -36.21 72.48 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 120.078 1.308 . . . . 2.96 112.446 -177.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -63.37 -56.11 19.02 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 120.52 -1.363 . . . . 5.6600000000000001 113.348 174.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -70.95 -31.24 67.75 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.188 0.995 . . . . 4.29 111.459 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.0 t -58.23 -37.64 75.26 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 124.908 1.283 . . . . 2.48 111.017 169.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.98 6.88 11.01 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 127.906 2.67 . . . . 1.8 116.379 175.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -94.48 123.25 37.78 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 105.332 -2.099 . . . . 5.8799999999999999 105.332 150.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 60.77 169.42 0.09 Allowed 'General case' 0 CA--C 1.559 1.303 0 N-CA-C 116.069 1.877 . . . . 5.7199999999999998 116.069 161.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.25 -106.33 1.56 Allowed Glycine 0 N--CA 1.472 1.078 0 N-CA-C 108.39 -1.884 . . . . 2.5699999999999998 108.39 -175.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.7 m -129.63 -179.85 5.41 Favored 'General case' 0 C--O 1.24 0.592 0 O-C-N 121.741 -0.858 . . . . 4.0899999999999999 111.946 141.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.2 ttmm -66.87 -9.62 39.72 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 127.973 2.509 . . . . 5.0300000000000002 113.326 174.142 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.9 mt -84.5 -43.62 14.39 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.698 1.599 . . . . 4.6299999999999999 111.302 170.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.7 p -101.51 134.6 44.37 Favored 'General case' 0 C--O 1.243 0.712 0 C-N-CA 125.862 1.665 . . . . 2.5 112.241 -168.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 68.4 mt -88.02 96.04 10.36 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.354 1.462 . . . . 2.6699999999999999 108.848 162.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.4 m -66.87 157.62 32.66 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.227 -0.921 . . . . 3.3300000000000001 112.133 171.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 45.5 ttt-85 -50.63 -9.88 0.06 Allowed 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 128.115 2.566 . . . . 4.2000000000000002 117.527 -177.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.43 -44.0 7.04 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 119.895 -1.753 . . . . 5.9100000000000001 113.259 167.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -54.42 -45.95 73.1 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.084 1.354 . . . . 1.5600000000000001 109.711 170.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.3 tp -67.28 -40.41 86.13 Favored 'General case' 0 C--N 1.344 0.368 0 C-N-CA 123.203 0.601 . . . . 3.2799999999999998 112.307 -179.505 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -59.51 -44.54 93.09 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.88 0.764 . . . . 3.96 111.658 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.424 ' HG2' ' HE2' ' A' ' 40' ' ' LYS . 53.3 tt0 -63.92 -52.19 60.98 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-O 119.035 -0.507 . . . . 3.8999999999999999 112.096 173.329 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -61.69 -47.39 85.53 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.843 1.257 . . . . 4.0199999999999996 112.647 -174.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 48.0 mt -49.77 -47.39 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 119.378 0.99 . . . . 1.9399999999999999 109.291 170.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.3 tptt -74.08 -12.7 60.68 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 112.995 0.739 . . . . 6.3899999999999997 112.995 -173.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.424 ' HE2' ' HG2' ' A' ' 36' ' ' GLU . 68.1 mmtt -79.69 -40.32 29.26 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.894 1.224 . . . . 3.5499999999999998 112.573 163.57 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -67.06 -71.76 0.19 Allowed 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 108.973 -0.751 . . . . 4.71 108.973 175.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.5 mt -76.45 65.5 2.33 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.956 1.302 . . . . 4.0199999999999996 111.824 172.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 14.9 t -79.63 -27.02 40.98 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.885 1.674 . . . . 4.7999999999999998 112.942 174.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -54.7 1.63 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 130.159 3.384 . . . . 4.5599999999999996 120.086 -161.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 104.8 -23.49 30.96 Favored Glycine 0 N--CA 1.473 1.118 0 C-N-CA 125.861 1.696 . . . . 4.29 113.465 -175.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.465 ' CD ' ' HZ2' ' A' ' 48' ' ' LYS . 2.6 mm-40 -80.87 171.36 15.11 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 117.475 0.637 . . . . 5.46 112.19 160.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 31.1 tpp 72.6 106.3 0.07 Allowed 'General case' 0 C--O 1.235 0.328 0 C-N-CA 129.165 2.986 . . . . 2.5499999999999998 112.49 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.465 ' HZ2' ' CD ' ' A' ' 46' ' ' GLU . 5.0 mptt -131.1 157.3 43.48 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.429 1.892 . . . . 6.2300000000000004 111.129 -174.103 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -26.46 -74.88 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 128.34 2.656 . . . . 4.6699999999999999 114.921 -168.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.1 m -65.14 -17.0 64.11 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.543 1.312 . . . . 3.2799999999999998 114.543 -169.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -76.17 -15.69 60.01 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.246 -0.909 . . . . 3.4399999999999999 112.919 173.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 81.0 mt -75.11 -30.15 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.1 0.96 . . . . 2.7400000000000002 110.482 -178.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.2 -22.09 36.12 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.543 0.942 . . . . 2.6299999999999999 113.543 -179.643 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -68.75 -44.13 74.39 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 121.188 -0.945 . . . . 3.2400000000000002 109.886 157.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 17.1 tp -62.57 -39.03 92.36 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 117.684 -1.15 . . . . 2.7400000000000002 110.958 -176.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.6 mmm -51.95 -56.79 12.01 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 126.022 1.729 . . . . 2.6600000000000001 112.113 167.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.4 tmmm? -58.91 -31.34 68.54 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.567 1.547 . . . . 4.3099999999999996 112.874 177.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 20.6 m -88.72 -26.86 21.56 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.82 1.648 . . . . 2.52 112.775 -175.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.6 mp -66.52 -44.0 83.71 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.099 0.863 . . . . 4.2999999999999998 110.76 160.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -58.69 147.07 34.24 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 123.134 1.445 . . . . 2.9500000000000002 113.617 174.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.38 15.24 13.87 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.852 1.261 . . . . 3.5 111.876 161.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 27.7 p-10 -137.85 -48.63 0.56 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.099 1.759 . . . . 3.9100000000000001 112.851 -177.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 2.9 t 95.62 104.18 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 129.163 2.985 . . . . 3.8399999999999999 108.383 -173.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.8 p30 -145.64 -139.31 0.1 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.736 1.215 . . . . 4.1799999999999997 109.349 -178.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -141.38 24.56 2.09 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.085 0.954 . . . . 4.7800000000000002 111.068 164.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -144.89 136.78 25.73 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 126.026 1.73 . . . . 3.2999999999999998 112.683 -173.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 39.8 mm -120.94 124.31 72.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 125.515 1.526 . . . . 2.23 110.274 -173.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.4 -176.23 3.33 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.967 1.707 . . . . 2.9700000000000002 111.794 168.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -57.44 -37.5 72.92 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 116.326 1.973 . . . . 4.8899999999999997 116.326 175.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 43.5 mtmt -74.58 -31.95 62.22 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.835 0.854 . . . . 4.4100000000000001 111.964 -178.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -69.76 -65.04 0.77 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.63 0.772 . . . . 2.2200000000000002 109.337 162.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -47.34 -36.45 9.49 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.996 2.119 . . . . 3.5499999999999998 115.224 -174.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.5 m -70.0 -19.38 63.33 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 120.314 -1.491 . . . . 2.8999999999999999 111.97 -177.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -74.05 -22.29 18.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 O-C-N 121.292 -0.88 . . . . 3.3199999999999998 112.696 173.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -65.28 -66.5 0.54 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.449 1.5 . . . . 4.1600000000000001 110.477 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.75 -33.2 55.01 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.316 1.446 . . . . 3.6000000000000001 112.523 170.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.6 m -59.57 -44.72 93.2 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.854 1.206 . . . . 1.96 112.139 173.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 51.4 mtp -60.23 -42.94 96.28 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.933 0.788 . . . . 2.7000000000000002 111.234 178.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 44.0 mt -66.57 -50.04 64.41 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.332 1.053 . . . . 2.0800000000000001 110.87 178.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 3.2 t -64.31 -27.26 68.91 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.269 1.428 . . . . 2.0499999999999998 113.051 -177.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 71.8 mtm -72.63 -39.39 67.25 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.051 1.13 . . . . 4.8200000000000003 114.051 165.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.6 -44.37 82.29 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.612 1.096 . . . . 2.27 112.036 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -60.9 -24.75 66.22 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.669 0.618 . . . . 3.48 112.669 173.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -65.93 -51.98 53.83 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 118.978 0.808 . . . . 3.4300000000000002 112.083 175.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -58.8 -51.05 71.63 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.207 1.803 . . . . 2.9199999999999999 111.581 174.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -50.93 -47.14 61.02 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.62 1.568 . . . . 4.0899999999999999 111.439 178.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -64.41 -33.76 76.62 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.913 0.885 . . . . 3.8900000000000001 112.852 -178.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.3 mt -74.61 -18.39 60.57 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.819 0.848 . . . . 2.77 112.745 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -96.96 -13.91 22.05 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.742 1.386 . . . . 4.8499999999999996 114.742 172.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 28.8 t70 . . . . . 0 CA--C 1.539 0.551 0 C-N-CA 125.343 1.457 . . . . 3.1499999999999999 112.668 179.415 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 74.1 p . . . . . 0 N--CA 1.47 0.552 0 N-CA-C 110.225 -0.287 . . . . 2.6800000000000002 110.225 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -64.72 -6.62 12.74 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 123.04 2.493 . . . . 1.6100000000000001 114.692 175.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 10.6 mp -76.91 -55.52 5.4 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.907 1.231 . . . . 4.6900000000000004 111.165 174.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -59.62 -29.85 68.29 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-O 122.297 1.046 . . . . 4.3099999999999996 111.82 170.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.74 -37.15 65.17 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 119.411 -2.055 . . . . 5.7599999999999998 113.869 170.495 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.02 -45.46 93.47 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.507 1.123 . . . . 2.1299999999999999 112.467 170.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 58.8 mt -58.45 -44.64 89.31 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 124.758 1.223 . . . . 2.46 111.425 173.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 64.7 m -53.48 -56.17 19.2 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 118.272 -0.871 . . . . 2.23 110.711 169.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 94.9 m -58.86 -37.1 75.73 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.144 1.378 . . . . 2.5699999999999998 111.811 -178.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.2 mmm -59.06 -51.81 68.45 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.304 1.042 . . . . 4.2000000000000002 112.674 171.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 85.6 t -68.79 -31.67 51.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 121.126 -0.984 . . . . 2.8700000000000001 111.909 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 31.8 m -59.02 -59.86 4.8 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.131 1.373 . . . . 2.2000000000000002 110.178 175.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.7 -31.48 71.47 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 124.743 1.217 . . . . 3.3100000000000001 110.046 -174.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -63.06 -46.73 86.13 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.892 0.701 . . . . 3.0699999999999998 112.892 174.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -61.99 -39.32 91.82 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.996 -1.065 . . . . 2.7599999999999998 112.408 175.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.475 ' HE2' ' CZ ' ' B' ' 19' ' ' TYR . 4.9 tttt -53.65 -33.44 55.24 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 125.501 1.52 . . . . 6.6600000000000001 113.468 171.341 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.475 ' CZ ' ' HE2' ' B' ' 18' ' ' LYS . 67.1 m-85 -96.02 -37.25 10.72 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 115.614 1.709 . . . . 3.5699999999999998 115.614 176.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 62.8 m -66.66 -22.69 66.09 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 116.661 2.097 . . . . 2.1200000000000001 116.661 -172.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.02 -17.18 63.56 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-O 118.43 -1.206 . . . . 2.0600000000000001 113.982 179.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 28.7 ttt-85 -58.07 -26.99 63.23 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.408 2.283 . . . . 4.5199999999999996 114.107 -175.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.426 ' C ' ' H ' ' B' ' 25' ' ' SER . 22.5 tt0 -151.33 144.41 24.62 Favored 'General case' 0 C--O 1.243 0.76 0 C-N-CA 128.617 2.767 . . . . 3.79 108.382 178.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.18 -12.76 0.58 Allowed Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.318 1.437 . . . . 2.2799999999999998 114.766 -172.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 25' ' ' SER . . . . . 0.426 ' H ' ' C ' ' B' ' 23' ' ' GLU . 0.9 OUTLIER 63.72 -159.66 0.3 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.56 1.944 . . . . 7.2400000000000002 110.747 -161.173 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 31.5 mmtm 73.62 -176.28 0.16 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.306 2.242 . . . . 9.9100000000000001 113.193 163.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -72.82 -9.3 58.51 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.79 1.236 . . . . 3.6299999999999999 113.521 168.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 5.9 p -90.43 135.21 33.83 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.974 1.309 . . . . 2.1699999999999999 110.954 -171.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -114.93 108.42 16.69 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.42 1.888 . . . . 3.2200000000000002 110.691 -159.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.429 ' HA ' ' HA ' ' B' ' 66' ' ' GLU . 0.9 OUTLIER -76.17 162.29 28.1 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 119.394 -2.066 . . . . 3.2400000000000002 115.364 -171.278 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -44.23 -38.28 3.71 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.728 0.811 . . . . 4.3700000000000001 112.176 169.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.66 -41.51 26.76 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.773 -1.204 . . . . 5.2400000000000002 114.055 177.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -58.31 -40.16 81.3 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.139 0.575 . . . . 1.76 109.978 173.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 18.3 tp -65.68 -41.86 91.93 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.818 1.247 . . . . 2.98 112.669 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 20.7 mtpt -49.73 -53.06 27.08 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 120.305 1.411 . . . . 4.2800000000000002 111.483 176.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -67.14 -41.61 85.79 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 117.959 -1.02 . . . . 3.1200000000000001 113.305 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.6 tt -54.87 -54.21 45.41 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.618 1.099 . . . . 2.9300000000000002 110.471 175.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 29.1 mt -57.88 -48.57 83.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 118.186 -0.911 . . . . 2.3599999999999999 109.856 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -75.65 -8.12 56.01 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 115.205 1.557 . . . . 6.0300000000000002 115.205 -172.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -108.29 -45.24 3.95 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.162 1.385 . . . . 4.5099999999999998 112.353 174.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -80.23 -19.83 46.01 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.122 0.569 . . . . 5.5099999999999998 111.357 -178.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mp -128.66 174.14 9.68 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.351 1.861 . . . . 4.7300000000000004 108.77 156.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 27.0 p -150.91 4.17 0.47 Allowed 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 116.755 2.132 . . . . 3.52 116.755 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 4.5 mp -43.16 -32.34 0.72 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 117.405 2.372 . . . . 3.7999999999999998 117.405 -168.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.64 -26.98 2.6 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 124.82 1.2 . . . . 3.8900000000000001 113.515 -178.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -61.03 -25.82 67.18 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.471 1.135 . . . . 5.8399999999999999 113.007 167.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.92 72.97 0.18 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 122.839 1.304 . . . . 3.2000000000000002 110.622 147.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.1 mppt? -66.13 159.23 26.64 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.05 -0.977 . . . . 5.4500000000000002 108.742 166.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -52.2 -37.66 55.55 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 113.359 0.874 . . . . 4.96 113.359 -177.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 35.2 t -62.37 -16.7 56.18 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 115.021 1.489 . . . . 4.46 115.021 174.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 3.3 t -106.33 -3.38 21.22 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.419 1.488 . . . . 3.6699999999999999 112.264 173.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 19.6 mm -80.2 -44.0 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 O-C-N 120.025 -1.672 . . . . 2.8399999999999999 110.839 175.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -70.98 -42.58 69.48 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.55 0.574 . . . . 3.3700000000000001 112.55 -178.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.95 -35.08 69.48 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 120.43 -1.419 . . . . 2.4300000000000002 112.483 -177.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -54.42 -47.88 72.28 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.324 1.049 . . . . 3.3999999999999999 110.285 164.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.49 -44.33 89.35 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.849 1.26 . . . . 2.6899999999999999 112.378 177.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -69.6 -27.22 64.91 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 120.832 -1.167 . . . . 4.8899999999999997 113.597 176.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 23.0 t -71.71 -36.13 70.44 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 121.125 -0.984 . . . . 3.29 111.523 170.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 8.7 mp -62.78 -50.33 71.47 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-O 118.352 -0.833 . . . . 3.8599999999999999 112.102 168.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -87.57 82.4 7.46 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 122.086 0.946 . . . . 1.6699999999999999 113.293 -169.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -21.65 58.74 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.121 1.156 . . . . 4.5 114.121 -177.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -84.69 -22.89 29.62 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.28 0.945 . . . . 2.7000000000000002 112.101 175.599 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 32.2 t 58.5 38.92 25.44 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.576 1.151 . . . . 2.9500000000000002 112.138 -167.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -88.54 -119.24 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.478 1.511 . . . . 3.04 107.152 176.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -148.6 -3.82 0.46 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 117.447 2.388 . . . . 4.9199999999999999 117.447 166.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . 0.429 ' HA ' ' HA ' ' B' ' 30' ' ' SER . 16.8 mt-10 -118.5 146.69 44.33 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 123.175 1.464 . . . . 3.25 112.702 166.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 79.1 mt -103.07 115.62 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 126.958 2.103 . . . . 3.0600000000000001 109.405 -175.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.74 161.73 25.57 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.808 2.043 . . . . 2.6299999999999999 111.2 169.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.2 -31.93 67.79 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 119.982 -1.699 . . . . 3.7000000000000002 114.749 -174.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.9 mtmp? -83.11 -16.98 44.7 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.222 1.409 . . . . 4.0999999999999996 113.151 177.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -70.66 -61.85 1.61 Allowed 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 107.389 -1.338 . . . . 1.99 107.389 156.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -58.45 -29.86 66.49 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 127.975 2.51 . . . . 4.0199999999999996 117.3 -171.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 60.2 p -58.29 -24.01 58.15 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 120.777 1.626 . . . . 2.79 113.745 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.9 p -67.56 -22.82 28.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 O-C-N 121.529 -0.732 . . . . 3.2999999999999998 112.578 174.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -63.73 -51.15 66.21 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.233 1.013 . . . . 4.6600000000000001 110.397 174.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 39.5 mt -60.74 -44.56 96.52 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 124.183 0.993 . . . . 2.9199999999999999 110.39 176.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 43.4 m -54.69 -54.35 42.94 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.743 0.817 . . . . 2.0899999999999999 111.423 176.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 48.5 mtm -60.32 -45.15 94.43 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.403 0.681 . . . . 2.6400000000000001 112.124 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 82.4 mt -63.17 -43.71 97.5 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 118.467 0.576 . . . . 3.1000000000000001 112.354 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 93.3 m -67.76 -33.82 75.6 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 122.742 0.417 . . . . 3.0899999999999999 112.073 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 64.5 mtp -68.56 -38.76 81.04 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 118.777 0.717 . . . . 2.8900000000000001 112.847 172.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.23 -38.19 66.13 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.482 1.037 . . . . 2.0800000000000001 112.351 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -68.31 -25.66 65.24 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.403 1.001 . . . . 3.2999999999999998 113.362 177.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 17.7 t30 -59.54 -46.09 89.89 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.358 0.981 . . . . 2.9900000000000002 111.499 169.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.89 -34.69 44.55 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.307 1.443 . . . . 3.1400000000000001 111.973 -175.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -53.32 -54.49 35.77 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.331 1.452 . . . . 4.4000000000000004 110.019 166.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -54.11 -36.28 63.05 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.895 1.278 . . . . 3.8900000000000001 112.757 177.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 55.1 mt -74.16 -19.16 60.65 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.916 1.08 . . . . 2.9300000000000002 113.916 178.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -101.83 -14.94 17.07 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.567 1.321 . . . . 3.5699999999999998 114.567 171.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -96.47 -48.45 5.56 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.312 1.845 . . . . 4.7599999999999998 112.548 -176.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -87.83 46.75 1.41 Allowed 'General case' 0 CA--C 1.548 0.866 0 CA-C-O 122.903 1.335 . . . . 4.2999999999999998 111.316 173.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm . . . . . 0 C--O 1.25 1.107 0 CA-C-O 114.903 -2.475 . . . . 5.5700000000000003 114.894 168.874 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 . . . . . 0 CA--C 1.531 0.22 0 N-CA-C 108.648 -0.871 . . . . 3.8300000000000001 108.648 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.9 t 174.13 150.76 0.25 Allowed Pre-proline 0 C--O 1.236 0.386 0 C-N-CA 127.331 2.253 . . . . 3.5499999999999998 107.612 -163.498 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -73.51 -24.25 16.38 Favored 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 121.925 1.75 . . . . 1.6899999999999999 112.437 175.564 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -69.54 -43.05 73.79 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.141 -0.933 . . . . 4.3600000000000003 112.584 -171.557 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -53.08 -34.52 56.96 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 122.137 0.97 . . . . 4.2400000000000002 112.563 171.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 46.9 mttt -80.68 -25.52 38.16 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.67 -1.269 . . . . 5.0 111.455 -179.037 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.47 -42.23 62.16 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.027 0.931 . . . . 1.95 111.198 169.461 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 83.7 mt -64.3 -43.02 96.04 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.185 0.994 . . . . 2.3599999999999999 111.224 171.741 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 87.2 m -55.35 -42.84 74.41 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.136 -0.977 . . . . 2.4399999999999999 111.664 167.912 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.5 m -61.63 -38.34 87.3 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 119.763 1.165 . . . . 2.1400000000000001 111.387 178.73 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 33.1 ttm -56.34 -53.88 52.06 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 118.473 0.579 . . . . 3.7599999999999998 111.388 169.924 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 93.2 t -62.39 -37.07 77.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-N 118.798 0.727 . . . . 2.8199999999999998 112.498 178.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 76.0 m -57.43 -59.17 5.55 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.907 1.283 . . . . 1.8400000000000001 110.408 177.315 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.21 -34.28 70.7 Favored 'General case' 0 CA--C 1.521 -0.167 0 C-N-CA 123.789 0.836 . . . . 3.0499999999999998 110.599 -170.109 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -57.59 -40.35 78.84 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.344 0.658 . . . . 3.7999999999999998 110.976 174.612 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 36.6 m170 -78.81 -28.17 44.45 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.931 1.086 . . . . 3.1200000000000001 113.931 176.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.1 mtmp? -60.27 -55.72 30.33 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.366 1.439 . . . . 5.5 111.438 166.553 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -71.24 -32.28 68.57 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.516 -0.74 . . . . 3.3199999999999998 111.96 -177.485 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.0 t -73.04 -6.43 45.49 Favored 'General case' 0 C--O 1.247 0.948 0 N-CA-C 116.465 2.024 . . . . 2.6699999999999999 116.465 -178.389 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.7 -12.62 74.34 Favored Glycine 0 CA--C 1.539 1.551 0 CA-C-O 119.061 -0.855 . . . . 2.2400000000000002 113.02 166.338 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -60.98 -31.35 70.94 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.507 1.523 . . . . 7.5300000000000002 113.652 -177.315 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 173.13 -149.95 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 129.662 3.185 . . . . 4.2199999999999998 111.706 164.337 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.04 -149.44 21.8 Favored Glycine 0 N--CA 1.476 1.352 0 O-C-N 120.351 -1.468 . . . . 2.8199999999999998 111.973 -175.229 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.7 m -78.48 -177.49 5.31 Favored 'General case' 0 CA--C 1.55 0.975 0 O-C-N 121.007 -1.29 . . . . 2.9199999999999999 112.072 158.351 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.48 ' HZ2' ' C ' ' B' ' 92' ' ' LYS . 38.1 ttmt -84.54 -32.99 23.58 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.191 1.397 . . . . 5.0300000000000002 111.726 169.579 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.07 6.84 14.99 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.923 1.689 . . . . 4.1299999999999999 114.711 178.022 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 24.1 p -146.95 150.9 36.09 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.843 1.657 . . . . 1.8200000000000001 110.554 -170.141 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 79.1 mt -116.82 109.36 16.99 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.248 1.019 . . . . 2.5600000000000001 112.331 174.603 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.0 t -77.46 151.93 34.47 Favored 'General case' 0 CA--C 1.549 0.924 0 O-C-N 121.325 -0.859 . . . . 2.4300000000000002 111.886 173.316 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.42 -46.19 4.63 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 126.087 1.755 . . . . 6.8700000000000001 115.604 -172.169 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.38 -18.06 61.21 Favored 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 115.051 1.5 . . . . 5.4400000000000004 115.051 178.996 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -90.73 -45.57 8.77 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 128.77 2.828 . . . . 3.1499999999999999 109.837 175.276 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.19 -31.04 72.01 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.281 1.033 . . . . 4.0300000000000002 112.906 175.318 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.95 -17.72 65.05 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.754 1.39 . . . . 6.2400000000000002 114.754 177.097 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.22 -58.2 3.42 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.38 1.072 . . . . 3.6899999999999999 108.894 171.529 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.9 tt -50.03 -56.02 12.44 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.729 1.611 . . . . 3.0600000000000001 112.121 -179.145 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.5 mt -53.69 -60.19 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 CA-C-N 118.85 0.75 . . . . 1.95 109.937 -175.142 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.4 tptt -72.39 -9.64 58.77 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 113.264 0.839 . . . . 6.6399999999999997 113.264 -174.794 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 46.0 mmtt -91.69 -35.91 13.91 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.82 1.648 . . . . 4.2800000000000002 114.988 173.702 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -104.25 -44.38 4.98 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.652 0.781 . . . . 5.1399999999999997 112.094 -175.04 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -104.47 61.4 0.72 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.434 1.894 . . . . 3.75 107.92 175.131 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 59.1 m -45.8 -64.94 0.62 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.537 1.535 . . . . 4.0499999999999998 113.066 -166.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 95.9 mt 65.19 152.17 0.05 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 127.862 2.465 . . . . 5.5 115.974 168.426 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.57 -25.29 63.35 Favored Glycine 0 N--CA 1.474 1.199 0 O-C-N 121.378 -0.826 . . . . 3.54 111.336 171.513 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.48 -160.2 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 129.484 3.114 . . . . 6.7000000000000002 110.894 173.312 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 17.8 mmt 43.5 93.38 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.22 1.808 . . . . 3.1200000000000001 115.187 -179.729 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.53 126.96 50.99 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.131 -1.062 . . . . 4.8399999999999999 108.131 164.076 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -12.73 -83.7 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 127.705 2.402 . . . . 4.9299999999999997 114.951 -157.652 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.5 t -60.08 -11.44 5.98 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.884 1.809 . . . . 4.4500000000000002 115.884 -172.009 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.9 t -61.53 -13.88 24.97 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 120.749 -1.219 . . . . 2.8599999999999999 113.513 164.684 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 88.9 mt -77.03 -21.35 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 126.585 1.954 . . . . 2.3500000000000001 111.828 171.156 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -70.66 -53.53 15.41 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.858 0.754 . . . . 3.0099999999999998 111.3 -169.462 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -67.47 -34.01 76.29 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 121.51 -0.744 . . . . 3.2999999999999998 111.889 172.467 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.6 tp -54.73 -59.37 4.8 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 118.52 -0.752 . . . . 2.9500000000000002 110.186 174.11 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -67.4 -33.02 74.32 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.465 0.575 . . . . 3.1299999999999999 112.161 -179.323 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.5 tmtm? -65.78 -22.25 66.56 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 120.782 -1.198 . . . . 7.1100000000000003 112.885 169.455 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.2 t -86.89 -28.33 22.88 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.352 1.861 . . . . 2.27 112.637 170.054 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.7 mt -65.83 -33.71 76.48 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.436 -0.79 . . . . 2.8999999999999999 111.335 167.444 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.422 ' CG ' ' H ' ' A' ' 64' ' ' ASP . 6.0 t0 -68.32 99.14 0.89 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 122.636 1.208 . . . . 2.3999999999999999 111.818 176.925 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -67.42 -23.6 65.56 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.691 1.196 . . . . 6.46 113.697 -176.764 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -83.9 -29.81 26.86 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.322 1.449 . . . . 3.1600000000000001 112.079 167.81 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.7 t 72.25 41.67 0.61 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 128.707 2.803 . . . . 3.9700000000000002 112.143 -167.569 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.422 ' H ' ' CG ' ' A' ' 60' ' ' ASP . 3.2 p30 -94.9 -117.82 0.1 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.736 1.615 . . . . 3.8599999999999999 106.775 -179.656 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -153.04 -9.12 0.17 Allowed 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 116.394 1.998 . . . . 4.4500000000000002 116.394 173.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -101.41 128.97 47.37 Favored 'General case' 0 C--O 1.242 0.665 0 N-CA-C 106.857 -1.534 . . . . 2.6000000000000001 106.857 171.788 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 20.1 mm -96.54 89.74 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 124.451 1.1 . . . . 2.1099999999999999 109.586 174.086 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -56.68 151.95 13.02 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.698 1.199 . . . . 2.98 111.3 165.106 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -46.95 -39.92 13.31 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.356 1.243 . . . . 3.4100000000000001 114.356 -175.831 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.58 -10.04 58.53 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.708 1.203 . . . . 4.1900000000000004 113.906 -179.544 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -73.1 -63.2 1.23 Allowed 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 106.633 -1.617 . . . . 2.04 106.633 155.599 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -49.04 -30.84 6.75 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 128.375 2.67 . . . . 3.29 115.74 -173.931 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.5 m -53.45 -30.54 41.15 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.597 -1.314 . . . . 2.8700000000000001 113.229 173.158 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.0 m -68.98 -27.01 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 CA-C-N 119.903 1.229 . . . . 3.6899999999999999 112.935 179.816 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -59.47 -55.09 39.06 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.11 0.964 . . . . 2.9199999999999999 109.968 173.416 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 52.3 mt -71.12 -25.91 62.79 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.015 -0.993 . . . . 3.1499999999999999 111.481 -179.599 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 41.5 m -64.48 -51.53 62.56 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.154 0.888 . . . . 2.1200000000000001 111.33 169.582 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 29.3 mtm -58.1 -45.57 87.02 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.455 1.025 . . . . 2.7999999999999998 111.909 179.121 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 72.6 mt -67.15 -38.18 85.08 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.905 -0.497 . . . . 2.1400000000000001 112.085 178.563 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 33.5 t -63.28 -31.6 72.8 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.248 0.619 . . . . 3.1200000000000001 112.387 172.541 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 71.1 mtp -68.39 -40.19 81.46 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 119.701 1.137 . . . . 2.52 112.324 167.448 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.15 -42.52 99.47 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.762 0.71 . . . . 1.6599999999999999 112.654 -179.112 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -60.69 -26.68 67.3 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.876 1.065 . . . . 4.3399999999999999 113.876 173.354 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -69.96 -37.7 75.88 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.466 1.03 . . . . 2.6400000000000001 112.796 176.402 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -73.04 -38.5 66.48 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.687 0.795 . . . . 3.2000000000000002 111.253 176.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -53.16 -51.47 61.9 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.131 1.372 . . . . 3.8300000000000001 110.959 172.198 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -55.54 -27.35 48.38 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.387 1.475 . . . . 3.5499999999999998 113.156 178.2 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 44.3 mt -84.03 -12.21 55.55 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.589 1.156 . . . . 2.5699999999999998 113.496 178.776 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 82.0 mm-40 -90.88 -38.34 12.99 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.266 1.026 . . . . 2.79 113.147 165.882 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 . . . . . 0 CA--C 1.544 0.721 0 C-N-CA 126.975 2.11 . . . . 3.4300000000000002 114.637 -178.245 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 64.2 p . . . . . 0 N--CA 1.475 0.808 0 N-CA-C 112.626 0.602 . . . . 3.1299999999999999 112.626 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -67.32 -21.25 47.82 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.899 2.4 . . . . 2.0099999999999998 112.855 172.404 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -63.49 -45.79 89.14 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-N 118.877 0.762 . . . . 3.5099999999999998 110.487 166.219 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . 0.43 ' CD ' ' HZ3' ' B' ' 7' ' ' LYS . 0.4 OUTLIER -61.51 -48.19 82.18 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 118.594 0.634 . . . . 3.7599999999999998 110.579 173.233 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . 0.44 ' HE3' ' HA ' ' B' ' 7' ' ' LYS . 0.0 OUTLIER -58.09 -25.17 60.98 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 120.576 -1.327 . . . . 4.9800000000000004 114.508 175.026 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.57 -41.69 99.09 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.498 0.59 . . . . 2.1800000000000002 110.924 176.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 29.2 mt -57.78 -48.62 79.15 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.251 1.02 . . . . 2.75 111.324 172.963 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.1 -48.27 79.03 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.919 0.888 . . . . 1.9299999999999999 111.018 177.622 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -72.54 -32.54 66.17 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.163 -0.922 . . . . 3.77 111.932 -177.817 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 7.6 mtp -64.42 -41.5 96.57 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.486 1.114 . . . . 3.6899999999999999 112.328 171.796 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.78 -36.89 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 119.629 1.104 . . . . 2.8700000000000001 111.422 169.328 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 88.7 m -63.77 -54.77 30.04 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 118.069 -0.967 . . . . 1.9099999999999999 110.89 -176.524 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.7 p -63.7 -44.64 93.09 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.056 0.942 . . . . 2.2200000000000002 110.03 176.949 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -65.17 -47.12 78.1 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.484 -0.486 . . . . 3.5699999999999998 110.886 -174.472 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -67.51 -44.81 77.53 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 120.796 -1.19 . . . . 2.5800000000000001 111.968 177.719 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -65.34 -20.81 66.56 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 120.78 -1.2 . . . . 5.4900000000000002 113.839 178.727 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -98.73 -1.18 41.18 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.625 0.972 . . . . 3.5499999999999998 113.625 164.814 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 41.8 m -87.26 -48.93 7.61 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 120.702 1.592 . . . . 2.2000000000000002 113.173 175.535 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.28 13.0 57.06 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.376 1.941 . . . . 1.78 112.693 174.478 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 8.8 ttm-85 -65.11 -59.33 4.23 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.033 1.333 . . . . 3.6099999999999999 109.507 169.451 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -156.35 -172.43 4.08 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 126.263 1.825 . . . . 3.6600000000000001 110.461 -169.506 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.59 -135.69 47.24 Favored Glycine 0 N--CA 1.472 1.092 0 O-C-N 120.962 -1.086 . . . . 3.2599999999999998 110.667 -178.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 6.6 t -82.19 158.89 23.41 Favored 'General case' 0 C--O 1.247 0.931 0 CA-C-O 123.329 1.538 . . . . 4.2699999999999996 111.2 154.723 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -84.52 155.75 22.0 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.993 1.317 . . . . 8.2599999999999998 110.33 170.899 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.5 tt 71.42 -21.59 0.21 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.516 1.927 . . . . 4.2599999999999998 112.868 -166.45 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.3 p -107.2 150.58 26.47 Favored 'General case' 0 C--O 1.253 1.237 0 C-N-CA 126.223 1.809 . . . . 1.8300000000000001 115.099 174.337 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -98.48 108.51 21.22 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 129.784 3.233 . . . . 3.3900000000000001 111.712 173.045 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 9.5 t -85.51 161.94 19.14 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.282 1.033 . . . . 2.8100000000000001 113.279 174.773 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 33.5 ttt85 -50.2 -19.53 0.8 Allowed 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 117.293 2.331 . . . . 4.4500000000000002 117.293 -174.964 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.21 -25.35 12.02 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.286 1.217 . . . . 5.0300000000000002 114.286 170.702 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -62.12 -51.91 66.0 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 108.362 -0.977 . . . . 2.0499999999999998 108.362 169.485 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 8.1 tp -60.31 -38.79 84.77 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 125.172 1.389 . . . . 2.9399999999999999 112.651 179.173 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -55.74 -41.75 74.37 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 122.098 -0.376 . . . . 3.96 110.851 175.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -65.34 -49.52 69.08 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 117.834 -1.079 . . . . 3.4100000000000001 113.293 169.631 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 tt -53.25 -48.9 67.85 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 120.155 1.343 . . . . 3.1800000000000002 111.671 -179.259 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 5.8 mt -65.35 -40.18 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 120.087 1.312 . . . . 2.1200000000000001 110.583 178.915 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -65.2 0.17 1.48 Allowed 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 114.572 1.323 . . . . 6.1900000000000004 114.572 171.566 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -119.78 -45.93 2.47 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.662 1.585 . . . . 4.21 112.971 177.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -72.72 -29.34 63.27 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-O 117.418 -1.277 . . . . 4.29 112.785 175.367 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -125.24 -81.7 0.63 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.909 1.684 . . . . 2.7400000000000002 110.469 -175.978 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.5 t 64.07 -44.24 0.27 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 129.01 2.924 . . . . 4.8899999999999997 115.745 -175.555 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 4.3 pp -61.92 -15.39 42.67 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 127.771 2.429 . . . . 4.1299999999999999 115.941 -167.707 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -79.92 13.17 26.32 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 124.346 0.974 . . . . 4.1399999999999997 114.148 171.757 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 61.43 56.07 2.69 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.205 2.202 . . . . 7.1799999999999997 111.811 -176.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.77 74.41 0.59 Allowed 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 115.624 1.712 . . . . 3.3100000000000001 115.624 -161.639 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -88.38 168.88 12.29 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 127.367 2.267 . . . . 6.2400000000000002 112.443 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -48.1 -53.61 15.96 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.789 1.236 . . . . 4.6200000000000001 113.146 -178.83 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 21.5 t -66.13 5.11 0.56 Allowed 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 115.652 1.723 . . . . 3.8999999999999999 115.652 -179.605 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 43.0 t -119.41 -40.63 2.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.17 1.388 . . . . 2.5099999999999998 111.765 166.732 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 26.0 mm -59.67 -33.93 53.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.612 1.565 . . . . 2.3700000000000001 112.507 174.307 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -70.67 -42.09 71.2 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.998 1.319 . . . . 4.1500000000000004 112.339 179.729 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -74.36 -42.23 59.69 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 124.362 1.065 . . . . 2.98 111.61 177.49 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 49.2 tp -58.73 -46.62 86.97 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.05 0.94 . . . . 3.3500000000000001 110.513 171.465 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 17.4 tpp -54.26 -49.18 70.13 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.059 0.943 . . . . 2.8999999999999999 110.773 174.334 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.65 -22.49 45.97 Favored 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 114.307 1.225 . . . . 5.0300000000000002 114.307 175.605 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.8 t -92.85 -28.25 16.64 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 120.744 -1.223 . . . . 3.0699999999999998 113.427 171.477 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.81 -42.44 27.75 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 127.924 2.49 . . . . 2.9300000000000002 112.724 -179.127 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -99.34 128.4 45.45 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 124.776 1.231 . . . . 1.9299999999999999 110.24 166.546 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -95.27 -11.34 28.09 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.741 -0.599 . . . . 4.4100000000000001 112.606 173.794 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -94.32 -32.98 13.38 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.515 1.302 . . . . 2.6200000000000001 114.515 -169.502 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 9.2 t 72.91 15.87 4.57 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.161 1.384 . . . . 3.7400000000000002 112.462 -156.048 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 53.9 p-10 -71.94 -18.45 62.01 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.382 1.073 . . . . 2.1000000000000001 109.802 169.741 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 61.08 21.23 11.64 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 128.98 2.912 . . . . 4.6500000000000004 111.853 -178.758 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -126.23 144.9 50.61 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 128.375 2.67 . . . . 2.1200000000000001 109.657 171.811 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 16.0 mt -128.3 130.26 69.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 125.791 1.637 . . . . 2.4700000000000002 109.428 -171.325 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.34 173.01 6.49 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.915 1.686 . . . . 2.9700000000000002 111.516 168.868 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -47.25 -40.77 17.26 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.235 1.414 . . . . 4.7800000000000002 114.811 176.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 24.2 mtmm -70.28 -43.93 69.42 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.526 -0.734 . . . . 4.1900000000000004 110.986 -176.651 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -61.34 -47.22 86.89 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.185 0.994 . . . . 2.2400000000000002 110.642 173.773 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -58.89 -22.0 58.59 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 128.499 2.719 . . . . 4.0599999999999996 113.647 177.448 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 9.4 t -53.31 -35.26 59.95 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 120.982 -1.074 . . . . 2.8799999999999999 111.714 168.491 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 65.0 t -66.14 -31.89 55.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 O-C-N 121.248 -0.907 . . . . 2.6299999999999999 112.15 -179.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -67.53 -56.98 7.34 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.431 1.092 . . . . 4.29 111.849 173.522 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 77.8 mt -55.43 -39.82 70.74 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.046 1.338 . . . . 2.8500000000000001 111.397 179.309 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 58.6 m -65.39 -52.19 55.16 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.141 1.376 . . . . 2.1000000000000001 111.815 176.538 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 16.7 ptp -65.63 -38.0 88.16 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.426 1.012 . . . . 3.6899999999999999 112.677 -177.412 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 92.3 mt -65.78 -47.01 76.58 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.269 0.628 . . . . 2.5 111.101 175.73 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 94.0 m -65.61 -32.58 74.23 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.462 -0.774 . . . . 2.8799999999999999 112.611 176.864 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 52.9 mtm -65.85 -37.04 85.12 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.923 1.238 . . . . 4.2699999999999996 112.715 172.238 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.28 -42.42 98.61 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.602 1.092 . . . . 2.0699999999999998 112.593 173.313 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -69.67 -32.9 71.8 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.533 0.938 . . . . 4.1399999999999997 113.533 172.682 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -58.8 -48.97 79.43 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.175 0.898 . . . . 3.7999999999999998 112.062 172.282 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -59.26 -48.66 80.79 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.163 1.385 . . . . 3.1800000000000002 111.44 177.78 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.09 -45.44 68.2 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.448 1.499 . . . . 3.5800000000000001 112.326 175.242 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -71.21 -28.18 64.03 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.31 1.444 . . . . 3.6299999999999999 112.861 -177.665 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 78.9 mt -77.74 -8.95 58.69 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.883 1.068 . . . . 2.7200000000000002 113.883 177.677 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -92.69 -3.38 54.96 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 119.298 0.954 . . . . 5.1200000000000001 113.333 167.564 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -99.7 -74.84 0.58 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.237 1.415 . . . . 4.96 110.203 166.926 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.32 -7.78 54.9 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 116.311 1.967 . . . . 6.5499999999999998 116.311 -167.159 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . 0.48 ' C ' ' HZ2' ' A' ' 26' ' ' LYS 0.26 4.0 tttp . . . . . 0 C--O 1.248 0.976 1 C-N-CA 131.827 4.051 . . . . 9.0399999999999991 116.897 -158.704 . . . . . . . . 3 2 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 . . . . . 0 CA--C 1.529 0.168 0 N-CA-C 107.711 -1.218 . . . . 3.3100000000000001 107.711 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 66.4 p -135.96 162.39 57.03 Favored Pre-proline 0 C--O 1.238 0.474 0 C-N-CA 124.96 1.304 . . . . 2.3399999999999999 109.846 160.914 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -64.31 -22.78 66.22 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 121.826 1.684 . . . . 1.53 112.091 166.551 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -69.68 -52.01 29.55 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.532 1.133 . . . . 4.4500000000000002 111.649 177.071 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -52.28 -44.22 64.86 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.563 1.145 . . . . 4.0599999999999996 111.041 175.196 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.486 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -77.35 -34.35 55.18 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 115.317 1.599 . . . . 6.79 115.317 -178.936 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.39 -42.17 77.47 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 123.441 0.697 . . . . 2.1899999999999999 112.001 165.039 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 74.0 mt -70.39 -34.19 72.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.264 0.938 . . . . 2.7999999999999998 112.37 173.911 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 5.1 m -60.56 -46.51 89.94 Favored 'General case' 0 N--CA 1.479 0.981 0 O-C-N 121.063 -1.023 . . . . 2.5600000000000001 110.937 167.463 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.5 m -57.86 -41.36 82.28 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.868 1.667 . . . . 2.9900000000000002 111.221 -179.003 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 19.0 tpp -52.93 -56.78 13.41 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 117.953 -1.023 . . . . 4.4100000000000001 111.852 168.702 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -62.35 -32.8 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 CA-C-N 120.983 1.719 . . . . 3.3300000000000001 113.106 -176.425 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.4 m -60.83 -58.93 6.39 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.631 1.172 . . . . 2.1600000000000001 111.069 173.787 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 t -73.54 -30.03 62.82 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 117.332 -1.318 . . . . 3.5699999999999998 110.399 -171.141 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -53.82 -53.03 58.16 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 125.677 1.591 . . . . 3.9399999999999999 110.01 170.708 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -59.15 -29.04 67.13 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.123 1.157 . . . . 2.7200000000000002 114.123 175.141 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.9 tttp -64.67 -31.72 73.07 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 120.724 -1.235 . . . . 4.9900000000000002 112.57 176.258 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -94.84 -38.7 10.62 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.729 1.212 . . . . 3.3700000000000001 112.778 177.452 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.3 p -70.05 -25.97 63.8 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.109 1.322 . . . . 2.4500000000000002 113.343 174.304 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.24 40.74 2.94 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 126.807 2.146 . . . . 2.4100000000000001 113.871 171.729 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -96.27 -26.34 15.44 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 118.941 1.371 . . . . 5.7699999999999996 112.349 166.059 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.02 153.38 42.16 Favored 'General case' 0 C--O 1.245 0.856 0 C-N-CA 128.722 2.809 . . . . 5.4400000000000004 110.24 177.984 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 46.46 -108.52 0.27 Allowed Glycine 0 C--N 1.345 1.038 0 C-N-CA 127.255 2.36 . . . . 3.8300000000000001 114.996 147.396 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 m -59.9 102.82 0.17 Allowed 'General case' 0 C--O 1.241 0.635 0 N-CA-C 108.77 -0.826 . . . . 3.02 108.77 166.669 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.7 -15.47 56.41 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.04 0.755 . . . . 5.54 113.04 -176.381 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 10.7 mp -83.96 -49.23 9.17 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 126.012 1.725 . . . . 5.5 110.986 177.098 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.4 p -111.31 170.36 8.17 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.939 2.096 . . . . 3.04 113.331 -168.748 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 46.7 mt -116.55 103.73 10.7 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.456 1.502 . . . . 2.5600000000000001 113.04 -162.796 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.94 172.47 10.87 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 121.18 -0.95 . . . . 2.6899999999999999 112.114 165.804 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.53 -48.64 2.86 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.593 1.957 . . . . 4.9000000000000004 114.594 -177.667 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.485 ' HZ2' ' CD ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -69.91 -41.53 74.55 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.657 -0.652 . . . . 7.4199999999999999 112.239 -178.616 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 87.8 mt-10 -67.55 -44.38 78.41 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.369 -0.604 . . . . 1.96 109.369 -178.06 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.83 -52.31 66.0 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.728 1.211 . . . . 3.25 112.156 177.264 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 15.5 ptmt -63.75 -25.81 68.36 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 120.288 1.404 . . . . 4.3600000000000003 114.217 -176.204 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.485 ' CD ' ' HZ2' ' A' ' 32' ' ' LYS . 4.6 tt0 -81.84 -50.94 8.63 Favored 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 124.927 1.291 . . . . 3.27 110.634 -177.726 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.1 tt -46.68 -55.22 8.09 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 125.407 1.483 . . . . 2.98 110.209 177.245 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.0 mt -51.59 -55.55 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 118.701 0.682 . . . . 2.25 110.689 -178.903 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -68.8 -23.45 64.29 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.984 0.735 . . . . 4.9500000000000002 112.984 -172.768 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.78 -14.99 22.85 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 126.81 2.044 . . . . 6.75 113.258 -179.22 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -79.42 -54.82 5.55 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.977 1.311 . . . . 4.4800000000000004 109.487 161.374 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.0 mt -119.3 91.31 3.52 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.85 1.66 . . . . 3.8999999999999999 110.729 -179.167 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 4.6 t -84.74 71.18 10.86 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.282 -0.886 . . . . 3.7000000000000002 109.756 168.121 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 pp -171.41 -179.39 2.59 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 128.067 2.547 . . . . 4.5099999999999998 110.112 -172.222 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 65.12 13.4 57.59 Favored Glycine 0 N--CA 1.477 1.404 0 O-C-N 121.707 -0.621 . . . . 5.8899999999999997 112.339 -173.796 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 44.5 53.03 7.27 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 129.568 3.147 . . . . 6.0499999999999998 109.878 178.934 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.1 tpp -67.36 80.69 0.15 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.344 1.858 . . . . 2.4100000000000001 113.962 -157.425 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -74.11 129.67 38.29 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.956 2.503 . . . . 6.1900000000000004 109.467 178.602 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -64.87 -10.29 27.46 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 116.348 1.981 . . . . 4.5199999999999996 116.348 -159.757 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.8 t -60.21 -28.81 68.29 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.245 -1.535 . . . . 4.4500000000000002 113.555 166.329 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.0 p -90.53 1.12 57.01 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.929 1.241 . . . . 3.8399999999999999 113.194 172.251 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 19.8 mm -82.18 -40.45 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 119.121 0.873 . . . . 3.4900000000000002 110.924 167.534 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -67.73 -52.47 37.26 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 118.649 0.658 . . . . 4.9699999999999998 112.751 -171.024 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -72.69 -26.47 61.63 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.929 -0.482 . . . . 3.2200000000000002 112.025 -179.173 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.32 -51.27 70.22 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 117.669 -1.158 . . . . 3.6000000000000001 109.551 165.771 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ttt -52.76 -46.26 67.42 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 119.932 1.242 . . . . 2.5600000000000001 111.838 174.132 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -68.69 -26.24 65.19 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 120.952 1.705 . . . . 4.2699999999999996 113.442 177.651 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.1 t -71.69 -28.68 63.87 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 120.953 -1.092 . . . . 3.1899999999999999 111.741 172.239 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 11.8 mt -72.88 -58.82 3.05 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.915 -1.115 . . . . 2.7000000000000002 109.855 165.559 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -84.25 61.3 6.46 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.542 1.937 . . . . 1.5600000000000001 111.665 -177.253 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.0 mttp -52.01 -20.7 2.55 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 127.561 2.344 . . . . 4.0599999999999996 114.472 -171.253 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 35.1 p-10 -111.27 -0.85 16.28 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 129.074 2.95 . . . . 3.2200000000000002 114.125 -175.499 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.6 t 67.42 30.59 6.81 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.775 1.23 . . . . 2.9399999999999999 114.268 168.134 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -90.17 -9.13 49.32 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.42 1.488 . . . . 2.7400000000000002 112.826 -176.408 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.28 -9.64 1.43 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 129.69 3.196 . . . . 5.0700000000000003 116.9 178.088 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -106.51 142.0 36.89 Favored 'General case' 0 C--O 1.247 0.971 0 C-N-CA 125.701 1.6 . . . . 2.8300000000000001 112.205 173.738 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.5 mt -120.37 101.06 10.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-O 122.854 1.312 . . . . 3.02 111.867 -167.852 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.44 ' OD1' ' HE3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -74.27 158.45 34.04 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 129.053 2.941 . . . . 3.27 111.998 171.527 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.79 -25.8 67.41 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 120.636 -1.29 . . . . 3.6800000000000002 114.09 -174.425 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.44 ' HE3' ' OD1' ' A' ' 68' ' ' ASP . 2.5 mtmt -81.55 -33.47 31.68 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 120.548 1.522 . . . . 4.3499999999999996 111.872 173.535 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -54.94 -53.59 53.67 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.027 0.831 . . . . 2.1699999999999999 109.003 165.27 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -66.01 -33.73 76.47 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 127.196 2.199 . . . . 3.25 114.751 -175.943 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.33 -21.37 61.98 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 120.443 -1.411 . . . . 2.6000000000000001 113.304 -175.348 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 p -60.13 -26.98 38.03 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 O-C-N 121.315 -0.865 . . . . 3.4900000000000002 112.477 171.697 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -68.0 -51.59 45.41 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 126.679 1.992 . . . . 3.8700000000000001 111.361 178.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.75 -46.85 67.65 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.178 0.991 . . . . 3.3999999999999999 109.841 169.786 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 20.6 m -61.42 -55.53 30.33 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.974 0.909 . . . . 1.8200000000000001 111.238 -176.675 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 21.1 ptm -66.53 -36.33 82.43 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.814 0.672 . . . . 3.3700000000000001 112.814 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.4 mt -66.54 -41.56 88.51 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.177 -0.916 . . . . 2.2599999999999998 111.43 173.437 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.5 m -64.25 -36.73 85.05 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 120.051 1.296 . . . . 2.71 112.731 175.57 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 38.1 mmm -61.17 -44.82 96.71 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.054 0.542 . . . . 2.5499999999999998 111.202 174.063 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.27 -38.5 81.8 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.772 0.829 . . . . 1.77 112.236 -178.608 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -65.93 -27.46 68.2 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.319 0.859 . . . . 3.75 113.319 175.036 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.14 -36.66 74.93 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 119.254 0.934 . . . . 3.3500000000000001 112.15 173.809 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -67.14 -43.58 82.0 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.885 0.874 . . . . 3.4500000000000002 110.847 175.926 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -52.6 -44.73 66.18 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.719 1.608 . . . . 4.3799999999999999 112.358 173.361 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -62.61 -27.23 69.06 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.069 1.748 . . . . 3.9399999999999999 112.541 178.892 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 45.3 mt -83.07 -18.6 39.06 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.403 1.081 . . . . 3.0899999999999999 112.84 177.156 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -90.26 -10.32 44.68 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.718 1.377 . . . . 3.2200000000000002 114.718 171.854 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 18.1 t70 . . . . . 0 N--CA 1.468 0.471 0 C-N-CA 126.034 1.734 . . . . 3.0600000000000001 112.591 169.011 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 9.6 t . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 112.256 0.465 . . . . 4.2599999999999998 112.256 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -66.95 -9.11 23.74 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.181 1.921 . . . . 2.6600000000000001 113.081 172.691 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.56 -37.7 77.11 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 117.098 -1.43 . . . . 3.7400000000000002 112.6 176.931 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 13.4 tm-20 -54.34 -42.04 69.78 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 121.427 1.921 . . . . 5.0 110.137 179.118 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 38.5 mtmt -55.05 -23.72 21.4 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.603 0.964 . . . . 8.5099999999999998 113.603 175.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.82 -49.03 61.87 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 120.731 -1.231 . . . . 1.79 111.007 176.274 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -57.42 -48.91 77.88 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 119.393 0.997 . . . . 4.3499999999999996 109.886 178.858 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 13.9 p -64.15 -44.22 92.79 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.394 1.078 . . . . 3.1499999999999999 112.684 177.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 26.9 m -70.2 -32.16 69.94 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.64 1.109 . . . . 2.79 110.813 178.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -70.78 -50.26 37.7 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.12 0.968 . . . . 4.4800000000000004 111.045 176.682 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 6.3 p -59.83 -27.3 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-N 120.509 1.504 . . . . 3.29 112.104 175.122 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 60.7 m -64.81 -57.8 7.93 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 116.921 -1.514 . . . . 1.76 111.593 175.159 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.9 p -61.61 -41.48 97.53 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.147 1.34 . . . . 2.25 109.07 175.317 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -64.45 -49.56 70.95 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 120.515 -0.474 . . . . 3.3100000000000001 111.604 -170.369 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 12.0 t60 -69.23 -44.69 71.5 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.774 -0.579 . . . . 2.7999999999999998 111.225 178.532 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -66.78 -39.47 87.83 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.015 -1.053 . . . . 5.0199999999999996 112.91 -175.289 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -80.18 -27.31 38.96 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.62 0.768 . . . . 3.5 112.424 173.016 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 57.0 m -68.91 -22.92 64.13 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.169 1.349 . . . . 2.7000000000000002 112.716 168.292 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.08 11.33 72.48 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 125.656 1.598 . . . . 1.77 115.45 178.127 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . 0.481 HH11 ' HG3' ' B' ' 22' ' ' ARG . 7.9 mmt85 -80.77 -23.38 39.38 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.196 1.398 . . . . 5.3799999999999999 114.181 177.994 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -164.01 149.64 10.86 Favored 'General case' 0 C--O 1.25 1.088 0 C-N-CA 126.481 1.913 . . . . 3.2999999999999998 108.738 -171.215 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.78 -142.32 16.6 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-O 121.702 0.612 . . . . 2.7599999999999998 111.855 -174.301 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 58.9 m -75.17 151.51 38.51 Favored 'General case' 0 C--O 1.242 0.661 0 O-C-N 121.331 -1.099 . . . . 4.6399999999999997 112.55 178.714 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -71.84 56.55 0.3 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.759 2.024 . . . . 6.5700000000000003 111.915 167.038 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 59.5 tp -160.2 -42.81 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.116 1.366 . . . . 4.8700000000000001 110.0 -170.556 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.4 p -101.45 140.25 35.99 Favored 'General case' 0 C--O 1.251 1.15 0 C-N-CA 125.066 1.346 . . . . 2.79 110.297 173.842 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . 0.263 1.8 pt? -98.58 94.72 6.83 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 122.334 1.064 . . . . 4.3600000000000003 109.493 158.042 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 5.6 m -65.33 165.24 12.07 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 126.729 2.012 . . . . 3.7000000000000002 112.532 -176.004 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . 0.507 HH22 ' CG ' ' B' ' 53' ' ' ASP . 0.9 OUTLIER -30.07 -39.07 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 128.394 2.678 . . . . 6.25 117.14 -178.191 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.4 -37.9 11.22 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.793 1.405 . . . . 4.9699999999999998 114.793 174.115 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -53.44 -41.54 66.2 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.71 1.204 . . . . 2.0699999999999998 109.579 174.305 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 24.7 tp -71.41 -40.89 70.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.108 0.963 . . . . 2.7200000000000002 113.473 179.7 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 24.1 ttmt -62.84 -45.09 94.21 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 120.837 -1.165 . . . . 3.9199999999999999 111.949 176.003 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.408 ' CD ' ' HZ3' ' B' ' 40' ' ' LYS . 14.4 tp10 -52.81 -56.83 12.86 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.378 1.471 . . . . 3.2200000000000002 111.993 167.006 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -60.05 -47.82 84.28 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.707 1.603 . . . . 4.04 112.846 -174.71 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.8 mt -59.24 -48.27 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 CA-C-N 120.254 1.388 . . . . 1.8600000000000001 109.547 175.485 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -62.53 -22.86 66.62 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.107 0.78 . . . . 4.8799999999999999 113.107 -179.489 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . 0.408 ' HZ3' ' CD ' ' B' ' 36' ' ' GLU . 39.9 mmtm -82.06 -53.62 5.96 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 117.353 -1.308 . . . . 4.4900000000000002 113.383 168.806 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -67.45 -35.97 80.27 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.632 1.173 . . . . 4.2300000000000004 112.527 -172.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -92.03 -73.89 0.53 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.924 1.29 . . . . 3.1600000000000001 110.263 174.178 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 11.9 t 66.13 -40.76 0.35 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 127.908 2.483 . . . . 4.1399999999999997 113.616 -168.858 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 pp -62.5 174.31 1.02 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 128.063 2.545 . . . . 4.3200000000000003 113.787 172.087 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.04 -142.04 23.88 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 115.456 -0.793 . . . . 4.2199999999999998 111.836 167.131 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -119.32 57.47 0.89 Allowed 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 122.399 1.095 . . . . 5.1900000000000004 109.564 178.206 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.76 47.53 1.4 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 124.234 1.969 . . . . 2.7599999999999998 113.401 -175.059 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 37.5 mttp -81.42 152.56 27.35 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.121 2.168 . . . . 4.8899999999999997 112.169 172.192 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -47.44 -54.04 12.45 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.49 1.293 . . . . 3.3399999999999999 114.49 -163.155 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 9.0 t -61.25 -23.7 65.84 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 120.184 1.356 . . . . 3.6499999999999999 113.945 -176.292 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 9.8 t -86.71 -9.37 56.08 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.978 0.808 . . . . 2.75 112.94 174.95 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 22.3 mt -97.52 -40.05 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 125.9 1.68 . . . . 2.1699999999999999 110.833 172.32 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.507 ' CG ' HH22 ' B' ' 31' ' ' ARG . 0.9 OUTLIER -67.52 -39.2 85.08 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 126.076 1.75 . . . . 4.0099999999999998 110.08 176.567 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -69.8 -44.92 69.07 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 118.559 0.618 . . . . 2.96 112.337 166.102 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 7.4 tt -57.85 -44.37 86.48 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.466 1.03 . . . . 3.2999999999999998 111.186 -177.893 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.9 ppp? -67.06 -38.8 86.43 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.453 1.024 . . . . 2.6200000000000001 111.959 176.972 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 1.4 tmpt? -62.74 -23.39 67.16 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.905 1.282 . . . . 4.6900000000000004 112.812 169.317 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 22.1 m -92.31 -22.45 19.72 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.639 1.576 . . . . 3.1000000000000001 112.95 178.218 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 19.2 mt -67.09 -47.67 70.51 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 118.643 0.656 . . . . 2.9700000000000002 109.731 163.403 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -78.08 141.66 38.66 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.949 1.3 . . . . 2.5899999999999999 113.832 -173.266 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -115.5 3.31 14.04 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.018 1.327 . . . . 4.2699999999999996 112.2 178.523 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -117.37 -28.94 5.99 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.612 1.565 . . . . 2.7799999999999998 112.933 -162.378 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 46.0 m 67.83 29.37 6.74 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 129.227 3.011 . . . . 3.73 112.52 -161.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 37.2 p30 -85.31 -14.32 46.88 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 120.695 -1.253 . . . . 2.4700000000000002 112.383 -170.92 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 58.99 4.63 0.43 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 129.901 3.28 . . . . 5.0800000000000001 115.236 -168.2 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -105.22 122.34 45.73 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 127.472 2.309 . . . . 2.8399999999999999 110.589 176.535 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 32.1 mm -101.87 107.03 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 114.646 -1.161 . . . . 2.7200000000000002 109.823 175.391 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.48 158.29 32.22 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.829 2.051 . . . . 4.1900000000000004 112.516 173.243 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -50.39 -25.57 4.03 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.278 1.431 . . . . 4.5499999999999998 113.219 163.114 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm -91.72 -16.96 26.15 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 115.623 1.712 . . . . 6.2199999999999998 115.623 176.283 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -89.89 -44.18 10.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.586 1.154 . . . . 1.8899999999999999 109.725 172.703 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -54.42 -22.12 11.64 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.518 1.927 . . . . 2.8399999999999999 114.297 179.17 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 41.0 p -55.76 -29.57 59.82 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 119.869 -1.769 . . . . 3.0899999999999999 113.068 168.393 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 88.2 t -61.12 -34.83 61.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 CA-C-N 119.412 1.005 . . . . 2.5499999999999998 111.034 173.497 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -66.56 -54.63 21.52 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.038 0.835 . . . . 3.9900000000000002 110.968 177.476 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 76.2 mt -56.86 -36.33 69.92 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.329 0.652 . . . . 2.23 112.269 177.463 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 60.8 m -61.63 -46.63 88.99 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.185 0.994 . . . . 2.2400000000000002 111.072 177.087 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.2 mtm -61.26 -43.53 98.72 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 118.845 0.748 . . . . 2.73 112.252 178.32 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -57.6 -54.59 45.16 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 118.714 0.688 . . . . 3.6800000000000002 110.883 173.733 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 89.7 m -66.85 -30.43 70.61 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.298 1.221 . . . . 2.5800000000000001 114.298 -176.676 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 81' ' ' MET . . . . . 0.418 ' SD ' ' HE2' ' A' ' 70' ' ' LYS . 14.3 mtp -75.09 -33.56 61.65 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.777 1.171 . . . . 3.04 112.562 171.514 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.21 -50.21 66.73 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 119.333 0.97 . . . . 2.1299999999999999 111.376 172.158 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -60.67 -24.45 65.6 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.403 0.89 . . . . 4.4500000000000002 113.403 175.917 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -66.64 -46.92 74.23 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 117.955 -1.022 . . . . 3.7799999999999998 112.484 170.394 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -65.14 -30.16 71.07 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 120.429 1.468 . . . . 3.2799999999999998 112.108 177.626 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.94 -46.64 83.82 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 127.407 2.283 . . . . 4.6100000000000003 111.953 175.15 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -81.13 4.24 20.71 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 119.704 -1.873 . . . . 3.4900000000000002 113.253 171.092 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 81.8 mt -109.57 -0.9 18.51 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 114.376 1.25 . . . . 2.46 114.376 165.696 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . 0.461 ' HB3' ' HZ2' ' B' ' 92' ' ' LYS . 21.4 pt-20 -97.23 -27.3 14.59 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.59 1.541 . . . . 5.6200000000000001 113.601 170.869 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -46.33 -42.51 14.87 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.519 1.128 . . . . 5.9299999999999997 111.273 149.015 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -85.14 -0.95 56.21 Favored 'General case' 0 CA--C 1.559 1.306 0 N-CA-C 116.258 1.947 . . . . 5.3300000000000001 116.258 177.303 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . 0.461 ' HZ2' ' HB3' ' B' ' 89' ' ' GLU . 19.0 mttp . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 116.279 -1.82 . . . . 6.8700000000000001 115.468 -172.301 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.3 mp0 . . . . . 0 C--O 1.235 0.301 0 N-CA-C 108.758 -0.83 . . . . 4.04 108.758 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -55.24 157.05 6.85 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 127.583 2.353 . . . . 2.54 112.852 172.454 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -65.21 -28.96 55.75 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.41 2.073 . . . . 2.2799999999999998 113.5 -168.174 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 27.9 tp -66.57 -47.79 71.67 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 120.042 1.292 . . . . 4.9500000000000002 110.974 174.321 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -60.15 -34.13 73.14 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.794 -0.566 . . . . 4.9400000000000004 110.819 174.192 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.487 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 5.4 mmpt? -72.84 -33.16 65.98 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 120.152 -1.592 . . . . 5.4100000000000001 113.988 173.478 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.64 -45.73 85.54 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 118.808 0.731 . . . . 2.4399999999999999 110.729 170.432 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 55.8 mt -67.02 -35.19 79.38 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.945 -1.097 . . . . 2.9300000000000002 112.872 174.328 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 84.8 m -55.54 -46.75 77.05 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.479 1.112 . . . . 2.7799999999999998 110.709 169.165 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 81.6 m -57.24 -48.53 78.6 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.746 0.818 . . . . 2.3700000000000001 109.678 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.1 tpp -51.3 -55.66 17.11 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.09 0.956 . . . . 4.1699999999999999 113.563 179.554 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.76 -29.15 46.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 123.689 0.795 . . . . 3.7200000000000002 112.489 -177.599 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.5 m -72.75 -46.28 54.3 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.184 1.394 . . . . 2.1800000000000002 110.578 -179.372 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.44 -37.27 77.7 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 118.634 -0.698 . . . . 2.9399999999999999 111.084 165.371 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -66.81 -60.19 2.88 Favored 'General case' 0 C--O 1.222 -0.343 0 O-C-N 123.532 0.52 . . . . 3.1200000000000001 110.845 -170.116 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.9 m170 -72.12 -1.94 16.76 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.892 1.441 . . . . 2.8199999999999998 114.892 -178.322 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -88.56 -62.58 1.46 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.413 1.085 . . . . 5.0999999999999996 112.535 164.957 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -72.64 -39.3 67.31 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.795 1.18 . . . . 3.8700000000000001 113.261 -179.215 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.0 t -62.29 -22.74 66.26 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.498 -0.751 . . . . 2.5899999999999999 111.818 -176.035 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -157.03 106.8 0.3 Allowed Glycine 0 C--N 1.343 0.924 0 N-CA-C 116.181 1.232 . . . . 2.71 116.181 164.479 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -79.86 -13.55 59.31 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 114.736 -0.732 . . . . 6.0 111.777 132.307 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -165.14 -167.94 1.3 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.0 2.12 . . . . 4.2199999999999998 109.022 -161.879 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 39.2 53.94 2.62 Favored Glycine 0 N--CA 1.474 1.184 0 C-N-CA 125.936 1.732 . . . . 3.4300000000000002 113.84 160.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.2 t 56.11 138.55 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.686 1.994 . . . . 3.29 114.186 -167.424 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.0 mmmt -70.32 -18.61 63.1 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 120.864 -1.147 . . . . 6.5199999999999996 113.983 172.751 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.5 mt -102.16 -6.61 23.04 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.518 1.127 . . . . 4.5800000000000001 113.076 -171.338 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.2 p -136.98 139.45 41.47 Favored 'General case' 0 C--O 1.247 0.962 0 C-N-CA 126.231 1.812 . . . . 1.8799999999999999 109.771 -174.478 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -94.61 103.31 15.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.064 0.946 . . . . 2.9300000000000002 110.136 170.408 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -74.15 161.31 30.12 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 119.973 -1.704 . . . . 2.9700000000000002 111.113 165.7 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -39.57 -46.77 1.82 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.285 1.834 . . . . 5.0 114.481 -167.605 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.422 ' HD3' ' H ' ' A' ' 32' ' ' LYS . 0.6 OUTLIER -69.36 -42.27 75.46 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.927 1.084 . . . . 5.0499999999999998 113.927 -179.108 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -60.56 -48.7 80.6 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.846 1.658 . . . . 1.5900000000000001 108.641 176.426 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.1 tp -61.4 -43.39 98.95 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.654 0.782 . . . . 3.1099999999999999 111.502 178.253 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.457 ' HZ1' ' CG ' ' A' ' 53' ' ' ASP . 24.7 ttmm -66.48 -37.91 86.15 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 118.363 -0.827 . . . . 4.4299999999999997 112.732 -173.049 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -56.86 -54.44 46.46 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 117.792 -1.099 . . . . 3.9100000000000001 112.543 166.376 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.6 tt -53.42 -60.81 2.82 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.907 0.883 . . . . 3.1299999999999999 110.514 -179.214 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.9 mt -56.96 -51.65 65.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 N-CA-C 108.831 -0.803 . . . . 1.73 108.831 -175.801 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -61.96 -35.79 79.5 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.172 0.896 . . . . 4.7599999999999998 113.115 -175.328 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 60.8 mttm -66.28 -34.87 78.97 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.503 1.047 . . . . 3.6699999999999999 112.956 172.116 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -72.47 -51.61 19.42 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.454 1.102 . . . . 4.6600000000000001 111.793 179.521 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -82.12 25.82 0.56 Allowed 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 126.45 1.9 . . . . 3.7599999999999998 113.025 -176.453 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.0 m -60.87 6.6 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 126.544 1.938 . . . . 3.77 115.766 177.866 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.0 mp -60.67 -21.51 62.9 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.417 1.887 . . . . 4.2699999999999996 112.8 162.333 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 119.26 14.87 5.75 Favored Glycine 0 N--CA 1.473 1.163 0 C-N-CA 126.335 1.921 . . . . 3.5899999999999999 114.552 175.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -88.06 -174.28 4.61 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.291 0.848 . . . . 5.75 113.291 -174.069 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 77.07 -8.05 1.75 Allowed 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.994 1.85 . . . . 3.1000000000000001 115.994 154.575 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.2 mptt -8.82 114.51 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 130.075 3.35 . . . . 6.79 114.92 178.405 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -9.91 -56.12 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 130.656 3.582 . . . . 4.4500000000000002 119.891 -149.007 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.1 t -77.57 -17.35 57.95 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.855 1.057 . . . . 3.0699999999999998 113.855 -178.036 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.9 t -75.41 -10.65 59.64 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.0 1.273 . . . . 2.8999999999999999 112.08 173.554 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 70.3 mt -73.98 -27.41 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.693 1.197 . . . . 2.1600000000000001 111.483 161.095 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.457 ' CG ' ' HZ1' ' A' ' 35' ' ' LYS . 69.8 m-20 -91.98 -30.29 16.17 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.672 0.789 . . . . 3.6800000000000002 112.339 -174.384 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -68.44 -37.82 80.59 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.436 -0.79 . . . . 2.29 111.507 161.739 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 58.8 tp -57.49 -46.72 83.41 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 116.747 -1.596 . . . . 2.8900000000000001 110.574 168.706 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.8 mtp -51.35 -48.5 62.45 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 121.239 1.836 . . . . 2.8799999999999999 112.248 173.596 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.68 -21.26 62.64 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.413 1.485 . . . . 4.7199999999999998 113.005 175.975 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -82.22 -39.14 23.51 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 120.51 -1.369 . . . . 2.4700000000000002 113.476 167.326 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 84.4 mt -83.77 -37.43 22.63 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.4 1.48 . . . . 3.0299999999999998 114.771 -172.808 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.435 ' C ' ' HE2' ' A' ' 61' ' ' LYS . 7.2 t70 -79.1 129.04 34.03 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.605 0.717 . . . . 2.54 110.419 177.568 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.435 ' HE2' ' C ' ' A' ' 60' ' ' ASP . 0.8 OUTLIER -101.69 -17.52 16.26 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.6 0.76 . . . . 4.3099999999999996 112.741 178.125 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.7 m120 -95.27 -26.03 16.1 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 115.097 1.518 . . . . 3.25 115.097 -170.745 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.6 m 61.61 36.42 16.73 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.735 1.614 . . . . 3.1299999999999999 111.48 -163.334 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 48.4 p30 -92.34 -11.93 33.73 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 127.134 2.174 . . . . 2.4100000000000001 111.828 178.039 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 65.4 18.46 11.33 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 128.758 2.823 . . . . 5.8700000000000001 113.053 -177.153 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -139.18 139.43 37.55 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 122.703 1.239 . . . . 3.2999999999999998 112.377 170.26 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 1.9 mt -98.19 97.82 6.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 124.074 0.95 . . . . 2.9900000000000002 109.644 -171.531 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -47.64 143.56 3.74 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 127.814 2.445 . . . . 2.3900000000000001 110.665 162.393 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -47.08 -36.99 8.88 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 122.196 0.998 . . . . 4.0800000000000001 112.337 172.619 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -69.79 -29.59 66.93 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.088 1.755 . . . . 3.75 114.346 175.965 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -74.13 -54.73 7.19 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 108.324 -0.991 . . . . 1.8999999999999999 108.324 166.418 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -53.99 -25.61 21.86 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 127.063 2.145 . . . . 3.1600000000000001 114.627 -178.552 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.3 t -62.07 -31.9 72.38 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.767 -1.208 . . . . 2.46 111.714 173.027 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 p -74.61 -23.83 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-N 119.635 1.107 . . . . 3.3300000000000001 112.123 -177.483 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -63.65 -50.74 68.08 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.131 0.972 . . . . 3.5099999999999998 110.115 169.466 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 44.7 mt -59.38 -41.47 89.44 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.394 1.078 . . . . 2.73 111.161 177.24 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 88.0 m -58.96 -52.51 65.47 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.314 1.046 . . . . 2.0499999999999998 111.72 171.726 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 36.1 mtp -56.53 -45.94 80.88 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.839 0.855 . . . . 2.46 112.281 179.275 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 92.7 mt -62.63 -47.07 85.34 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 123.338 0.655 . . . . 2.4199999999999999 111.488 177.179 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 79.1 m -64.45 -34.88 79.22 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.543 0.942 . . . . 3.2799999999999998 113.543 178.564 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.5 mmm -65.67 -42.51 91.24 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 118.009 0.368 . . . . 3.5 111.065 174.598 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.24 -35.8 78.48 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.761 -0.638 . . . . 2.1800000000000002 112.308 179.769 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -76.98 -30.23 55.86 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.187 1.18 . . . . 3.6299999999999999 114.187 177.683 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -58.55 -49.44 77.42 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.987 0.812 . . . . 2.7999999999999998 110.926 167.936 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.44 -33.13 75.02 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.107 1.363 . . . . 4.5999999999999996 111.84 178.292 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -59.98 -45.51 92.47 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.86 1.264 . . . . 3.4500000000000002 112.625 174.468 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -63.26 -34.13 77.0 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.867 1.267 . . . . 3.96 111.922 177.058 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 71.2 mt -74.68 -7.84 54.51 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.222 1.409 . . . . 2.6299999999999999 113.477 178.166 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -101.38 -1.09 34.22 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.217 1.407 . . . . 3.5699999999999998 114.139 170.518 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.8 t70 . . . . . 0 CA--C 1.543 0.709 0 C-N-CA 125.844 1.658 . . . . 3.5699999999999998 111.977 179.13 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 3' ' ' THR . . . . . 0.538 HG22 ' H ' ' B' ' 6' ' ' GLU . 4.7 t . . . . . 0 C--O 1.236 0.362 0 N-CA-C 108.01 -1.107 . . . . 3.73 108.01 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -63.74 -16.68 56.18 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 121.726 1.618 . . . . 1.9099999999999999 112.22 167.58 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 24.8 tp -68.38 -50.65 51.48 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.64 1.109 . . . . 3.8799999999999999 112.204 -177.111 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . 0.538 ' H ' HG22 ' B' ' 3' ' ' THR . 2.6 tm-20 -47.95 -54.58 12.33 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.055 1.342 . . . . 4.0300000000000002 110.63 167.303 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -70.34 -26.33 63.7 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.496 -0.752 . . . . 5.7800000000000002 112.278 -171.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.61 -38.93 74.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.894 1.278 . . . . 2.1600000000000001 111.933 170.623 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.93 -44.24 81.18 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.897 1.226 . . . . 3.0 110.388 171.906 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 59.1 m -55.6 -43.46 76.05 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.616 1.566 . . . . 2.0 111.991 172.232 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.15 -32.12 58.93 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 121.036 -1.04 . . . . 2.9700000000000002 113.17 175.949 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -55.98 -49.07 74.62 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.959 1.254 . . . . 4.0499999999999998 110.218 167.755 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 29.9 t -59.21 -30.6 44.26 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 C-N-CA 124.938 1.295 . . . . 3.21 112.906 172.152 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 29.8 m -71.39 -45.49 62.66 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 120.881 -1.137 . . . . 1.98 111.785 175.483 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.22 -32.29 64.29 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.923 0.783 . . . . 2.3700000000000001 110.248 167.604 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -64.06 -58.24 7.25 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 118.473 -0.775 . . . . 3.27 110.563 179.632 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 47.2 m-70 -57.23 -43.94 83.35 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 120.589 1.54 . . . . 5.3300000000000001 112.184 178.494 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -56.71 -36.8 70.08 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.086 1.354 . . . . 6.1699999999999999 113.961 -177.794 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -108.87 -34.11 6.75 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.725 1.009 . . . . 3.6600000000000001 113.725 -179.308 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -67.96 -27.5 66.65 Favored 'General case' 0 C--O 1.249 1.067 0 C-N-CA 125.251 1.42 . . . . 2.4100000000000001 111.774 175.463 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.81 4.51 60.8 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 128.119 2.771 . . . . 1.8100000000000001 115.222 177.551 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 17.9 mtp180 -78.83 -113.1 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.117 1.459 . . . . 5.1799999999999997 110.575 172.496 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.51 -178.16 1.7 Allowed 'General case' 0 C--O 1.248 0.979 0 C-N-CA 124.954 1.302 . . . . 3.9199999999999999 113.018 178.144 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 62.97 -145.73 50.17 Favored Glycine 0 C--N 1.34 0.783 0 C-N-CA 125.036 1.303 . . . . 2.8399999999999999 111.531 171.412 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.6 m -66.51 153.37 43.09 Favored 'General case' 0 C--O 1.248 0.984 0 CA-C-O 123.723 1.725 . . . . 4.0899999999999999 110.31 155.28 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -82.71 -4.05 57.29 Favored 'General case' 0 CA--C 1.552 1.048 0 O-C-N 120.364 -1.46 . . . . 7.8600000000000003 113.555 175.593 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 4.9 mp -103.04 0.39 31.97 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 128.175 2.59 . . . . 4.4800000000000004 112.592 171.924 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 28' ' ' THR . . . . . 0.401 ' HG1' ' CD ' ' B' ' 66' ' ' GLU . 81.9 p -132.13 157.57 43.89 Favored 'General case' 0 C--O 1.245 0.846 0 C-N-CA 125.356 1.462 . . . . 1.73 112.0 -178.562 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -95.29 128.45 42.14 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.395 1.478 . . . . 3.27 110.552 167.229 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 23.0 t -101.1 171.99 7.28 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.27 1.428 . . . . 2.5899999999999999 112.062 162.754 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 48.6 ttm-85 -58.87 -20.29 49.85 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.986 1.714 . . . . 4.6500000000000004 114.96 -165.143 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -95.74 -39.8 9.68 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.46 1.482 . . . . 6.7599999999999998 113.791 169.704 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -46.48 -44.87 17.92 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.224 1.01 . . . . 1.73 111.806 168.679 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 8.6 tp -77.67 -44.65 27.38 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 119.44 -0.314 . . . . 3.29 111.687 -175.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 52.3 mttm -54.87 -46.38 74.71 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 118.858 0.754 . . . . 4.0099999999999998 111.662 172.837 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -56.54 -53.92 51.95 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 123.852 0.72 . . . . 2.9300000000000002 111.469 174.379 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 64.0 tp -56.6 -57.67 11.36 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 125.26 1.424 . . . . 3.5800000000000001 112.375 -177.109 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 34.5 mt -56.95 -39.24 64.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.87 0.868 . . . . 2.4700000000000002 110.268 179.225 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -68.62 -9.25 48.68 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 120.689 -1.257 . . . . 4.9100000000000001 113.768 -176.387 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -104.8 -60.72 1.56 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.067 0.947 . . . . 4.4299999999999997 109.219 164.107 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -82.6 67.3 8.6 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 127.473 2.309 . . . . 5.6600000000000001 110.543 -176.578 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -173.73 29.58 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 127.861 2.465 . . . . 3.7799999999999998 111.075 166.878 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 33.5 t -50.96 -16.25 0.41 Allowed 'General case' 0 CA--C 1.557 1.246 0 N-CA-C 117.71 2.485 . . . . 3.71 117.71 -159.688 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -96.93 -7.4 33.32 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 116.226 1.936 . . . . 4.1799999999999997 116.226 174.459 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -110.35 105.96 2.04 Favored Glycine 0 N--CA 1.469 0.882 0 C-N-CA 125.148 1.356 . . . . 4.5599999999999996 112.547 -175.751 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -75.4 84.95 2.53 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-O 122.247 1.023 . . . . 6.3099999999999996 111.218 179.17 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 8.0 mmt -84.93 117.87 24.19 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 126.378 1.871 . . . . 3.3199999999999998 113.093 -178.289 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -70.71 140.94 51.55 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.892 1.277 . . . . 4.0199999999999996 110.126 171.431 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -53.21 -47.94 68.54 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 114.333 1.235 . . . . 3.8700000000000001 114.333 -168.147 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 15.4 t -70.83 -19.31 62.67 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.025 1.12 . . . . 4.5499999999999998 114.025 178.835 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 38.0 m -76.12 -18.92 58.93 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 120.884 -1.135 . . . . 4.6900000000000004 111.884 172.35 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 11.9 mm -66.28 -34.22 68.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 118.828 0.74 . . . . 2.5800000000000001 110.908 167.531 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -78.31 -21.88 48.99 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.044 0.838 . . . . 3.75 113.13 -177.83 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.555 ' HA ' ' HE3' ' B' ' 57' ' ' LYS . 9.8 t70 -77.78 -41.19 38.28 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 118.438 0.563 . . . . 2.71 111.357 166.23 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 50.7 tp -59.98 -48.31 82.21 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-O 118.411 -0.804 . . . . 3.6899999999999999 111.227 173.143 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 2.5 ppp? -59.93 -40.46 89.0 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.203 0.91 . . . . 2.8799999999999999 110.187 -179.493 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . 0.555 ' HE3' ' HA ' ' B' ' 54' ' ' ASP . 11.7 ttpp -61.51 -36.06 79.47 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.099 1.76 . . . . 4.0 113.227 172.6 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 5.6 t -75.16 -34.06 61.55 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.844 -1.16 . . . . 2.1299999999999999 111.581 176.417 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 70.9 mt -69.09 -34.26 74.83 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 117.437 -1.268 . . . . 2.7599999999999998 111.389 170.568 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -96.8 90.34 5.22 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.474 1.51 . . . . 1.99 113.919 -179.339 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 3.8 mptt -67.18 -19.8 65.63 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.904 1.281 . . . . 4.5599999999999996 113.28 -178.732 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -78.7 -31.76 46.67 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.161 0.892 . . . . 3.1499999999999999 112.886 173.065 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 12.5 t 63.51 24.03 13.89 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.951 1.3 . . . . 3.7400000000000002 113.637 -159.29 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 54.3 p-10 -81.57 -18.43 44.89 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.496 1.518 . . . . 2.5899999999999999 112.52 176.477 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 76.88 1.53 3.23 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 131.504 3.921 . . . . 4.3600000000000003 113.186 179.066 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . 0.401 ' CD ' ' HG1' ' B' ' 28' ' ' THR . 12.2 mm-40 -92.77 112.8 24.88 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 125.465 1.506 . . . . 2.4199999999999999 107.109 164.503 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 2.7 mt -97.65 107.46 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 O-C-N 121.045 -1.035 . . . . 2.6099999999999999 109.816 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -56.71 154.04 9.64 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.487 1.115 . . . . 3.7400000000000002 110.272 173.691 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -49.4 -46.11 47.0 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 120.727 -1.233 . . . . 3.7400000000000002 110.842 163.176 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -53.28 -31.18 42.54 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 127.958 2.503 . . . . 4.7800000000000002 115.319 173.054 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -87.19 -53.69 4.71 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.476 1.511 . . . . 1.75 109.371 176.84 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -58.42 -31.28 67.57 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 129.12 2.968 . . . . 3.3700000000000001 113.982 -177.54 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 23.3 t -56.74 -23.16 40.72 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 120.703 1.592 . . . . 3.0 112.837 178.786 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 78.2 t -64.79 -25.71 38.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 124.051 0.94 . . . . 2.6600000000000001 112.011 176.423 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -57.2 -53.16 61.29 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.489 1.516 . . . . 3.9300000000000002 110.803 169.206 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 25.7 mt -57.93 -43.48 86.32 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.18 1.392 . . . . 2.2000000000000002 109.985 179.387 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 65.3 m -58.26 -53.08 62.36 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 117.807 -1.092 . . . . 1.99 111.478 176.654 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.6 mtm -57.1 -47.76 80.28 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.602 1.092 . . . . 2.3300000000000001 112.019 -179.536 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 84.0 mt -68.68 -39.45 80.58 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.786 0.834 . . . . 2.71 112.677 -178.174 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.8 t -73.16 -31.83 64.49 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.645 -0.659 . . . . 2.8100000000000001 111.877 177.66 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 47.6 mtt -63.77 -43.74 95.48 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.787 0.721 . . . . 3.9399999999999999 110.994 169.637 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.2 -37.53 85.68 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.412 0.523 . . . . 1.5900000000000001 112.412 176.349 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -70.07 -35.77 74.47 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.612 0.967 . . . . 3.6200000000000001 113.612 172.645 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -65.88 -37.4 86.03 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 119.306 0.957 . . . . 2.6200000000000001 112.28 175.199 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -68.19 -42.37 80.01 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.337 1.055 . . . . 2.6499999999999999 111.983 173.028 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -52.51 -43.97 65.42 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.912 1.285 . . . . 3.29 112.185 175.758 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -63.08 -25.74 68.51 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.809 1.643 . . . . 3.8199999999999998 112.438 179.023 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 39.4 mt -85.3 -12.33 52.6 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.638 1.175 . . . . 2.6600000000000001 113.072 178.158 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . 0.554 ' CD ' ' HZ1' ' B' ' 92' ' ' LYS . 14.3 mm-40 -93.19 -8.11 43.35 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.277 1.831 . . . . 3.6000000000000001 114.234 169.307 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -89.44 -46.93 8.34 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.836 2.055 . . . . 4.1299999999999999 111.425 169.801 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -71.17 0.27 8.17 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.433 1.493 . . . . 3.8100000000000001 114.848 -172.003 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . 0.554 ' HZ1' ' CD ' ' B' ' 89' ' ' GLU . 16.7 pttm . . . . . 0 C--O 1.249 1.033 0 N-CA-C 117.186 2.291 . . . . 5.2000000000000002 117.186 -168.464 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 . . . . . 0 CA--C 1.536 0.415 0 N-CA-C 109.541 -0.54 . . . . 3.52 109.541 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 67.1 p -133.96 157.86 76.74 Favored Pre-proline 0 N--CA 1.471 0.619 0 C-N-CA 124.463 1.105 . . . . 2.46 111.1 -169.571 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.99 -21.54 32.27 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 122.305 2.004 . . . . 1.5800000000000001 112.216 176.7 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.24 -44.56 52.56 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.479 1.111 . . . . 3.21 110.886 176.45 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -67.15 -33.63 75.84 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.451 -0.781 . . . . 4.0 111.7 170.134 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.428 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -62.97 -35.9 81.72 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 119.957 -1.714 . . . . 6.9100000000000001 112.037 168.765 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.59 -56.17 17.98 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 120.405 1.457 . . . . 2.04 110.954 176.451 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 70.2 mt -57.58 -39.97 77.97 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.567 1.147 . . . . 2.2599999999999998 112.847 -178.384 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 19.7 p -67.3 -39.17 85.9 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 117.83 -1.081 . . . . 3.71 112.097 174.089 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.0 m -65.48 -32.51 74.17 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.375 0.989 . . . . 2.2799999999999998 111.562 179.921 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -55.34 -57.12 13.13 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 118.227 0.467 . . . . 4.4100000000000001 110.016 168.91 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 74.9 t -60.93 -37.79 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.024 0.53 . . . . 3.1000000000000001 111.797 -176.573 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.7 m -56.26 -57.92 10.18 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.216 1.006 . . . . 2.21 111.424 175.974 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.74 -28.45 55.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 118.688 -0.672 . . . . 3.5299999999999998 110.885 -170.749 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -63.05 -41.55 99.52 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.855 1.662 . . . . 2.8900000000000001 112.596 173.892 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 18.7 m170 -66.14 -20.93 66.3 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.756 1.021 . . . . 3.1299999999999999 113.756 175.873 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -65.34 -36.76 85.0 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.77 1.168 . . . . 6.0700000000000003 111.906 172.545 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -102.81 -38.46 7.41 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 114.176 1.176 . . . . 3.5499999999999998 114.176 -170.292 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.3 t -59.02 -32.87 70.12 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 120.106 1.321 . . . . 2.6600000000000001 112.686 179.61 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -93.56 34.16 4.76 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 126.845 2.164 . . . . 1.54 113.95 179.705 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.402 ' HE ' ' CD ' ' A' ' 36' ' ' GLU . 0.9 OUTLIER -72.41 52.76 0.28 Allowed 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.202 1.501 . . . . 4.71 110.089 162.912 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . 0.254 6.3 tp10 -6.53 -92.99 0.0 OUTLIER 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.854 1.057 . . . . 9.5399999999999991 113.854 -114.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 43.24 63.47 2.06 Favored Glycine 0 C--N 1.34 0.798 0 C-N-CA 124.71 1.148 . . . . 3.71 110.979 172.255 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.9 t 66.25 141.08 0.03 OUTLIER 'General case' 0 C--O 1.25 1.125 0 C-N-CA 125.745 1.618 . . . . 3.3300000000000001 113.361 -175.309 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.4 tttp -127.59 117.5 22.15 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.133 1.373 . . . . 5.3099999999999996 110.608 -154.556 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 97.45 -17.27 0.06 Allowed 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 130.419 3.488 . . . . 5.0099999999999998 110.513 -163.27 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 47.3 p -109.74 156.63 20.06 Favored 'General case' 0 C--O 1.245 0.86 0 C-N-CA 125.939 1.695 . . . . 2.02 112.348 176.564 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -109.58 105.42 14.72 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 125.764 1.625 . . . . 3.5699999999999998 109.651 169.85 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.4 t -64.77 159.59 22.03 Favored 'General case' 0 C--N 1.318 -0.763 0 O-C-N 121.955 -0.465 . . . . 2.7000000000000002 111.304 168.749 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.4 ttp85 -45.34 -40.09 7.46 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.56 1.544 . . . . 4.9500000000000002 115.014 -175.305 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 24.6 tptp -52.7 -57.92 8.54 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 119.203 -2.186 . . . . 5.7800000000000002 115.217 163.791 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -61.76 -41.33 97.54 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.558 1.543 . . . . 1.8400000000000001 109.715 -167.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.37 -43.03 95.79 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.717 1.207 . . . . 3.3399999999999999 111.668 177.443 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -63.57 -44.33 94.42 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.539 -1.351 . . . . 5.9400000000000004 111.61 176.989 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.402 ' CD ' ' HE ' ' A' ' 22' ' ' ARG . 80.5 tt0 -59.17 -44.5 92.15 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.668 0.787 . . . . 4.3899999999999997 112.504 176.352 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.3 tt -58.16 -54.31 48.44 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.226 1.41 . . . . 2.8599999999999999 111.324 176.566 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 27.6 mt -58.78 -46.17 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 119.0 0.818 . . . . 2.3599999999999999 109.87 -175.45 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -72.93 -3.33 25.16 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.987 1.106 . . . . 5.0 113.987 -174.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 56.6 mmtt -99.22 -49.89 4.32 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.346 1.858 . . . . 4.0199999999999996 111.534 168.392 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -75.04 -48.44 23.99 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.162 0.985 . . . . 5.4500000000000002 112.244 -173.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -89.59 -48.46 7.28 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.966 1.306 . . . . 3.6000000000000001 110.202 176.329 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 9.7 t 75.66 -40.59 0.42 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 128.1 2.56 . . . . 4.4500000000000002 113.673 -175.314 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -38.97 135.19 0.92 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.183 1.793 . . . . 5.6600000000000001 114.598 -169.71 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -81.85 -23.04 58.54 Favored Glycine 0 N--CA 1.477 1.384 0 C-N-CA 125.273 1.416 . . . . 5.4100000000000001 111.514 169.432 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -57.04 -16.65 7.64 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 127.923 2.489 . . . . 6.1200000000000001 112.563 169.041 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 9.9 tpt -66.57 -28.04 68.21 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.642 1.577 . . . . 4.96 113.377 169.683 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.42 109.51 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 130.078 3.351 . . . . 9.1799999999999997 112.382 -171.139 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -50.04 -52.32 35.28 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.985 1.714 . . . . 5.3099999999999996 114.147 -170.948 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.9 t -73.11 -15.35 61.48 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 120.098 -1.626 . . . . 3.46 114.005 177.643 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 20.1 t -75.5 -10.48 59.49 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.661 1.118 . . . . 4.0300000000000002 112.393 169.391 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 82.2 mt -70.92 -29.49 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-N 119.103 0.865 . . . . 2.6200000000000001 111.278 172.795 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.25 -32.51 70.06 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 118.775 0.716 . . . . 3.2000000000000002 111.38 174.537 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -81.38 -40.07 24.05 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.862 1.265 . . . . 2.6099999999999999 112.862 176.366 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.4 tt -66.26 -42.57 88.3 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 117.767 -1.111 . . . . 3.1000000000000001 111.503 176.493 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ppp? -65.04 -40.42 94.77 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.592 1.087 . . . . 3.0600000000000001 110.084 177.013 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.48 -38.97 82.21 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.068 0.947 . . . . 4.4699999999999998 112.375 172.173 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.3 t -57.98 -27.09 63.15 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.773 1.17 . . . . 2.7999999999999998 113.963 176.139 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 12.5 mt -74.27 -24.84 59.33 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.339 -0.85 . . . . 2.8500000000000001 112.372 178.584 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -102.31 115.64 30.98 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.58 1.552 . . . . 2.3700000000000001 111.685 -154.702 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -81.5 -14.04 57.42 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.133 1.16 . . . . 5.0300000000000002 114.133 -169.585 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 36.9 p-10 -124.49 -10.56 7.4 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.519 1.528 . . . . 2.5099999999999998 113.963 -178.097 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.3 m 58.57 42.27 21.01 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.516 1.527 . . . . 4.2400000000000002 111.861 -173.577 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.4 p30 -72.98 -29.24 62.9 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.073 1.749 . . . . 2.3599999999999999 111.347 -175.896 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 114.76 -6.2 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.456 1 C-N-CA 135.225 5.41 . . . . 4.7599999999999998 113.431 175.795 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -132.54 129.36 38.96 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.021 1.728 . . . . 4.1299999999999999 110.812 -168.506 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 10.6 mm -92.46 99.9 10.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 126.076 1.75 . . . . 2.1299999999999999 108.979 -173.02 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.415 ' OD2' ' HE3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -59.92 161.91 6.07 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.727 2.011 . . . . 3.1600000000000001 111.467 165.624 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.78 -43.0 76.35 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.658 -1.276 . . . . 3.3399999999999999 113.318 -177.537 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.533 ' HE2' ' SD ' ' B' ' 81' ' ' MET . 3.4 mtmt -73.3 -19.23 61.09 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 120.502 -1.374 . . . . 4.29 112.964 176.415 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -69.25 -56.46 7.51 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 107.85 -1.167 . . . . 2.1000000000000001 107.85 166.074 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -58.03 -28.94 64.93 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 127.915 2.486 . . . . 3.29 114.844 -177.976 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 53.1 m -53.04 -30.15 33.97 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 120.456 -1.402 . . . . 2.25 113.048 168.122 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 97.8 t -65.58 -31.89 55.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 CA-C-N 120.251 1.387 . . . . 3.1099999999999999 111.559 179.094 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -67.28 -51.56 51.4 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.122 0.969 . . . . 2.9700000000000002 109.473 176.396 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 59.9 mt -57.62 -37.1 72.7 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.859 1.264 . . . . 2.71 111.647 174.253 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 28.0 m -66.48 -48.83 68.62 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.758 0.823 . . . . 1.9099999999999999 111.023 176.082 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 19.4 ttp -62.93 -47.08 84.78 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.969 0.907 . . . . 3.77 111.656 -177.038 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 97.4 mt -65.73 -43.41 89.13 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.318 0.647 . . . . 2.29 112.203 177.385 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 7.7 t -65.21 -32.83 74.7 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 119.689 1.131 . . . . 2.6099999999999999 112.691 177.158 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 27.5 mtp -68.18 -34.62 76.63 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 118.689 -0.672 . . . . 2.8500000000000001 112.546 170.864 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.63 -40.65 88.85 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.627 1.103 . . . . 2.0 112.42 173.244 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -61.78 -24.6 66.94 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 113.56 0.948 . . . . 3.2200000000000002 113.56 172.002 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -72.95 -41.21 64.68 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.537 1.062 . . . . 2.7200000000000002 112.682 172.3 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -66.66 -37.57 85.07 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 118.569 0.622 . . . . 2.79 111.084 179.23 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.96 -55.43 23.55 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.968 1.307 . . . . 3.2599999999999998 111.322 167.8 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -58.02 -26.73 62.8 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.263 1.425 . . . . 3.6699999999999999 113.127 -176.898 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 76.0 mt -75.64 -20.56 58.42 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.625 1.17 . . . . 2.5099999999999998 113.657 175.454 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -91.52 -37.14 13.32 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.967 0.907 . . . . 3.52 113.359 169.067 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 . . . . . 0 CA--C 1.541 0.607 0 C-N-CA 125.278 1.431 . . . . 3.5099999999999998 114.197 -175.845 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 72.4 p . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 111.999 0.37 . . . . 3.23 111.999 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -71.69 -17.18 29.77 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 121.944 1.762 . . . . 1.6599999999999999 113.371 -178.43 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tt -65.02 -39.04 92.81 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.402 1.001 . . . . 4.1299999999999999 111.57 176.081 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -60.24 -42.73 95.87 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.694 0.759 . . . . 4.9199999999999999 111.424 174.178 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -67.15 -29.88 69.71 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.065 -1.022 . . . . 5.3200000000000003 112.626 175.631 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.33 -42.99 82.67 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.734 1.214 . . . . 1.6000000000000001 110.744 171.837 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.83 -38.45 90.8 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.267 -0.895 . . . . 2.3399999999999999 112.026 173.92 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.15 -43.46 95.72 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.075 -1.016 . . . . 2.1499999999999999 111.286 171.187 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 93.8 m -57.62 -38.78 75.55 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.783 1.233 . . . . 2.2400000000000002 111.425 -178.702 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -59.75 -38.83 82.86 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.758 1.022 . . . . 4.8899999999999997 113.758 172.87 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 21.1 t -69.88 -31.81 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 CA-C-N 119.627 1.103 . . . . 3.2400000000000002 111.259 175.559 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 44.6 m -77.85 -30.28 50.9 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 126.947 2.099 . . . . 1.8200000000000001 113.327 -174.807 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 12.7 p -78.13 -29.58 48.92 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.164 0.893 . . . . 2.1499999999999999 110.612 162.502 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.77 -57.29 13.3 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 118.261 0.482 . . . . 3.52 110.59 -175.872 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 14.0 m80 -68.7 -8.62 44.3 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.673 1.36 . . . . 2.7599999999999998 114.673 174.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -75.42 -49.97 17.28 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 120.903 -1.123 . . . . 5.0999999999999996 111.332 169.55 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -93.77 -23.99 17.97 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.185 0.994 . . . . 3.21 113.67 -174.104 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 97.6 p -65.59 -11.65 46.13 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 115.865 1.802 . . . . 3.29 115.865 -175.578 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.79 -0.2 83.98 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-O 117.457 -1.746 . . . . 2.7999999999999998 114.344 171.769 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -62.43 -31.36 72.05 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 120.496 2.148 . . . . 4.3300000000000001 112.66 178.733 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -177.51 -148.84 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 128.71 2.804 . . . . 4.7599999999999998 108.939 165.385 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 26.29 87.43 0.01 OUTLIER Glycine 0 N--CA 1.477 1.376 0 C-N-CA 128.459 2.933 . . . . 4.3499999999999996 113.551 167.464 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 6.0 m 43.58 150.17 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 129.331 3.052 . . . . 4.0199999999999996 117.104 -172.001 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 71.8 tttt -80.32 -12.38 59.61 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 119.503 -1.998 . . . . 7.4000000000000004 113.579 179.53 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 62.7 tp -71.85 -54.56 9.71 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 119.265 0.939 . . . . 4.1900000000000004 109.828 164.058 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 35.8 p -93.94 162.43 13.9 Favored 'General case' 0 C--O 1.254 1.301 0 C-N-CA 125.503 1.521 . . . . 2.2200000000000002 114.832 -159.059 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 24.6 mt -105.87 86.59 2.41 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.422 2.289 . . . . 2.7000000000000002 111.024 173.401 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 7.9 t -71.72 -178.41 2.25 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 119.768 -1.832 . . . . 3.8500000000000001 112.288 170.353 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -41.06 -60.2 1.28 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.634 1.574 . . . . 5.5499999999999998 114.758 -163.794 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.69 -32.7 58.06 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 120.12 1.327 . . . . 5.2000000000000002 112.147 -174.398 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -52.5 -52.2 55.65 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.558 1.543 . . . . 1.8600000000000001 111.539 172.458 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.65 -48.21 80.32 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.919 1.288 . . . . 3.3599999999999999 111.748 -178.663 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -57.25 -46.14 83.3 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 121.018 -1.051 . . . . 5.6399999999999997 112.892 177.842 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -57.41 -47.57 81.38 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 118.074 -0.965 . . . . 3.0699999999999998 113.03 175.287 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.47 -53.09 40.86 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.619 1.168 . . . . 3.0499999999999998 111.654 175.227 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 38.6 mt -55.78 -52.49 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 CA-C-N 118.949 0.795 . . . . 2.21 109.18 177.581 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -66.94 -10.57 50.49 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 114.043 1.127 . . . . 5.6799999999999997 114.043 -174.917 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 34.6 mmtm -95.68 -39.22 10.0 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.584 1.954 . . . . 4.5300000000000002 113.392 176.649 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -118.71 -35.2 3.76 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 118.163 -0.922 . . . . 5.5099999999999998 113.066 -166.34 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -109.19 57.76 0.61 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.528 1.931 . . . . 2.8100000000000001 108.975 171.243 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 76.8 m -54.59 -56.46 18.7 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.061 -0.971 . . . . 4.1299999999999999 113.523 -167.169 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 95.7 mt 59.09 -23.89 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 129.256 3.023 . . . . 5.8700000000000001 118.973 164.437 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.44 -55.92 4.67 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 125.679 1.609 . . . . 4.4900000000000002 112.28 177.914 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -66.83 1.04 2.04 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.989 1.107 . . . . 5.6799999999999997 113.989 171.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.08 57.02 1.72 Allowed 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 125.008 2.337 . . . . 2.54 112.593 172.248 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -87.39 162.62 17.22 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 129.997 3.319 . . . . 5.25 110.652 174.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -56.94 -36.46 70.27 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 120.761 -1.212 . . . . 4.0999999999999996 113.5 -173.389 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 7.0 m -72.08 -5.56 36.14 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 116.245 1.943 . . . . 3.3799999999999999 116.245 175.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 62.0 p -107.8 -39.69 5.49 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 120.426 1.466 . . . . 2.8900000000000001 111.516 165.982 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 11.8 mm -56.88 -49.3 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 126.678 1.991 . . . . 2.8100000000000001 113.245 176.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -76.31 -22.96 54.35 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.282 0.845 . . . . 3.1800000000000002 113.282 -166.891 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.467 ' CG ' ' HZ3' ' B' ' 57' ' ' LYS . 8.1 t70 -77.77 -39.66 43.38 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.124 0.569 . . . . 3.7999999999999998 111.494 167.285 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.92 -42.83 90.63 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 122.994 0.518 . . . . 3.27 110.537 174.707 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 7.2 tpt -57.77 -53.01 63.06 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.76 2.424 . . . . 2.4399999999999999 112.137 169.171 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . 0.467 ' HZ3' ' CG ' ' B' ' 54' ' ' ASP . 8.1 tttm -54.76 -43.81 73.08 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 120.675 -1.266 . . . . 5.6799999999999997 112.646 174.444 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 73.4 m -82.46 -24.63 34.17 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.923 1.289 . . . . 2.4399999999999999 112.35 -171.067 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 mt -60.77 -57.79 11.21 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 126.445 1.898 . . . . 3.6000000000000001 110.942 157.192 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -89.92 65.75 6.73 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.645 1.578 . . . . 1.53 111.508 -168.721 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 55.7 mttm -58.08 -31.91 67.54 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 115.177 1.547 . . . . 3.8399999999999999 115.177 -160.772 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -88.86 -5.49 57.99 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.288 1.218 . . . . 2.7799999999999998 114.288 176.394 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 11.2 t 61.22 25.64 15.6 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.544 1.938 . . . . 3.0099999999999998 114.065 178.838 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 55.7 p-10 -72.48 -16.15 61.8 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.838 1.255 . . . . 2.98 111.572 178.675 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 63.97 7.53 3.39 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 130.904 3.682 . . . . 4.4900000000000002 114.815 -177.485 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -89.92 127.73 36.07 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 107.053 -1.462 . . . . 3.4700000000000002 107.053 158.454 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 97.5 mt -111.81 110.35 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 N-CA-C 108.8 -0.815 . . . . 2.54 108.8 169.68 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -87.58 164.31 16.16 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 128.577 2.751 . . . . 4.1799999999999997 110.54 166.514 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -43.73 -38.81 3.36 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.704 1.601 . . . . 3.75 114.746 171.076 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 tpmt? -65.91 -28.42 68.92 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.04 0.936 . . . . 7.2000000000000002 112.938 179.834 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -85.27 -53.13 5.43 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.83 1.252 . . . . 2.02 109.858 167.517 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -47.63 -38.26 14.34 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 126.802 2.041 . . . . 4.0 114.603 -175.487 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 1.1 t -62.27 -17.13 57.7 Favored 'General case' 0 CA--C 1.549 0.904 0 O-C-N 120.342 -1.474 . . . . 3.1600000000000001 114.345 176.824 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 76.0 t -59.33 -45.1 93.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 O-C-N 120.269 -1.519 . . . . 2.4399999999999999 110.991 169.75 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -60.29 -51.45 69.49 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.551 0.74 . . . . 2.6600000000000001 110.249 175.893 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 31.9 mt -55.96 -39.28 71.52 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.745 0.818 . . . . 2.2000000000000002 112.383 176.576 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 95.0 m -60.61 -53.53 56.37 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.759 1.223 . . . . 1.78 111.87 176.715 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 33.1 mtm -63.78 -36.33 83.52 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 118.727 0.694 . . . . 2.3599999999999999 112.399 -177.134 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 82.1 mt -67.77 -45.82 73.81 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.91 0.884 . . . . 2.3100000000000001 111.947 176.814 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 61.7 m -59.79 -37.63 79.67 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 118.083 -0.96 . . . . 2.6899999999999999 112.719 173.744 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 81' ' ' MET . . . . . 0.533 ' SD ' ' HE2' ' A' ' 70' ' ' LYS . 21.9 mtp -66.44 -36.25 82.33 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.476 1.034 . . . . 3.5600000000000001 113.204 174.817 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.04 -47.65 73.67 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.856 0.753 . . . . 1.9299999999999999 111.635 173.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -65.01 -30.46 71.44 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.429 0.9 . . . . 4.1399999999999997 113.429 176.354 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -61.84 -52.59 63.54 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 118.983 0.811 . . . . 4.3200000000000003 112.268 174.322 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -61.74 -47.22 86.21 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.229 1.411 . . . . 3.0 111.935 -179.774 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.27 -46.97 69.49 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.517 1.527 . . . . 4.9699999999999998 111.717 177.346 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -61.57 -29.93 70.33 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.347 1.059 . . . . 4.1799999999999997 112.931 178.133 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 68.4 mt -77.19 -11.88 59.88 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.043 0.937 . . . . 2.9100000000000001 113.24 179.657 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . 0.448 ' O ' ' HE2' ' B' ' 92' ' ' LYS . 24.4 mm-40 -106.13 0.84 25.75 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.54 1.536 . . . . 5.1500000000000004 114.72 170.992 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -110.64 -50.91 2.91 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.235 1.814 . . . . 2.9700000000000002 112.46 -178.406 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -90.38 14.74 12.1 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 125.358 1.463 . . . . 3.8999999999999999 113.623 -177.136 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . 0.448 ' HE2' ' O ' ' B' ' 89' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 115.814 -2.041 . . . . 5.0700000000000003 115.974 -177.246 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.239 0.525 0 N-CA-C 109.332 -0.618 . . . . 5.9400000000000004 109.332 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.5 t -55.58 146.91 42.39 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.425 1.49 . . . . 3.5800000000000001 112.751 178.465 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -62.35 -14.75 40.65 Favored 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 122.084 1.856 . . . . 1.9399999999999999 112.69 169.345 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tt -76.99 -34.64 57.52 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.387 0.994 . . . . 3.52 111.705 173.313 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -59.77 -47.08 87.13 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.618 1.099 . . . . 4.7999999999999998 108.835 166.375 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.406 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -59.03 -27.26 65.3 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.916 -1.115 . . . . 4.8099999999999996 112.685 175.176 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -75.1 -48.56 23.21 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.798 1.239 . . . . 2.0299999999999998 112.589 172.992 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.4 mt -57.99 -42.67 85.62 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.693 1.133 . . . . 2.6200000000000001 111.538 172.479 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 8.2 m -57.36 -51.54 69.0 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.346 1.858 . . . . 3.02 111.137 170.555 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.7 m -58.78 -44.22 90.64 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.272 1.396 . . . . 2.4199999999999999 111.731 178.112 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 5.8 tmm? -55.95 -58.82 6.29 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.615 0.766 . . . . 4.5599999999999996 110.538 172.609 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.1 p -66.78 -26.6 37.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 CA-C-N 119.769 1.168 . . . . 3.3799999999999999 112.931 -177.75 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 98.7 m -60.86 -61.27 2.7 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.399 1.079 . . . . 1.8799999999999999 109.71 175.878 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.78 -31.87 65.19 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-O 118.383 -0.817 . . . . 3.6200000000000001 109.954 -173.746 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -65.11 -50.43 66.12 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.115 0.87 . . . . 3.29 112.547 171.854 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -68.28 -19.69 64.72 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.061 0.846 . . . . 2.5899999999999999 111.887 -178.05 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.8 mtpp -68.93 -53.47 20.73 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 120.822 -1.174 . . . . 4.1500000000000004 111.928 163.48 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -73.53 -32.75 64.38 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.689 1.366 . . . . 3.8399999999999999 114.689 -175.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.5 p -67.41 -22.37 65.54 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 121.298 1.863 . . . . 3.1699999999999999 112.439 172.736 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.53 -2.68 82.05 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.169 1.366 . . . . 1.8300000000000001 114.959 171.425 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.477 ' HE ' ' CD ' ' A' ' 36' ' ' GLU . 49.6 tpt85 -64.0 -19.17 64.98 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.53 1.665 . . . . 5.0800000000000001 114.943 -172.222 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -155.68 -178.71 7.48 Favored 'General case' 0 C--O 1.247 0.938 0 C-N-CA 129.701 3.2 . . . . 3.8100000000000001 107.808 165.673 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 24.96 99.41 0.01 OUTLIER Glycine 0 C--N 1.346 1.133 0 C-N-CA 126.946 2.212 . . . . 2.8500000000000001 114.651 149.364 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t 60.28 136.78 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.822 1.649 . . . . 3.1400000000000001 112.819 -176.931 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -80.5 -9.72 59.76 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.933 1.086 . . . . 6.0300000000000002 113.933 171.244 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 73.9 mt -79.91 -40.0 29.17 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 118.986 0.812 . . . . 4.6799999999999997 110.597 174.523 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.7 p -121.94 150.18 42.37 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-O 122.877 1.322 . . . . 2.52 112.545 -161.645 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.51 120.85 43.05 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 114.041 -1.436 . . . . 3.8500000000000001 111.706 176.888 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.5 p -68.85 169.43 11.5 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.911 1.285 . . . . 3.77 113.202 167.636 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 46.2 ttt85 -50.35 -26.77 5.27 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 115.549 1.685 . . . . 5.3200000000000003 115.549 176.656 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.86 -28.71 14.59 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.575 1.324 . . . . 5.1500000000000004 114.575 174.455 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -58.37 -52.44 65.59 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.563 1.074 . . . . 1.6100000000000001 109.021 163.615 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.9 tt -57.01 -45.89 82.73 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 128.142 2.577 . . . . 4.7800000000000002 112.168 175.573 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.3 ttmt -70.38 -38.19 74.67 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 118.692 0.678 . . . . 4.4199999999999999 111.63 -178.871 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.477 ' CD ' ' HE ' ' A' ' 22' ' ' ARG . 25.2 tt0 -60.1 -47.63 85.09 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 118.265 -0.874 . . . . 4.7800000000000002 111.729 169.097 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 tt -56.17 -59.87 4.31 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.46 1.104 . . . . 3.4100000000000001 110.652 179.289 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.7 mt -63.63 -54.37 33.15 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.523 0 CA-C-O 118.626 -0.702 . . . . 2.5699999999999998 109.408 -177.843 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.1 ttpp -72.0 -8.24 53.4 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 120.978 1.717 . . . . 5.0700000000000003 114.097 -172.691 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -90.77 -54.28 4.04 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 120.288 1.404 . . . . 5.3600000000000003 112.874 165.365 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -71.91 -33.24 68.14 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.82 1.191 . . . . 5.1100000000000003 111.511 -177.362 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.4 mt -111.53 65.32 0.62 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.81 1.644 . . . . 4.04 109.42 163.401 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 15.2 t -75.33 36.12 0.12 Allowed 'General case' 0 CA--C 1.55 0.975 0 O-C-N 120.68 -1.263 . . . . 4.5700000000000003 112.798 172.619 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 31.3 mt -96.23 169.88 9.63 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.488 1.515 . . . . 5.7800000000000002 111.466 -175.398 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.43 -25.44 74.8 Favored Glycine 0 N--CA 1.475 1.278 0 C-N-CA 123.929 0.776 . . . . 4.5499999999999998 112.502 -179.481 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -59.09 -34.51 72.08 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.752 2.021 . . . . 5.2999999999999998 111.402 173.58 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.53 66.34 2.77 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 124.511 2.101 . . . . 2.6600000000000001 112.878 -172.376 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 ptpp? -72.78 161.95 30.09 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 112.315 -2.22 . . . . 5.2400000000000002 110.692 156.39 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -49.38 -44.91 45.32 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 118.916 0.78 . . . . 5.4000000000000004 112.518 -179.253 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.2 m -61.33 -19.31 61.66 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.797 1.406 . . . . 3.27 114.797 178.558 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.8 m -83.85 -27.18 28.89 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.555 1.071 . . . . 3.6099999999999999 112.675 170.219 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 88.4 mt -80.91 -32.94 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 126.195 1.798 . . . . 3.1099999999999999 111.113 -178.88 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -61.93 -55.84 25.4 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.555 1.142 . . . . 3.8100000000000001 112.028 176.875 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -66.67 -26.16 66.91 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.764 0.653 . . . . 3.3599999999999999 112.764 177.163 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.1 tt -69.95 -38.92 76.28 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.354 -0.841 . . . . 4.0899999999999999 110.657 172.261 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.4 ttt -59.72 -49.59 77.14 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-O 117.85 -1.071 . . . . 3.2799999999999998 111.83 165.515 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -66.08 -22.97 66.43 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 121.171 1.805 . . . . 6.0499999999999998 113.124 179.041 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 29.0 t -81.15 -38.9 26.41 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.035 1.334 . . . . 2.8199999999999998 112.043 176.545 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 84.3 mt -81.8 -44.98 16.23 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 119.065 0.848 . . . . 2.9199999999999999 112.153 175.593 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -77.51 63.72 2.71 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.96 1.304 . . . . 2.73 111.327 -177.379 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -58.73 -22.31 57.33 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 125.813 1.645 . . . . 5.5099999999999998 113.936 -172.923 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -106.87 0.83 24.22 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 114.703 1.371 . . . . 2.9100000000000001 114.703 173.569 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.5 t 62.0 27.61 16.73 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.868 1.432 . . . . 3.9900000000000002 114.868 169.201 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.3 p-10 -86.69 2.6 48.01 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.171 1.788 . . . . 2.2400000000000002 111.914 -174.742 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.69 1.34 3.96 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 129.813 3.245 . . . . 4.5899999999999999 113.565 -173.802 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -119.59 131.99 55.62 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 123.691 1.71 . . . . 3.25 111.251 -179.392 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 3.6 mp -110.01 106.55 20.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 N-CA-C 107.653 -1.24 . . . . 3.5600000000000001 107.653 171.536 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -79.75 166.06 22.16 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.404 1.481 . . . . 3.4500000000000002 110.923 168.471 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -45.29 -38.26 5.49 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.556 1.142 . . . . 3.2999999999999998 112.817 171.77 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.87 -26.98 68.56 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 115.287 1.588 . . . . 6.4000000000000004 115.287 177.012 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -90.74 -47.06 7.86 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.488 1.915 . . . . 2.5600000000000001 109.414 170.789 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -57.97 -34.35 69.86 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 126.825 2.05 . . . . 3.7599999999999998 114.399 -173.84 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.6 t -59.21 -18.74 39.43 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.878 1.217 . . . . 2.96 112.884 -178.163 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 84.9 t -65.49 -25.35 36.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.804 0.841 . . . . 3.0299999999999998 112.024 172.135 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -63.21 -52.66 61.35 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.071 1.348 . . . . 4.0599999999999996 110.226 173.093 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.1 mt -58.28 -39.7 79.94 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.423 1.089 . . . . 3.4199999999999999 110.06 177.34 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.6 m -62.82 -52.44 63.14 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 117.707 -1.14 . . . . 2.2400000000000002 112.045 174.254 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 70.2 mtm -55.66 -45.43 77.71 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.876 1.216 . . . . 2.8100000000000001 111.754 -179.553 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 47.4 mt -76.68 -40.57 48.44 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.806 0.842 . . . . 2.48 112.444 -177.098 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 42.4 t -62.54 -36.66 83.33 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.53 1.059 . . . . 3.1200000000000001 111.943 171.469 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 83.2 mtp -64.27 -39.46 93.98 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.223 0.92 . . . . 3.0499999999999998 112.149 170.408 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.11 -45.98 82.9 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 119.293 0.951 . . . . 2.04 112.164 177.351 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -64.52 -36.12 83.18 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.248 0.833 . . . . 3.8900000000000001 113.248 175.136 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.83 -46.33 89.94 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.016 0.825 . . . . 2.98 112.079 174.542 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -67.33 -37.32 83.12 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.953 -0.467 . . . . 2.8500000000000001 111.163 -177.943 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.93 -54.98 26.96 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.027 1.331 . . . . 3.0899999999999999 111.053 169.727 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -60.84 -30.66 70.24 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.318 1.047 . . . . 3.7000000000000002 112.612 -175.852 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 69.6 mt -74.56 -15.36 60.85 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.042 0.937 . . . . 3.0 113.243 176.052 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -97.8 -23.99 15.64 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.295 1.221 . . . . 3.29 114.295 167.633 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 . . . . . 0 CA--C 1.542 0.649 0 C-N-CA 125.446 1.499 . . . . 4.0099999999999998 113.79 179.966 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.617 0 CA-C-O 118.508 -0.758 . . . . 3.0699999999999998 111.559 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -69.39 -31.59 21.85 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.489 2.126 . . . . 3.1400000000000001 115.237 -156.337 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 8.5 tt -68.67 -54.38 16.61 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 120.351 1.432 . . . . 5.04 111.378 171.856 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -57.66 -43.6 85.08 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.718 0.807 . . . . 6.1799999999999997 111.241 -178.545 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.36 -38.03 40.2 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 125.449 1.5 . . . . 5.0099999999999998 112.926 175.371 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.08 -43.58 61.64 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.604 0.761 . . . . 2.0800000000000001 110.409 179.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 73.2 mt -60.54 -36.39 78.34 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 123.513 0.725 . . . . 3.21 112.088 174.051 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.4 m -55.19 -45.31 75.82 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 118.61 0.641 . . . . 2.3300000000000001 112.074 170.338 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.4 t -72.35 -29.82 64.16 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.084 -0.96 . . . . 3.4300000000000002 112.612 179.352 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 43.3 mtp -61.32 -51.61 68.12 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 118.151 -0.928 . . . . 4.1799999999999997 111.529 176.02 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 26.3 m -62.65 -33.28 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 CA-C-N 119.037 0.835 . . . . 3.4399999999999999 112.15 176.592 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 54.0 m -67.93 -37.94 82.24 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.19 1.396 . . . . 2.2000000000000002 113.049 -178.224 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.59 -38.35 74.0 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 118.798 0.726 . . . . 2.3900000000000001 111.277 165.408 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -65.88 -49.68 67.21 Favored 'General case' 0 N--CA 1.462 0.139 0 O-C-N 123.929 0.768 . . . . 3.4300000000000002 111.439 -167.422 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -64.73 -23.49 67.27 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.903 0.774 . . . . 4.6100000000000003 112.44 -179.095 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -78.81 -52.04 8.91 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.659 -0.651 . . . . 5.4100000000000001 111.45 178.187 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -66.86 -43.0 84.74 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.069 -1.019 . . . . 3.2999999999999998 112.137 178.181 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 83.8 p -74.9 -16.7 60.65 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.137 1.162 . . . . 2.6400000000000001 114.137 176.491 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.65 -23.56 49.74 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-O 117.683 -1.621 . . . . 1.54 113.748 170.881 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.92 -19.18 60.77 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 119.939 1.87 . . . . 5.54 114.037 -165.442 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -124.49 122.67 38.26 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 119.096 0.862 . . . . 3.77 108.875 169.805 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.11 -1.23 2.87 Favored Glycine 0 N--CA 1.477 1.428 0 C-N-CA 127.968 2.699 . . . . 4.2199999999999998 117.793 -144.718 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 52.8 p -56.66 75.74 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.973 0 CA-C-O 121.463 0.649 . . . . 6.2000000000000002 109.885 141.986 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -75.87 118.98 19.23 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 119.657 -1.902 . . . . 6.96 111.208 -173.0 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 86.3 mt 96.37 -8.2 0.08 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 130.376 3.47 . . . . 5.6699999999999999 112.751 -179.361 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 45.2 p -108.19 144.09 36.1 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 124.904 1.282 . . . . 2.79 111.635 168.047 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 29.1 mt -97.73 114.21 26.16 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.388 1.875 . . . . 2.8500000000000001 112.527 177.361 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 20.3 p -68.86 167.86 14.72 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.533 1.533 . . . . 4.4199999999999999 113.798 165.292 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -58.58 -0.62 0.11 Allowed 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 115.958 1.836 . . . . 4.6900000000000004 115.958 172.554 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.0 -44.79 3.24 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.577 1.551 . . . . 4.4299999999999997 112.819 169.693 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -54.08 -44.97 71.63 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.478 1.036 . . . . 1.9299999999999999 109.538 171.819 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 56.1 tp -67.6 -44.08 78.95 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.599 1.559 . . . . 3.4900000000000002 112.448 179.449 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -55.39 -43.7 75.44 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.856 -0.592 . . . . 4.0899999999999999 111.147 172.537 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -60.73 -52.92 63.07 Favored 'General case' 0 C--O 1.224 -0.279 0 O-C-N 123.824 0.702 . . . . 2.8399999999999999 110.761 178.085 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.6 tt -59.14 -58.89 6.65 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.668 1.187 . . . . 3.0800000000000001 110.565 -178.534 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 25.7 mt -54.56 -46.47 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 119.304 0.956 . . . . 1.6899999999999999 110.073 179.159 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -74.32 -17.91 60.78 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 115.111 1.522 . . . . 7.1799999999999997 115.111 -177.354 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -93.15 -14.32 27.34 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.358 1.863 . . . . 4.1500000000000004 112.66 171.811 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -96.54 -37.09 10.53 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.13 1.772 . . . . 5.21 111.537 176.497 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -127.33 120.86 29.52 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.637 1.575 . . . . 2.7400000000000002 109.446 174.152 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 4.7 t -131.58 -9.42 3.62 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 115.255 1.576 . . . . 3.7999999999999998 115.255 174.088 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -47.46 -16.19 0.06 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 128.654 2.782 . . . . 3.9700000000000002 118.432 175.878 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.88 169.05 12.62 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-N 120.106 1.321 . . . . 3.5699999999999998 114.711 178.295 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 26.0 tp10 62.98 -22.19 0.05 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 129.775 3.23 . . . . 5.5300000000000002 117.203 172.776 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 32.9 tpp -75.74 82.11 2.7 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.459 -1.401 . . . . 2.75 111.332 -179.621 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 41.9 mttt -89.45 173.98 8.04 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.668 2.387 . . . . 4.2699999999999996 110.771 179.753 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 44.8 tp10 -48.79 -52.72 22.44 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.856 0.862 . . . . 3.8700000000000001 111.202 171.574 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 2.8 m -64.67 -27.61 69.04 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.372 1.249 . . . . 3.6499999999999999 114.372 177.417 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 3.8 m -74.0 -31.72 63.07 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.399 -0.813 . . . . 3.7000000000000002 111.479 176.828 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 28.9 mm -68.72 -38.47 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.66 0.784 . . . . 2.4700000000000002 111.11 171.575 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -70.55 -43.68 69.03 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.654 0.983 . . . . 3.3599999999999999 113.654 -167.542 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.99 -27.43 26.45 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 113.474 0.916 . . . . 3.7799999999999998 113.474 175.748 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 60.6 tp -56.22 -48.42 76.49 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 118.661 -0.685 . . . . 3.1200000000000001 110.199 167.82 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.9 ppp? -62.03 -32.17 72.64 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.605 1.093 . . . . 3.1800000000000002 113.681 -177.154 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 44.9 mttp -65.59 -25.25 67.32 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.041 0.837 . . . . 6.9199999999999999 112.685 174.494 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.1 t -92.17 -32.29 15.15 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.928 1.291 . . . . 2.27 113.896 177.007 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 69.3 mt -74.43 -25.44 59.45 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.947 0.899 . . . . 3.2000000000000002 112.81 175.143 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -80.81 121.5 26.02 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 122.457 1.122 . . . . 1.45 111.013 174.32 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -85.57 -13.77 47.83 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.059 1.133 . . . . 6.8300000000000001 114.059 -156.533 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 45.5 p-10 -141.95 -6.46 0.97 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.385 2.274 . . . . 3.23 115.324 -169.566 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 68.73 43.59 1.26 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.927 1.291 . . . . 3.0699999999999998 113.098 -175.086 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 40.0 p30 -87.96 -16.86 32.62 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.941 1.297 . . . . 2.1899999999999999 112.004 165.027 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 70.47 14.78 7.33 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 130.258 3.423 . . . . 6.6900000000000004 114.819 179.099 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -124.26 143.79 50.34 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.362 1.065 . . . . 3.6099999999999999 110.665 161.36 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 6.3 mm -97.34 105.38 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 O-C-N 121.33 -0.856 . . . . 2.52 110.143 179.135 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.02 155.69 39.93 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.998 1.319 . . . . 2.8999999999999999 111.437 166.355 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -46.44 -47.2 19.1 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.711 1.374 . . . . 4.8700000000000001 114.711 177.224 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . 0.301 0.3 OUTLIER -85.38 -1.15 56.7 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 120.329 -1.482 . . . . 5.3200000000000003 114.598 177.688 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -77.03 -53.85 7.29 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 108.866 -0.79 . . . . 2.2400000000000002 108.866 152.15 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -52.82 -29.84 30.0 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 127.579 2.352 . . . . 3.7799999999999998 115.272 -173.827 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 26.8 t -57.14 -21.63 34.04 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 120.588 -1.32 . . . . 2.5299999999999998 113.679 170.589 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 87.5 t -66.83 -45.88 86.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 120.109 1.322 . . . . 3.1299999999999999 110.666 174.991 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -56.38 -46.39 80.12 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.146 0.978 . . . . 2.6299999999999999 111.512 172.532 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 33.7 mt -61.19 -41.88 97.59 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.426 -0.797 . . . . 2.6000000000000001 111.533 178.231 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 93.7 m -56.53 -49.9 73.41 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.307 0.958 . . . . 2.3199999999999998 111.883 171.333 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 76.7 mtp -60.35 -46.4 90.05 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.838 0.744 . . . . 2.6400000000000001 111.922 -177.895 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 82.3 mt -62.35 -50.67 70.65 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.064 0.546 . . . . 3.1400000000000001 110.884 175.172 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 88.2 m -59.11 -33.02 70.36 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.151 0.887 . . . . 3.7200000000000002 113.279 179.942 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 63.8 mtt -74.45 -34.67 63.23 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.043 0.937 . . . . 5.0700000000000003 113.468 172.78 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.79 -41.35 71.76 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.737 1.153 . . . . 2.2799999999999998 111.662 176.446 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -57.52 -23.22 49.0 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.781 1.232 . . . . 4.0700000000000003 112.636 172.912 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -67.75 -42.72 81.36 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.178 -0.952 . . . . 2.8599999999999999 111.782 173.629 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -80.94 -32.63 34.51 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.291 1.036 . . . . 2.6400000000000001 111.563 -177.816 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -54.91 -37.28 66.16 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.255 1.822 . . . . 3.79 111.644 166.56 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -74.27 -16.68 60.94 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.838 1.255 . . . . 3.21 113.042 174.946 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 6.7 mp -79.29 -25.94 42.36 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 120.489 -1.382 . . . . 4.2800000000000002 113.107 168.906 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -62.55 -22.03 66.03 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 113.187 0.81 . . . . 7.3300000000000001 113.187 169.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -85.33 -56.6 3.45 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.174 1.79 . . . . 4.1399999999999997 111.285 171.575 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.15 -8.24 29.58 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 115.472 1.656 . . . . 3.6099999999999999 115.472 -173.002 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.971 0 C-N-CA 126.608 1.963 . . . . 6.5700000000000003 115.691 -179.43 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.446 -0.673 0 N-CA-C 103.958 -2.608 . . . . 6.0700000000000003 103.958 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.41 162.71 13.57 Favored Pre-proline 0 N--CA 1.475 0.823 0 O-C-N 121.68 -0.638 . . . . 2.4500000000000002 110.345 169.376 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.75 -21.22 21.88 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 121.447 1.431 . . . . 1.48 111.569 173.731 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -77.08 -43.27 34.95 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.903 1.681 . . . . 4.0800000000000001 112.386 176.442 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -51.05 -49.36 60.72 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.887 0.875 . . . . 3.7400000000000002 109.249 168.015 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -64.44 -38.1 89.84 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 120.889 -1.132 . . . . 4.7400000000000002 113.781 174.952 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.04 -52.19 64.93 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.605 1.093 . . . . 1.8400000000000001 112.306 178.986 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.0 mt -66.64 -31.98 73.01 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.156 0.582 . . . . 3.0699999999999998 111.895 176.873 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.2 m -58.71 -52.05 67.36 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 117.899 -1.048 . . . . 2.6600000000000001 111.378 166.969 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 49.9 m -55.84 -41.27 74.05 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.918 1.235 . . . . 2.3199999999999998 111.632 179.868 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 75.4 mmm -58.09 -54.43 47.08 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 122.951 0.501 . . . . 4.75 111.495 174.521 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.4 t -63.96 -31.97 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 CA-C-N 119.019 0.827 . . . . 3.1899999999999999 112.083 179.03 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.7 m -64.0 -57.67 9.0 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.358 1.463 . . . . 1.8200000000000001 111.244 -179.395 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 t -67.07 -36.1 81.26 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 118.854 -0.593 . . . . 4.0199999999999996 109.601 178.363 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -56.39 -48.07 77.64 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-O 117.746 -1.121 . . . . 2.8700000000000001 110.935 175.632 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.1 m80 -60.99 -43.65 98.56 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 120.816 1.643 . . . . 2.6499999999999999 112.584 173.283 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -62.69 -23.1 66.96 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.145 1.378 . . . . 4.9400000000000004 114.311 -176.069 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.4 ' HH ' ' HG2' ' A' ' 40' ' ' LYS . 94.2 m-85 -95.38 -47.73 6.17 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.537 1.062 . . . . 3.9700000000000002 111.191 161.891 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.7 t -54.38 -39.25 67.03 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.461 1.904 . . . . 2.4500000000000002 115.286 -168.689 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.86 7.37 42.95 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 125.43 1.491 . . . . 2.48 115.472 179.747 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 -118.57 96.66 5.38 Favored 'General case' 0 C--O 1.221 -0.424 0 N-CA-C 106.854 -1.535 . . . . 5.1500000000000004 106.854 174.994 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.401 ' CD ' ' HZ1' ' A' ' 32' ' ' LYS . 28.2 mt-10 88.26 148.67 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 127.897 2.479 . . . . 3.6499999999999999 111.623 -168.896 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.9 -145.44 49.76 Favored Glycine 0 CA--C 1.526 0.741 0 C-N-CA 124.182 0.896 . . . . 3.1800000000000002 112.168 177.155 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.4 m -88.35 164.53 15.5 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 122.085 -0.656 . . . . 3.6000000000000001 112.466 170.199 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -16.13 63.24 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 114.499 1.296 . . . . 8.8599999999999994 114.499 179.42 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -117.13 10.95 14.02 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.496 1.919 . . . . 4.2599999999999998 112.497 179.209 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.463 ' HG1' ' CD ' ' A' ' 66' ' ' GLU . 43.2 p -122.53 134.43 54.55 Favored 'General case' 0 C--O 1.249 1.043 0 N-CA-C 114.421 1.267 . . . . 1.97 114.421 171.97 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 69.8 mt -95.62 104.27 16.18 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.413 1.085 . . . . 2.7799999999999998 109.821 167.488 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.0 t -58.71 150.49 23.38 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.421 -0.799 . . . . 2.4500000000000002 109.965 161.284 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 34.3 ttp85 -45.47 -30.31 1.37 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 115.831 1.789 . . . . 3.8500000000000001 115.831 -172.56 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.401 ' HZ1' ' CD ' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -79.31 -36.9 38.87 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.029 1.122 . . . . 4.7400000000000002 114.029 176.012 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -59.34 -50.63 73.22 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.827 0.851 . . . . 1.54 109.351 169.685 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.3 tp -57.84 -46.61 84.51 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.405 1.082 . . . . 3.0800000000000001 111.902 178.032 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.533 ' HZ1' ' CG ' ' A' ' 53' ' ' ASP . 12.8 tppt? -49.34 -50.88 37.76 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.395 1.078 . . . . 4.8600000000000003 112.92 -178.373 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -89.6 -11.96 41.12 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 115.25 1.574 . . . . 4.54 115.25 -178.678 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.4 tt -63.81 -60.93 2.67 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 120.063 1.301 . . . . 3.0699999999999998 109.432 160.285 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.3 mt -58.03 -43.18 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 N-CA-C 110.215 -0.291 . . . . 2.27 110.215 -175.353 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.8 mtpt -64.25 -12.15 38.37 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 114.15 1.166 . . . . 5.5700000000000003 114.15 -179.492 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.4 ' HG2' ' HH ' ' A' ' 19' ' ' TYR . 0.3 OUTLIER -109.15 -24.02 11.35 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.186 1.794 . . . . 5.1600000000000001 112.335 -178.392 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 72.4 mt-10 -65.93 -48.07 72.63 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.793 1.178 . . . . 3.9900000000000002 111.372 163.056 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 77.3 mt -124.68 149.74 46.86 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.629 1.572 . . . . 3.25 111.419 -163.516 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 1.7 t -156.01 11.86 0.3 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.149 1.38 . . . . 3.9199999999999999 112.713 179.184 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.97 28.79 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 126.382 1.873 . . . . 4.4500000000000002 116.005 178.034 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.5 -49.86 3.69 Favored Glycine 0 N--CA 1.474 1.201 0 C-N-CA 125.924 1.726 . . . . 3.5600000000000001 115.033 170.17 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.59 -35.3 80.56 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.841 1.257 . . . . 7.6600000000000001 112.7 -177.62 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 45.2 tpp -83.86 68.82 10.1 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 123.053 1.406 . . . . 2.8500000000000001 112.597 -179.025 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -66.14 163.27 17.98 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.227 1.411 . . . . 6.5700000000000003 112.726 174.59 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.59 -46.64 14.43 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.832 0.853 . . . . 4.7599999999999998 111.452 160.768 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.1 t -70.45 -37.71 74.38 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 114.852 1.427 . . . . 2.75 114.852 175.077 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.0 m -62.91 -32.53 73.83 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 121.148 1.794 . . . . 2.7200000000000002 111.636 176.871 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.3 mt -63.85 -30.53 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 124.795 1.238 . . . . 2.4700000000000002 113.765 179.917 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.533 ' CG ' ' HZ1' ' A' ' 35' ' ' LYS . 67.5 m-20 -81.08 -24.45 37.77 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.813 1.188 . . . . 3.3900000000000001 112.64 -179.739 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -73.84 -42.15 61.25 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.406 -0.809 . . . . 3.0699999999999998 111.0 168.165 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 43.3 tp -57.75 -45.37 85.97 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.886 1.274 . . . . 3.0600000000000001 110.758 168.581 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -56.75 -47.2 80.59 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 125.543 1.537 . . . . 2.5299999999999998 110.886 175.315 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -26.34 64.75 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 121.205 -0.934 . . . . 4.5999999999999996 113.405 174.113 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 t -88.68 -32.8 17.81 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 120.714 -1.242 . . . . 2.6299999999999999 113.468 176.917 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.1 mt -58.42 -50.59 73.16 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.815 1.246 . . . . 3.8300000000000001 110.938 165.06 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -102.57 76.47 1.53 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.375 1.87 . . . . 1.8899999999999999 112.791 -161.78 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -60.42 -21.33 62.12 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 113.67 0.989 . . . . 3.75 113.67 -167.689 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 51.6 p30 -100.5 -8.29 23.28 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.662 1.585 . . . . 2.6000000000000001 114.351 177.657 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 73.4 m 54.89 33.64 20.38 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.201 1.4 . . . . 3.27 114.069 -174.687 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.4 p30 -71.02 -15.54 62.56 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.547 1.539 . . . . 2.1400000000000001 111.872 176.35 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 66.04 4.53 3.1 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 131.558 3.943 . . . . 4.6699999999999999 116.131 -174.9 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.463 ' CD ' ' HG1' ' A' ' 28' ' ' THR . 2.4 mm-40 -103.99 126.86 51.43 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 127.193 2.197 . . . . 2.52 109.056 167.527 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 1.6 mm -104.3 100.74 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 O-C-N 120.953 -1.092 . . . . 2.0899999999999999 111.024 -175.041 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -75.28 156.86 35.2 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 127.421 2.289 . . . . 2.54 111.275 170.561 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -45.41 -41.36 9.14 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.125 1.528 . . . . 5.21 115.125 -179.994 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.6 pttm -80.14 -10.22 59.75 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 113.912 1.078 . . . . 3.9500000000000002 113.912 -178.595 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -80.93 -53.67 6.24 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 108.043 -1.095 . . . . 1.79 108.043 158.278 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -54.48 -36.38 64.07 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.343 2.257 . . . . 4.29 116.178 -170.891 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.6 p -67.69 -23.12 65.26 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 120.725 -1.234 . . . . 2.6499999999999999 112.79 -170.77 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 p -60.74 -28.13 42.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 CA-C-N 118.56 0.618 . . . . 3.4500000000000002 112.586 176.517 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -74.72 -58.9 3.0 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.921 0.889 . . . . 3.8599999999999999 110.469 -175.752 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.429 ' H ' HD22 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -61.83 -24.53 66.94 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 118.045 -0.978 . . . . 3.2400000000000002 113.126 172.452 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 53.7 m -58.59 -53.72 55.21 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.874 0.87 . . . . 2.04 110.946 165.411 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 61.8 mtm -60.95 -40.18 92.31 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.822 0.737 . . . . 2.1600000000000001 112.356 178.451 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 60.7 mt -60.09 -51.42 69.69 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.784 0.72 . . . . 2.5 110.729 174.698 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 82.0 m -63.84 -35.07 79.41 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.098 0.777 . . . . 3.1400000000000001 113.098 178.024 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 75.3 mtp -62.81 -44.35 96.38 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.892 1.224 . . . . 3.23 111.325 171.57 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.44 -47.82 82.39 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.932 -0.556 . . . . 1.79 111.452 177.249 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -62.85 -32.16 73.33 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.941 0.792 . . . . 4.6200000000000001 113.085 177.005 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -67.74 -39.98 84.17 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 119.88 1.218 . . . . 2.3500000000000001 111.358 177.133 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -72.69 -39.47 67.0 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.001 0.819 . . . . 2.98 110.965 178.465 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -53.62 -42.34 67.63 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.008 1.723 . . . . 3.52 111.464 170.653 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -58.92 -29.31 66.99 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.23 1.012 . . . . 3.6499999999999999 112.886 -179.448 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.9 mp -74.7 -23.55 58.62 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.57 0.748 . . . . 3.6099999999999999 112.916 174.494 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -91.82 -14.58 29.53 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.809 1.644 . . . . 2.6499999999999999 114.359 175.858 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 31.9 t70 . . . . . 0 CA--C 1.54 0.562 0 C-N-CA 128.045 2.538 . . . . 3.71 113.067 -170.475 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 17.2 p . . . . . 0 N--CA 1.469 0.476 0 N-CA-C 113.037 0.754 . . . . 2.4399999999999999 113.037 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -62.75 -18.93 66.87 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.701 2.267 . . . . 2.7400000000000002 112.257 166.713 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 9.7 tt -68.39 -51.99 37.94 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-O 118.482 -0.771 . . . . 3.9500000000000002 110.387 166.477 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.05 -30.62 71.74 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.755 1.161 . . . . 3.79 111.974 176.973 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -33.54 68.18 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 119.523 -1.986 . . . . 6.0 111.963 172.494 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.03 -40.03 94.23 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 119.691 1.132 . . . . 3.1699999999999999 112.648 169.76 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 68.2 mt -64.77 -35.55 81.45 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.287 0.949 . . . . 3.3100000000000001 111.872 171.018 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 36.5 m -60.96 -52.01 66.83 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 118.061 -0.971 . . . . 1.98 110.182 170.416 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 93.1 m -50.93 -38.75 52.23 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.069 1.348 . . . . 2.73 111.802 175.776 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 5.1 ttp -53.45 -51.52 62.41 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.585 0.754 . . . . 4.0999999999999996 112.022 174.229 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 34.5 m -74.66 -27.84 21.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 N-CA-C 113.251 0.834 . . . . 3.23 113.251 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 17.9 m -59.22 -54.84 42.37 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.656 1.182 . . . . 2.27 110.745 176.446 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.93 -32.12 51.41 Favored 'General case' 0 C--O 1.224 -0.252 0 O-C-N 123.62 0.575 . . . . 4.2000000000000002 110.463 -175.989 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -54.49 -44.52 72.72 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.312 0.505 . . . . 3.1600000000000001 110.718 172.418 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.21 -27.32 63.79 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.821 1.415 . . . . 2.4300000000000002 114.821 179.04 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -63.71 -45.6 89.26 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 120.833 -1.167 . . . . 5.7999999999999998 111.537 172.541 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -87.7 -10.27 51.7 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.428 1.091 . . . . 3.1800000000000002 113.098 -178.383 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 68.2 m -58.05 -56.52 20.96 Favored 'General case' 0 C--O 1.241 0.624 0 O-C-N 120.883 -1.136 . . . . 2.7599999999999998 112.009 164.018 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.12 -20.31 53.24 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-O 117.407 -1.774 . . . . 2.52 114.77 -168.439 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -47.85 -46.51 31.2 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.402 1.481 . . . . 4.5999999999999996 113.118 -169.572 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 57.0 mp0 -130.74 153.53 48.92 Favored 'General case' 0 C--O 1.248 0.981 0 CA-C-O 124.014 1.864 . . . . 3.5899999999999999 111.912 167.744 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.92 -8.15 2.65 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.32 1.438 . . . . 2.4100000000000001 113.903 -172.309 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 15.1 m 57.1 -142.83 0.73 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.485 1.114 . . . . 7.4100000000000001 109.781 -159.782 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 24.1 mttt 68.25 -172.48 0.19 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.274 1.83 . . . . 12.25 112.541 172.522 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 mp -82.91 -0.8 50.1 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.829 1.251 . . . . 4.79 112.843 173.683 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 21.8 p -113.57 152.47 30.25 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 115.765 1.765 . . . . 2.0699999999999998 115.765 -155.578 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -101.43 108.39 19.97 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 127.205 2.202 . . . . 3.23 113.022 -172.215 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 12.9 t -84.1 162.46 20.29 Favored 'General case' 0 C--N 1.315 -0.896 0 O-C-N 120.247 -1.533 . . . . 2.8700000000000001 112.16 176.835 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 24.0 ttt85 -45.14 -41.11 7.69 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.603 1.561 . . . . 4.7300000000000004 114.426 -178.17 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.411 ' HZ3' ' CD ' ' B' ' 36' ' ' GLU . 0.0 OUTLIER -78.82 -36.36 42.71 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.898 -1.126 . . . . 7.3300000000000001 113.277 174.279 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -60.5 -46.11 91.32 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 120.041 1.291 . . . . 1.8 110.393 176.349 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 8.2 tp -65.69 -36.78 84.61 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.008 1.723 . . . . 2.9100000000000001 113.076 178.7 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -64.91 -28.03 69.26 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.362 1.065 . . . . 6.0 112.363 174.506 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.411 ' CD ' ' HZ3' ' B' ' 32' ' ' LYS . 0.2 OUTLIER -68.03 -77.19 0.08 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.061 -0.971 . . . . 3.2400000000000002 108.541 158.822 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 23.3 tp -48.69 -43.2 36.79 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.276 1.83 . . . . 3.1200000000000001 114.502 -163.684 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 58.6 mt -57.15 -64.51 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 120.191 1.36 . . . . 2.23 107.49 174.474 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 25.4 mtpt -62.09 -26.37 68.25 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.398 0.888 . . . . 5.4299999999999997 113.398 -174.803 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.73 -36.48 50.8 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.113 1.765 . . . . 6.6900000000000004 113.308 -179.534 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -122.17 -29.48 4.19 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.145 1.165 . . . . 6.04 114.145 -170.189 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -118.36 79.44 1.38 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.168 1.787 . . . . 4.9800000000000004 107.098 169.446 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 93.4 m -68.53 -47.81 65.96 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.36 -0.836 . . . . 4.4299999999999997 112.448 -155.722 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 6.7 mp 61.84 -34.86 0.11 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 129.755 3.222 . . . . 6.2199999999999998 118.604 170.519 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.68 -51.22 4.39 Favored Glycine 0 N--CA 1.473 1.164 0 C-N-CA 126.598 2.047 . . . . 3.54 112.788 174.411 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -68.72 -4.36 15.58 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.497 1.119 . . . . 5.2599999999999998 112.217 168.322 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.55 63.84 0.42 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 124.542 2.115 . . . . 2.7400000000000002 111.063 163.698 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -76.46 147.89 37.59 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 127.269 2.228 . . . . 4.3300000000000001 109.147 174.457 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.16 -37.1 66.56 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.674 1.361 . . . . 4.8300000000000001 114.674 -157.348 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 8.5 t -74.74 -24.17 58.68 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.884 1.439 . . . . 3.1000000000000001 114.884 174.389 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 4.8 m -63.55 -18.23 63.63 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 120.06 1.3 . . . . 3.0600000000000001 111.957 173.895 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 42.7 mm -67.62 -25.7 33.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 C-N-CA 124.805 1.242 . . . . 2.8100000000000001 111.834 174.299 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -70.75 -34.45 71.85 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.958 0.799 . . . . 5.0599999999999996 111.944 173.391 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.61 -32.95 47.73 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.203 1.001 . . . . 3.54 111.732 174.821 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.87 -44.38 93.25 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 118.414 -0.803 . . . . 3.46 111.211 167.453 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 14.0 mtp -57.64 -49.35 76.76 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.86 1.209 . . . . 2.6699999999999999 110.71 171.453 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -60.87 -29.32 69.47 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.303 1.441 . . . . 4.3099999999999996 113.142 -178.607 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 33.2 t -76.09 -22.03 56.05 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 115.086 1.513 . . . . 4.1100000000000003 115.086 172.021 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mp -109.21 -45.91 3.66 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.736 1.614 . . . . 4.2800000000000002 114.775 -172.401 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -85.11 88.49 7.47 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.485 1.514 . . . . 1.6000000000000001 111.26 -163.587 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -62.82 -29.36 70.66 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.614 1.565 . . . . 5.8600000000000003 114.634 -173.431 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -85.04 -16.31 41.15 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 117.83 -1.081 . . . . 2.3100000000000001 112.711 169.059 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 20.6 m 49.64 66.1 1.22 Allowed 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 126.261 1.825 . . . . 4.7699999999999996 112.28 176.224 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -136.69 -102.12 0.2 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.377 0.671 . . . . 3.29 110.804 -148.851 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -145.19 -10.17 0.57 Allowed 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 115.592 1.701 . . . . 6.1500000000000004 115.592 167.17 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -137.87 146.12 43.0 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 125.357 1.463 . . . . 2.4199999999999999 112.961 175.541 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 2.6 mt -100.02 109.3 24.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 C-N-CA 127.89 2.476 . . . . 2.7400000000000002 107.284 173.321 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . 0.463 ' CG ' ' HZ1' ' B' ' 70' ' ' LYS . 0.0 OUTLIER -76.07 160.2 30.02 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.752 1.621 . . . . 2.4900000000000002 111.181 168.334 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -56.46 -31.26 63.81 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 121.078 -1.014 . . . . 3.7999999999999998 112.999 -174.463 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.463 ' HZ1' ' CG ' ' B' ' 68' ' ' ASP . 0.0 OUTLIER -89.6 -11.06 43.74 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.304 1.841 . . . . 4.5199999999999996 112.81 -179.465 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -75.02 -57.18 4.06 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 108.468 -0.938 . . . . 1.6899999999999999 108.468 153.494 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -54.84 -24.88 25.15 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.653 2.381 . . . . 2.8900000000000001 115.663 -174.607 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 1.8 m -49.54 -31.08 9.61 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 120.754 -1.216 . . . . 2.8700000000000001 112.689 170.121 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 95.4 t -74.21 -25.46 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.159 0.583 . . . . 2.71 111.959 -179.777 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -61.31 -56.98 14.29 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-N 119.199 0.908 . . . . 4.3200000000000003 111.037 171.039 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -56.75 -45.57 81.95 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.51 0.724 . . . . 4.5199999999999996 110.772 179.242 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 76.4 m -53.19 -54.5 35.02 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.118 1.367 . . . . 2.1899999999999999 112.154 176.707 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 12.7 tmm? -65.73 -43.99 87.39 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.948 1.299 . . . . 3.6600000000000001 112.412 -176.293 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -55.27 -50.4 69.62 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.631 0.772 . . . . 3.46 110.978 170.149 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 9.6 t -61.71 -36.11 79.98 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.117 0.784 . . . . 4.0199999999999996 113.117 -179.254 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 94.0 mtp -67.79 -35.95 79.59 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.244 1.017 . . . . 3.6899999999999999 113.004 173.926 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.91 -30.27 50.53 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 119.453 1.024 . . . . 2.25 112.969 175.623 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -74.75 -18.39 60.5 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.668 -1.27 . . . . 4.1600000000000001 111.719 -177.537 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -55.9 -32.97 64.21 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.527 1.531 . . . . 3.25 114.055 161.262 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -105.9 -28.94 10.3 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 127.408 2.283 . . . . 3.04 112.126 -167.752 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.67 -41.14 61.16 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.382 1.073 . . . . 4.2000000000000002 110.369 159.336 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -65.94 -24.23 66.77 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.288 1.835 . . . . 3.71 113.218 173.099 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 75.1 mt -90.05 -3.68 57.81 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.453 1.501 . . . . 3.2599999999999998 113.935 178.306 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . 0.482 ' CD ' ' HZ2' ' B' ' 92' ' ' LYS . 72.4 mm-40 -90.45 -4.72 56.8 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.085 0.954 . . . . 3.8900000000000001 112.685 162.014 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -119.02 -66.96 1.02 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.335 1.454 . . . . 3.0499999999999998 111.268 -174.798 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -81.75 47.83 1.13 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.401 1.481 . . . . 3.3300000000000001 111.372 169.544 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . 0.482 ' HZ2' ' CD ' ' B' ' 89' ' ' GLU . 22.2 tttp . . . . . 0 C--O 1.251 1.148 0 C-N-CA 129.748 3.219 . . . . 5.3600000000000003 115.839 -173.316 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 . . . . . 0 CA--C 1.534 0.355 0 N-CA-C 118.412 2.745 . . . . 7.0099999999999998 118.412 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 76.4 p -147.91 161.0 36.45 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 118.603 0.638 . . . . 3.0699999999999998 112.146 -154.88 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -62.36 -23.86 75.4 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 121.933 1.755 . . . . 1.73 111.836 165.384 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -69.87 -48.38 58.97 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.994 1.318 . . . . 3.3799999999999999 111.083 177.411 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -63.77 -44.01 94.69 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 122.522 1.153 . . . . 3.3900000000000001 110.611 177.363 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -66.04 -19.98 66.03 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.686 -1.259 . . . . 5.0599999999999996 112.282 175.105 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -81.94 -45.12 15.84 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.167 1.387 . . . . 2.29 112.379 171.54 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.4 pp -63.37 -30.14 71.32 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 121.999 2.182 . . . . 4.4699999999999998 112.157 171.588 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 30.0 m -53.09 -56.75 13.8 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.223 1.009 . . . . 2.2799999999999998 109.371 164.622 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.76 -34.72 73.35 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.926 1.291 . . . . 2.71 114.008 179.503 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -56.88 -44.46 82.28 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.335 1.054 . . . . 4.29 112.444 170.193 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.2 t -71.66 -32.03 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 CA-C-O 118.597 -0.716 . . . . 3.02 112.178 173.235 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 54.3 m -57.34 -56.61 19.62 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 119.758 1.163 . . . . 2.0 111.641 175.476 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -57.93 -43.12 86.12 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 123.344 0.657 . . . . 2.7599999999999998 110.068 173.537 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -64.5 -45.2 88.3 Favored 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 120.677 -0.409 . . . . 2.98 111.99 -173.265 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.32 -45.59 92.56 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 120.379 -1.451 . . . . 2.3399999999999999 112.061 176.336 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.17 -41.36 67.15 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.948 0.721 . . . . 6.9100000000000001 112.948 -176.513 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -72.74 -43.4 62.98 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.083 0.856 . . . . 3.4900000000000002 112.99 173.096 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.2 m -72.45 -26.2 61.74 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 120.307 1.412 . . . . 3.1600000000000001 111.964 -179.407 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.02 -35.44 89.33 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 124.689 1.138 . . . . 2.04 113.164 173.891 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.3 ttt85 -45.55 -50.1 13.31 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 128.073 2.549 . . . . 5.9199999999999999 115.609 -168.775 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -138.6 161.95 35.83 Favored 'General case' 0 C--O 1.25 1.127 0 C-N-CA 126.167 1.787 . . . . 4.7199999999999998 111.465 -177.255 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.52 -87.81 0.27 Allowed Glycine 0 C--N 1.346 1.123 0 C-N-CA 127.234 2.349 . . . . 2.3500000000000001 109.62 179.678 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -146.36 -179.54 6.82 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 121.559 -0.965 . . . . 5.6600000000000001 110.04 142.75 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.51 ' H ' ' HD3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -37.73 156.35 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.489 1.916 . . . . 7.4800000000000004 113.011 147.106 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.0 mt 78.85 -50.7 0.45 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 128.185 2.594 . . . . 3.9199999999999999 110.712 -169.857 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.6 p -86.18 136.6 33.13 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 113.243 0.831 . . . . 3.1400000000000001 113.243 -176.326 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 28.3 mt -90.7 107.4 19.15 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.56 -0.904 . . . . 2.46 108.56 149.394 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.0 t -71.01 161.22 31.52 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 120.646 -1.284 . . . . 2.2599999999999998 111.177 163.425 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.423 HH21 ' CG ' ' A' ' 53' ' ' ASP . 22.4 ttt180 -42.2 -35.34 0.93 Allowed 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.757 1.623 . . . . 4.1900000000000004 114.209 179.819 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 mmmm -71.38 -55.74 7.35 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 116.071 1.878 . . . . 5.7400000000000002 116.071 173.507 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -49.9 -35.65 24.46 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.2 1.4 . . . . 2.0600000000000001 110.002 171.606 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.7 tp -81.57 -49.07 10.98 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.968 0.907 . . . . 3.0600000000000001 110.902 -174.814 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -55.34 -38.22 68.48 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.06 0.846 . . . . 7.3200000000000003 111.384 175.885 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -79.19 -8.61 59.14 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.83 1.419 . . . . 3.7599999999999998 114.83 -174.73 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 50.8 tp -92.27 -55.28 3.48 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.855 1.262 . . . . 4.0899999999999999 111.212 169.611 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 23.0 mt -57.86 -49.07 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 O-C-N 121.668 -0.645 . . . . 2.0899999999999999 110.08 -174.133 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.09 -3.94 15.23 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 113.475 0.917 . . . . 5.04 113.475 -178.008 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.6 mmtp -95.37 -45.82 6.97 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.948 1.299 . . . . 3.8799999999999999 110.88 167.942 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -64.82 -53.0 53.69 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.227 1.411 . . . . 5.2800000000000002 111.81 -177.131 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -82.47 41.5 0.71 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.029 1.332 . . . . 3.6000000000000001 112.245 -175.621 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 53.4 t -58.04 -33.52 69.09 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.17 1.388 . . . . 3.7799999999999998 112.646 177.916 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -71.42 -6.34 39.57 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.896 1.443 . . . . 5.0499999999999998 114.896 174.332 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -133.67 -8.96 2.09 Favored Glycine 0 N--CA 1.472 1.045 0 CA-C-O 118.195 -1.336 . . . . 4.75 115.881 -178.173 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 52.32 41.38 30.47 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.157 1.783 . . . . 7.9100000000000001 113.509 -179.436 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.4 tpt -39.33 104.97 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.609 1.564 . . . . 2.4500000000000002 112.102 -173.509 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -73.53 158.79 34.22 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.393 0.516 . . . . 6.9100000000000001 112.393 -160.641 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.54 -47.02 73.68 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 119.761 1.164 . . . . 5.6299999999999999 111.822 175.447 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.8 t -65.34 -3.67 4.45 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 115.183 1.549 . . . . 3.0899999999999999 115.183 173.782 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -114.1 -18.46 11.67 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.833 1.253 . . . . 3.46 113.086 170.317 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 24.8 mt -76.71 -31.15 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 125.908 1.683 . . . . 2.1099999999999999 110.527 172.029 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.423 ' CG ' HH21 ' A' ' 31' ' ' ARG . 43.8 m-20 -70.2 -41.22 73.96 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 118.127 -0.94 . . . . 2.8500000000000001 113.197 177.166 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -65.92 -44.59 84.7 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 120.385 1.448 . . . . 2.8700000000000001 110.348 168.316 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 49.1 tp -54.67 -48.45 72.35 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.109 -0.948 . . . . 3.1099999999999999 110.403 179.847 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.6 ttt -55.9 -50.39 70.82 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.192 1.36 . . . . 2.3300000000000001 112.144 172.249 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.56 -18.56 30.72 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.549 1.54 . . . . 5.7400000000000002 113.322 175.345 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.5 m -101.17 -22.85 14.57 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 127.077 2.151 . . . . 2.8500000000000001 113.763 179.067 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.7 mp -72.9 -46.17 54.16 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.573 -1.33 . . . . 3.8300000000000001 110.79 162.328 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -78.48 63.13 3.25 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.826 2.05 . . . . 1.9399999999999999 112.577 -166.295 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -51.06 -39.62 56.41 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 125.804 1.642 . . . . 4.2400000000000002 113.962 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -82.02 -8.02 59.64 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.777 1.399 . . . . 3.27 114.777 176.004 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.4 t 63.36 39.55 9.27 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.871 1.268 . . . . 2.9700000000000002 114.202 166.855 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 42.3 p-10 -109.45 1.96 20.23 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 127.946 2.499 . . . . 2.6000000000000001 112.976 -175.074 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 78.66 -7.35 1.8 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 128.157 2.583 . . . . 4.1200000000000001 115.639 -178.385 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -116.0 141.94 47.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.049 1.34 . . . . 3.8500000000000001 109.895 -179.659 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 22.4 mm -100.22 103.82 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 O-C-N 120.514 -1.366 . . . . 2.29 111.569 175.994 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.48 162.22 29.52 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 125.139 1.376 . . . . 2.3999999999999999 112.132 164.057 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.32 -40.72 74.86 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 120.544 -1.348 . . . . 3.2000000000000002 113.16 -174.818 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.63 -14.65 62.94 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 120.977 -1.077 . . . . 4.3399999999999999 112.744 174.855 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -84.88 -51.93 6.37 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.34 -0.85 . . . . 2.0699999999999998 110.789 168.682 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -52.97 -45.0 67.58 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 127.195 2.198 . . . . 3.5600000000000001 114.513 -171.571 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.0 t -54.09 -27.28 31.85 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.225 1.194 . . . . 2.4700000000000002 114.225 -171.214 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.3 m -68.24 -22.97 27.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 O-C-N 120.759 -1.213 . . . . 3.4199999999999999 113.48 -179.556 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -60.54 -62.83 1.58 Allowed 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 123.704 0.802 . . . . 3.0299999999999998 110.542 171.712 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.8 mp -60.91 -30.93 70.47 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.347 1.059 . . . . 3.6699999999999999 111.404 179.71 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.5 m -59.73 -58.93 6.42 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.958 0.903 . . . . 1.75 111.318 172.167 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 13.6 ptp -65.32 -34.0 77.31 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 118.405 0.548 . . . . 2.9100000000000001 112.228 -178.493 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -54.18 46.42 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.489 1.116 . . . . 4.1500000000000004 110.794 173.557 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 7.6 t -64.3 -33.76 76.57 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.024 0.53 . . . . 2.2999999999999998 112.08 179.741 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.8 mtp -61.46 -44.18 97.55 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 118.957 0.798 . . . . 3.4700000000000002 112.954 168.616 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.45 -40.84 89.65 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.176 0.898 . . . . 2.4500000000000002 111.293 178.66 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -64.27 -22.39 66.93 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 118.77 -0.633 . . . . 3.9100000000000001 112.705 175.098 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -67.44 -40.9 85.47 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 120.146 1.339 . . . . 2.7599999999999998 111.682 174.013 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -71.91 -40.54 68.76 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.976 0.911 . . . . 2.6899999999999999 110.463 178.806 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -52.89 -48.3 67.26 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.142 1.377 . . . . 4.4400000000000004 111.871 170.068 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -58.37 -24.38 59.71 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.992 1.717 . . . . 3.9500000000000002 113.618 179.355 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.2 mp -72.27 -17.79 61.86 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.41 1.005 . . . . 3.5800000000000001 113.37 171.998 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -112.58 6.26 18.31 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 126.889 2.076 . . . . 3.77 114.892 173.985 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 . . . . . 0 CA--C 1.546 0.813 0 O-C-N 120.262 -1.524 . . . . 4.4400000000000004 112.169 162.362 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 71.8 p . . . . . 0 N--CA 1.472 0.659 0 CA-C-O 119.659 -0.21 . . . . 2.6099999999999999 110.938 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.01 -13.07 35.85 Favored 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 122.43 2.086 . . . . 1.6000000000000001 112.757 167.053 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -82.01 -44.14 17.05 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.638 1.175 . . . . 3.6400000000000001 112.986 -179.58 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -57.56 -40.88 79.92 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 122.343 1.068 . . . . 4.3200000000000003 110.045 168.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 49.9 mttm -76.79 -27.84 55.4 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 121.125 -0.985 . . . . 5.3099999999999996 112.259 179.599 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.81 -43.08 80.5 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.876 0.762 . . . . 1.78 111.532 169.257 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 42.9 mt -58.22 -39.02 77.96 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.576 1.15 . . . . 2.5499999999999998 111.12 169.557 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 71.1 m -65.19 -42.59 93.45 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.006 0.922 . . . . 2.1299999999999999 112.131 171.977 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 63.2 m -58.48 -46.45 86.64 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 120.328 1.422 . . . . 2.1000000000000001 111.047 171.152 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 82.3 mtp -57.24 -49.37 76.25 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.531 1.532 . . . . 3.6400000000000001 111.756 173.754 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.73 -27.36 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.188 0.904 . . . . 2.9700000000000002 112.647 177.279 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 94.1 m -67.96 -54.75 16.21 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.127 1.371 . . . . 1.73 110.458 174.012 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.2 p -59.28 -35.95 74.66 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.346 0.975 . . . . 2.4700000000000002 110.702 173.538 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -67.79 -45.72 74.01 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 118.729 -0.653 . . . . 3.5600000000000001 110.96 179.801 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -69.75 -46.78 65.1 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 120.432 1.469 . . . . 2.3700000000000001 111.345 176.42 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -58.69 -44.78 90.37 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.22 1.408 . . . . 6.6600000000000001 113.71 179.306 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -81.14 -19.9 42.48 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 120.641 -1.287 . . . . 3.7599999999999998 112.094 171.235 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 26.9 m -67.79 -22.33 65.19 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 121.112 1.778 . . . . 2.25 112.94 170.207 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.15 7.58 81.78 Favored Glycine 0 CA--C 1.53 1.02 0 C-N-CA 126.467 1.984 . . . . 1.77 114.73 176.216 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 5.0 mmm-85 -76.46 -14.22 60.06 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.477 1.638 . . . . 5.46 113.868 178.897 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 171.28 -174.16 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 129.713 3.205 . . . . 3.2799999999999998 110.852 -176.572 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 62.72 -139.1 44.94 Favored Glycine 0 N--CA 1.472 1.096 0 O-C-N 120.731 -1.231 . . . . 2.4900000000000002 110.651 -179.624 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 8.1 t -82.28 158.89 23.3 Favored 'General case' 0 C--O 1.245 0.819 0 CA-C-N 118.054 0.927 . . . . 5.0300000000000002 110.418 157.012 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.6 51.23 1.44 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.89 1.676 . . . . 7.6299999999999999 111.421 172.476 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 63.3 tp -168.07 -35.05 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 126.878 2.071 . . . . 4.0199999999999996 110.678 -170.431 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 25.6 p -102.98 152.75 20.97 Favored 'General case' 0 C--O 1.248 1.001 0 C-N-CA 126.794 2.038 . . . . 2.6000000000000001 111.622 173.801 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -122.4 78.48 1.51 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.919 1.287 . . . . 3.4199999999999999 110.214 -163.807 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.96 150.51 10.09 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.536 1.935 . . . . 2.8399999999999999 112.967 177.738 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 23.5 ttp85 -40.34 -55.23 2.26 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.547 0.943 . . . . 3.8900000000000001 113.547 178.144 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.22 -27.35 61.93 Favored 'General case' 0 CA--C 1.554 1.116 0 N-CA-C 117.15 2.278 . . . . 4.8600000000000003 117.15 177.655 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -76.6 -52.95 8.72 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.181 1.792 . . . . 1.76 108.022 175.284 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.07 -31.59 69.26 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.095 0.558 . . . . 4.3200000000000003 112.314 -173.192 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . 0.448 ' HZ1' ' CD ' ' B' ' 36' ' ' GLU . 0.0 OUTLIER -68.58 -15.06 63.41 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.154 1.168 . . . . 6.6200000000000001 114.154 175.777 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.448 ' CD ' ' HZ1' ' B' ' 35' ' ' LYS . 0.6 OUTLIER -71.57 -61.95 1.59 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 118.22 -0.895 . . . . 4.0800000000000001 112.555 156.625 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 tt -45.18 -54.0 7.47 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.449 1.499 . . . . 3.0800000000000001 111.577 -174.115 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 11.8 mt -58.6 -68.14 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 119.075 0.852 . . . . 2.3500000000000001 110.448 -173.742 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -12.57 42.94 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 113.546 0.943 . . . . 5.0199999999999996 113.546 -176.513 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.12 -53.77 6.1 Favored 'General case' 0 N--CA 1.444 -0.763 0 O-C-N 120.479 -1.388 . . . . 7.7599999999999998 111.3 165.84 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -75.8 -32.33 59.81 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 120.461 1.482 . . . . 3.73 112.104 -172.998 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -126.1 110.99 14.15 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.985 2.114 . . . . 3.0499999999999998 110.106 168.578 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 29.4 p -99.26 2.43 45.58 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 121.375 -0.828 . . . . 4.8300000000000001 112.706 164.821 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 7.2 mp -77.01 155.3 32.67 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.081 0.953 . . . . 4.6200000000000001 112.263 -160.825 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.52 -73.8 1.13 Allowed Glycine 0 N--CA 1.469 0.875 0 C-N-CA 124.709 1.147 . . . . 6.7300000000000004 110.774 -175.073 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -154.71 7.37 0.29 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.164 1.386 . . . . 5.5700000000000003 113.458 165.289 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 5.7 tpt -50.07 117.65 2.46 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.287 1.435 . . . . 3.6099999999999999 114.075 -156.231 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 ttmp? -164.09 162.56 23.04 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.344 1.457 . . . . 4.7800000000000002 110.162 -161.45 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.77 3.51 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 116.653 2.094 . . . . 4.9800000000000004 116.653 170.5 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 2.6 p -73.75 -42.9 60.45 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 119.834 -1.791 . . . . 6.79 113.666 159.25 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 2.8 p -103.92 -16.28 15.4 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.299 1.839 . . . . 3.2599999999999998 113.572 -176.284 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 30.1 mt -71.81 -34.17 50.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 N-CA-C 114.621 1.341 . . . . 2.8399999999999999 114.621 -176.588 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.09 -29.99 65.97 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 120.464 1.484 . . . . 2.8599999999999999 112.301 -174.204 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -71.24 -45.16 63.87 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.421 1.489 . . . . 2.4700000000000002 112.142 169.829 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 53.4 tp -56.87 -51.09 70.4 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 124.251 1.02 . . . . 3.3199999999999998 109.977 173.093 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 8.6 tpt -52.66 -48.74 66.26 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 127.095 2.158 . . . . 2.2400000000000002 111.861 175.868 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.39 -27.28 62.19 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.741 0.816 . . . . 4.5099999999999998 113.186 172.206 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 58' ' ' SER . . . . . 0.413 ' O ' ' HE3' ' B' ' 61' ' ' LYS . 9.3 t -87.8 -30.3 20.34 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.242 1.417 . . . . 2.5600000000000001 113.396 176.74 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 30.5 mt -67.94 -49.15 63.48 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 121.223 -0.923 . . . . 3.0800000000000001 110.605 171.555 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -81.51 81.05 7.74 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 122.895 1.331 . . . . 1.54 112.562 -173.523 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . 0.413 ' HE3' ' O ' ' B' ' 58' ' ' SER . 1.6 mptm? -61.36 -17.04 52.09 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 114.257 1.206 . . . . 3.9100000000000001 114.257 178.607 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -78.3 -33.27 49.46 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.097 0.862 . . . . 2.9199999999999999 112.915 171.105 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 57.8 m 54.35 56.78 6.5 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.437 1.495 . . . . 3.3599999999999999 111.526 -159.662 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 9.3 p30 -101.21 -72.58 0.67 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.572 1.149 . . . . 2.3599999999999999 109.656 -172.042 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 167.62 -25.71 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.831 1 C-N-CA 133.386 4.674 . . . . 6.4299999999999997 113.854 -177.886 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -125.31 133.76 52.5 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 126.624 1.97 . . . . 2.5800000000000001 110.458 -171.091 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 34.1 mt -87.88 112.14 23.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 122.118 0.961 . . . . 2.4100000000000001 109.572 173.876 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.75 163.09 27.91 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.535 1.934 . . . . 2.5600000000000001 111.085 166.527 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -57.1 -37.76 72.4 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 120.866 -1.147 . . . . 3.6000000000000001 113.803 -176.871 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 5.0 mtmp? -77.9 -29.68 50.27 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 120.476 -1.39 . . . . 3.9500000000000002 112.343 177.257 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -60.86 -52.05 66.7 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-N 119.911 1.232 . . . . 1.8600000000000001 108.866 163.229 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -58.0 -29.36 65.22 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 119.61 -1.931 . . . . 3.27 114.186 -179.436 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 32.7 p -58.27 -26.14 62.61 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.397 -1.439 . . . . 3.48 113.802 171.851 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 47.3 t -64.74 -44.98 96.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.042 0.937 . . . . 2.9900000000000002 109.953 172.939 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -58.12 -54.88 41.94 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 119.103 -0.475 . . . . 2.6200000000000001 111.115 176.805 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 91.4 mt -52.99 -45.74 67.99 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.169 0.987 . . . . 3.1499999999999999 111.791 -179.748 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 25.3 m -64.11 -51.1 65.58 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.107 0.563 . . . . 2.0099999999999998 112.286 -179.206 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 67.9 mtm -62.69 -39.69 94.79 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 118.245 0.475 . . . . 2.3500000000000001 111.729 -179.367 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.38 -48.45 67.38 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.353 0.661 . . . . 3.8799999999999999 111.719 179.381 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 84.6 m -65.91 -28.47 68.96 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.079 0.77 . . . . 2.7400000000000002 113.079 179.657 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 48.0 mtm -72.69 -31.46 65.04 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.034 1.124 . . . . 4.0199999999999996 114.034 169.205 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.67 -43.15 56.71 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.861 1.209 . . . . 1.97 112.033 173.738 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.89 -15.64 23.02 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.531 1.308 . . . . 3.6099999999999999 114.531 172.877 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -66.12 -38.12 87.42 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.514 0.726 . . . . 3.7400000000000002 112.099 172.228 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -90.09 -25.48 20.74 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.736 1.214 . . . . 3.5099999999999998 112.657 -179.12 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.97 -18.9 61.98 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 124.925 1.29 . . . . 4.6500000000000004 112.43 167.9 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -88.57 -16.49 32.44 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.387 1.875 . . . . 4.2400000000000002 112.801 168.903 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 87.7 mt -94.99 -32.15 13.29 Favored 'General case' 0 C--O 1.222 -0.395 0 CA-C-O 116.999 -1.477 . . . . 3.6200000000000001 112.792 -179.951 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -55.48 -25.31 36.19 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 120.297 1.408 . . . . 8.0899999999999999 114.022 168.158 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -81.38 -53.74 6.06 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 128.245 2.618 . . . . 3.3100000000000001 112.492 168.498 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -77.73 -16.9 58.12 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 116.701 2.112 . . . . 3.23 116.701 -170.444 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? . . . . . 0 N--CA 1.469 0.498 0 N-CA-C 119.818 3.266 . . . . 6.6900000000000004 119.818 -159.767 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.427 ' HB2' ' H ' ' A' ' 3' ' ' THR . 0.2 OUTLIER . . . . . 0 CA--C 1.543 0.692 0 N-CA-C 106.15 -1.796 . . . . 3.9900000000000002 106.15 . . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' THR . . . . . 0.427 ' H ' ' HB2' ' A' ' 2' ' ' GLU . 72.9 p -152.19 169.77 9.02 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 128.264 2.626 . . . . 2.5800000000000001 108.829 -168.921 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.89 -37.46 3.67 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 CA-C-N 120.73 1.296 . . . . 1.96 111.372 167.612 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 26.4 mt -62.87 -49.68 73.9 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-O 117.729 -1.129 . . . . 4.4400000000000004 112.792 -174.916 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -38.34 66.76 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.955 1.252 . . . . 4.4500000000000002 111.057 -178.839 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -73.86 -42.79 60.28 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 120.361 -1.462 . . . . 4.3099999999999996 113.431 171.475 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -75.13 -30.81 60.92 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 114.717 1.377 . . . . 3.29 114.717 -174.782 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.3 mt -67.49 -35.57 79.41 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.908 1.683 . . . . 2.9700000000000002 110.066 166.958 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 56.9 m -67.96 -36.2 79.66 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 118.139 -0.934 . . . . 3.04 111.038 170.893 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.9 m -56.61 -41.4 76.98 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 120.004 1.274 . . . . 2.9900000000000002 111.3 167.38 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.5 tpt -63.34 -44.6 94.41 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.586 0.754 . . . . 5.3300000000000001 112.465 172.835 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 37.5 t -61.83 -33.65 58.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 O-C-N 120.478 -1.388 . . . . 3.3100000000000001 112.229 173.958 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.9 m -71.24 -41.63 69.88 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.828 1.651 . . . . 2.3599999999999999 112.183 -177.804 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.0 p -69.0 -37.61 78.79 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 117.966 -1.016 . . . . 3.1099999999999999 109.193 167.904 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -59.69 -57.16 14.12 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.462 0.574 . . . . 3.0899999999999999 111.147 -173.538 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -59.57 -50.0 75.57 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-O 122.274 1.035 . . . . 3.0699999999999998 111.594 178.097 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -57.8 -34.14 69.31 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.923 -1.111 . . . . 4.1699999999999999 113.683 -178.695 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -97.0 -19.81 18.5 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.992 1.317 . . . . 3.2000000000000002 112.472 177.137 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.4 p -71.11 -29.51 65.37 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-N 121.624 2.011 . . . . 3.2599999999999998 111.952 171.081 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.24 -8.99 80.7 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 126.854 2.168 . . . . 1.8700000000000001 115.217 173.657 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.3 ttm-85 -66.18 -23.38 66.45 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 119.194 1.497 . . . . 5.1399999999999997 113.574 -177.948 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -166.72 158.78 13.32 Favored 'General case' 0 C--O 1.247 0.95 0 C-N-CA 124.404 1.082 . . . . 4.9800000000000004 112.468 -174.672 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.71 -134.25 52.42 Favored Glycine 0 C--N 1.339 0.743 0 C-N-CA 125.268 1.413 . . . . 2.7799999999999998 111.234 172.201 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.9 m -62.52 139.71 58.61 Favored 'General case' 0 C--O 1.246 0.918 0 O-C-N 121.824 -0.81 . . . . 4.04 110.697 165.364 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -89.51 -20.12 24.22 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 115.332 1.605 . . . . 6.9800000000000004 115.332 -171.065 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -81.27 -18.76 44.82 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.285 1.034 . . . . 6.1900000000000004 112.793 168.091 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.84 157.1 34.92 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 125.262 1.425 . . . . 1.78 114.25 -169.553 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 88.3 mt -99.44 112.91 25.02 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.283 1.833 . . . . 2.8300000000000001 110.606 -177.085 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.35 168.55 16.52 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.983 1.313 . . . . 3.3799999999999999 112.526 170.611 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -51.46 -22.85 3.36 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 127.53 2.332 . . . . 5.1500000000000004 116.316 -175.442 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.68 -39.68 8.55 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 121.178 -0.951 . . . . 4.7000000000000002 112.96 173.972 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -48.29 -48.07 36.01 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.134 0.973 . . . . 1.6200000000000001 110.912 168.011 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.4 -48.38 67.53 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.91 1.284 . . . . 3.2200000000000002 112.444 178.306 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -51.96 -43.91 63.75 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.479 -1.388 . . . . 4.46 112.643 174.407 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -68.18 -43.28 78.49 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.706 1.203 . . . . 3.2799999999999998 111.719 177.705 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.6 mt -53.43 -53.68 47.84 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.783 1.174 . . . . 3.8500000000000001 112.926 175.17 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.2 mt -55.15 -48.97 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.137 0.88 . . . . 2.2200000000000002 110.686 -178.481 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -64.94 -27.31 68.76 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 112.586 0.588 . . . . 4.8600000000000003 112.586 -176.738 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -87.62 -48.66 7.72 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.922 1.689 . . . . 3.5099999999999998 112.518 -179.068 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -73.34 -50.59 21.2 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.482 1.513 . . . . 4.4800000000000004 111.946 -175.26 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -95.59 61.73 2.31 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.498 1.519 . . . . 3.75 109.313 -177.458 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.6 t -63.64 5.17 0.21 Allowed 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 126.05 1.74 . . . . 3.8300000000000001 115.552 -173.927 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.0 mp -69.87 -24.23 63.39 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.163 1.785 . . . . 5.3899999999999997 111.968 166.926 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.17 -108.39 3.67 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 125.013 1.292 . . . . 4.8700000000000001 112.211 171.706 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.417 ' CD ' ' HZ3' ' A' ' 48' ' ' LYS . 7.3 tp10 62.27 -75.65 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.843 2.057 . . . . 5.3700000000000001 112.17 -167.526 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.44 107.44 0.11 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 127.124 2.17 . . . . 2.71 115.318 -159.095 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.417 ' HZ3' ' CD ' ' A' ' 46' ' ' GLU . 1.2 mptt -67.48 151.31 47.59 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.12 0.968 . . . . 5.9000000000000004 109.811 168.752 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -60.69 -33.7 73.24 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 116.027 1.862 . . . . 3.73 116.027 -159.757 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.4 t -84.23 -16.72 42.24 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 114.145 1.165 . . . . 3.3100000000000001 114.145 171.941 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.4 t -76.2 -21.32 56.6 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.259 1.39 . . . . 3.2200000000000002 112.074 174.606 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 21.9 mm -55.92 -40.7 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 124.056 0.943 . . . . 2.8399999999999999 110.994 163.546 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -69.67 -39.55 76.93 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 123.423 0.689 . . . . 3.3999999999999999 110.609 -172.88 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.98 -33.86 68.47 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.167 0.987 . . . . 2.7200000000000002 113.331 171.935 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.9 -56.55 20.59 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-N 118.831 0.741 . . . . 3.6699999999999999 109.828 171.017 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.6 ptm -71.95 -25.52 61.91 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.918 1.081 . . . . 3.2999999999999998 113.918 -176.804 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.5 ttmp? -64.6 -24.96 67.76 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.316 1.046 . . . . 5.2400000000000002 111.939 168.657 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.3 t -78.29 -25.35 46.61 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.035 1.124 . . . . 2.8199999999999998 114.035 168.3 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.5 mp -73.95 -53.85 9.19 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.174 0.99 . . . . 3.6400000000000001 113.324 178.597 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -75.45 81.92 2.51 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 122.355 1.074 . . . . 1.8200000000000001 112.295 -169.881 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.7 tmtp? -62.19 -7.46 4.18 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 115.118 1.525 . . . . 6.4100000000000001 115.118 -171.141 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.13 -26.69 13.86 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.838 1.655 . . . . 3.2400000000000002 112.913 172.365 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.1 m 57.84 32.46 21.95 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.322 1.049 . . . . 4.1100000000000003 112.902 -160.9 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 p30 -75.55 -6.42 50.21 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.779 0.832 . . . . 3.4900000000000002 111.876 166.433 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.35 -3.9 2.46 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 129.505 3.122 . . . . 4.6900000000000004 113.425 171.977 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -106.85 121.4 44.33 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 123.484 1.612 . . . . 2.8100000000000001 110.123 166.565 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 49.9 mt -81.29 103.6 8.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 123.013 1.387 . . . . 2.6699999999999999 108.721 178.517 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.79 151.01 30.56 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 112.844 -1.98 . . . . 4.0300000000000002 109.45 178.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.19 -38.14 70.56 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 120.611 -1.306 . . . . 4.0499999999999998 113.375 -177.474 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -59.18 -22.22 60.63 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.335 2.254 . . . . 5.1699999999999999 115.787 172.256 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -94.83 -47.45 6.45 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.248 1.419 . . . . 3.46 109.81 173.091 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -51.36 -26.14 7.2 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 127.432 2.293 . . . . 3.5499999999999998 115.845 -170.853 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 47.3 p -64.18 -18.7 64.73 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 120.155 -1.591 . . . . 2.8500000000000001 113.295 175.839 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.5 m -63.95 -24.22 35.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 119.54 1.064 . . . . 3.6499999999999999 112.822 170.385 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -60.05 -57.23 13.74 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.633 1.173 . . . . 3.27 111.423 173.538 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.6 mp -55.59 -41.07 72.86 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 125.827 1.651 . . . . 4.2199999999999998 110.56 173.332 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 44.3 m -61.14 -50.9 71.31 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 117.172 -1.394 . . . . 1.79 111.742 178.826 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 2.5 mpp? -52.42 -45.89 66.12 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 120.865 1.666 . . . . 2.8300000000000001 111.562 174.735 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 46.5 mt -69.69 -49.25 55.23 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.624 0.77 . . . . 2.1200000000000001 111.444 -175.716 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 99.3 m -65.37 -30.21 71.01 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.614 0.968 . . . . 2.2599999999999998 113.614 176.654 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 69.3 mtp -70.17 -37.0 75.07 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 120.01 1.277 . . . . 2.5899999999999999 111.203 171.874 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.64 -37.05 84.01 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.181 0.901 . . . . 1.74 112.616 173.102 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.0 m-30 -68.25 -23.33 64.77 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.987 0.915 . . . . 3.5499999999999998 112.575 174.6 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -68.0 -48.5 65.58 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.438 0.695 . . . . 3.54 111.52 174.571 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -62.49 -43.11 99.62 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.968 1.707 . . . . 2.6600000000000001 111.643 178.673 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.43 -45.52 65.99 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.303 1.441 . . . . 3.4399999999999999 111.964 174.174 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -66.79 -27.76 67.83 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.803 1.241 . . . . 4.0700000000000003 112.533 178.69 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 84.4 mt -78.01 -17.65 56.85 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.581 1.152 . . . . 2.5899999999999999 113.511 175.829 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -101.35 1.44 38.54 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 114.485 1.291 . . . . 2.8199999999999998 114.485 173.725 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 21.1 t70 . . . . . 0 CA--C 1.541 0.617 0 C-N-CA 125.06 1.344 . . . . 4.1200000000000001 111.729 171.169 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.4 p . . . . . 0 C--O 1.238 0.486 0 N-CA-C 109.351 -0.611 . . . . 2.9199999999999999 109.351 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -71.65 -13.71 29.95 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.877 2.385 . . . . 2.0499999999999998 111.886 163.88 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 8.8 tt -76.34 -42.95 43.15 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 123.916 0.887 . . . . 4.0700000000000003 111.322 177.501 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -60.52 -30.29 69.64 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 118.617 0.644 . . . . 4.1500000000000004 111.28 177.032 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.48 -25.75 38.66 Favored 'General case' 0 CA--C 1.548 0.869 0 O-C-N 120.786 -1.196 . . . . 4.5899999999999999 114.166 169.334 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.19 -42.58 99.42 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.012 -1.055 . . . . 2.6000000000000001 111.301 171.255 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 41.1 mt -69.71 -36.63 76.07 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.638 1.175 . . . . 2.6299999999999999 111.441 -175.02 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.79 -47.01 67.21 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.821 0.848 . . . . 2.5899999999999999 112.002 168.268 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.3 t -65.44 -25.06 67.35 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 120.093 1.315 . . . . 4.0499999999999998 111.966 -178.571 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 85.9 mtp -59.2 -60.11 4.38 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.143 0.977 . . . . 3.5899999999999999 110.869 169.479 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 28.1 m -61.78 -22.95 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 120.378 -1.451 . . . . 3.2400000000000002 113.112 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 90.5 m -75.48 -40.15 57.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 126.269 1.828 . . . . 1.8500000000000001 113.185 178.7 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 10.7 p -75.33 -35.29 61.22 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.112 1.323 . . . . 2.1499999999999999 109.923 169.25 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -54.28 -61.38 2.34 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.85 0.86 . . . . 3.4700000000000002 109.91 -179.273 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 42.4 m170 -71.15 -24.86 62.34 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 115.005 1.483 . . . . 3.5099999999999998 115.005 178.672 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -70.19 -33.92 72.32 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 122.026 2.194 . . . . 4.8300000000000001 113.657 174.199 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -92.0 -36.18 13.55 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.155 0.889 . . . . 3.2799999999999998 112.479 175.765 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 20' ' ' SER . . . . . 0.414 ' HG ' ' C ' ' B' ' 27' ' ' LEU . 26.5 t -64.83 -29.75 70.72 Favored 'General case' 0 C--O 1.247 0.963 0 N-CA-C 113.844 1.053 . . . . 2.2400000000000002 113.844 171.355 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.29 -12.24 84.77 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 126.583 2.04 . . . . 1.6699999999999999 114.675 178.893 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -76.88 -44.6 31.35 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 118.783 1.292 . . . . 4.2400000000000002 112.361 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -123.65 144.57 49.55 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 118.768 0.713 . . . . 3.2000000000000002 111.888 -171.35 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.77 -129.69 30.66 Favored Glycine 0 C--N 1.341 0.845 0 C-N-CA 125.628 1.585 . . . . 2.52 112.791 175.528 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 12.0 t -57.62 132.47 53.32 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.609 0.719 . . . . 4.2699999999999996 110.578 166.218 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -80.89 -12.75 59.36 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.575 1.15 . . . . 8.2400000000000002 113.938 177.729 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.414 ' C ' ' HG ' ' B' ' 20' ' ' SER . 57.5 tp -84.17 -39.98 18.72 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.62 1.168 . . . . 3.6499999999999999 111.116 171.011 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 3.1 p -108.0 148.77 29.26 Favored 'General case' 0 C--O 1.253 1.256 0 C-N-CA 125.495 1.518 . . . . 2.1200000000000001 113.421 -173.208 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 2.4 pp -122.56 112.04 17.52 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 113.104 -1.862 . . . . 3.1299999999999999 111.48 -174.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 79.9 p -97.12 -170.02 1.96 Allowed 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 122.144 0.973 . . . . 2.7799999999999998 113.392 -178.989 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 25.6 ttt-85 -56.08 -8.12 0.43 Allowed 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 117.948 2.573 . . . . 4.4199999999999999 117.948 -172.349 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.89 -50.73 3.75 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 113.734 1.012 . . . . 5.0 113.734 164.295 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -54.69 -34.06 61.77 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.771 1.228 . . . . 1.9199999999999999 112.029 178.015 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 54.6 tp -70.23 -49.4 50.43 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.28 1.032 . . . . 2.8399999999999999 112.335 174.548 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -78.83 -24.4 44.46 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.373 -1.454 . . . . 4.9800000000000004 114.65 -174.021 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -46.26 -71.68 0.07 Allowed 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 117.802 -1.094 . . . . 3.23 110.503 149.903 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.18 -57.75 6.18 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.612 1.165 . . . . 2.75 113.215 -175.726 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 22.8 mt -53.98 -44.98 63.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 119.269 0.94 . . . . 1.97 110.13 -176.558 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 22.9 mmmt -74.56 -5.61 43.82 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.559 1.318 . . . . 6.25 114.559 -179.847 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 8.7 mmtp -102.78 -22.11 13.95 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 120.749 1.613 . . . . 4.8700000000000001 113.699 168.351 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -91.02 -87.9 0.19 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.315 1.046 . . . . 3.8700000000000001 108.491 170.875 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -77.37 37.77 0.22 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.099 1.76 . . . . 3.0 112.842 -175.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 39.8 t -51.05 -27.64 8.51 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.645 1.978 . . . . 4.0800000000000001 113.488 178.604 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . 0.483 ' H ' HD11 ' B' ' 44' ' ' LEU . 3.3 mp -60.16 -37.06 79.01 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.369 2.268 . . . . 5.4000000000000004 113.641 178.92 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -81.83 40.53 2.65 Favored Glycine 0 N--CA 1.473 1.131 0 C-N-CA 124.798 1.19 . . . . 4.5800000000000001 113.983 -169.107 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . 0.266 6.2 pt-20 46.08 -68.67 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 129.521 3.128 . . . . 4.96 114.928 -165.288 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 6.9 mmt 59.16 60.82 2.26 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 124.672 2.177 . . . . 3.0299999999999998 113.235 173.074 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.3 mppt? -65.51 159.46 24.44 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 111.604 -2.544 . . . . 4.2699999999999996 111.489 168.256 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.56 -41.85 6.83 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 128.275 2.63 . . . . 5.8600000000000003 115.66 -170.202 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 6.0 t -91.35 -32.97 15.47 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.456 1.102 . . . . 3.8300000000000001 113.151 177.405 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 35.9 t -62.74 -33.83 75.94 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 120.204 -1.56 . . . . 2.5499999999999998 111.398 174.074 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 3.7 mm -59.97 -38.42 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 126.974 2.11 . . . . 2.5499999999999998 112.878 166.815 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.85 -31.02 24.02 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 124.791 1.236 . . . . 2.7000000000000002 111.472 -168.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.513 ' CG ' ' HZ2' ' B' ' 57' ' ' LYS . 16.9 m-20 -81.67 -30.97 32.46 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.201 1.401 . . . . 4.6699999999999999 111.645 170.468 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 16.0 tp -57.74 -45.61 85.61 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.525 -0.75 . . . . 2.96 110.061 162.355 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 3.2 ttt -58.68 -41.91 87.3 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-O 118.069 -0.967 . . . . 2.9300000000000002 113.279 173.66 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . 0.513 ' HZ2' ' CG ' ' B' ' 54' ' ' ASP . 31.0 mttp -61.02 -29.48 69.74 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 120.358 1.435 . . . . 5.7199999999999998 112.134 176.455 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 2.2 p -79.21 -37.34 38.42 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.258 0.836 . . . . 3.3700000000000001 113.258 173.643 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.85 -53.15 29.01 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 125.828 1.651 . . . . 3.3900000000000001 110.603 179.733 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -76.85 68.08 3.0 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 123.671 1.7 . . . . 1.6299999999999999 111.19 -179.317 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . 0.436 ' HZ1' ' CG2' ' B' ' 74' ' ' VAL . 2.4 ttmp? -53.0 -26.51 15.6 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.905 2.482 . . . . 4.6299999999999999 114.03 178.827 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -73.5 -34.39 65.27 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 118.199 -0.905 . . . . 3.1499999999999999 112.873 171.744 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 65.8 m 53.54 65.49 1.5 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.609 1.164 . . . . 4.3099999999999996 111.388 -157.841 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -110.34 -74.2 0.66 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.78 1.232 . . . . 2.5800000000000001 109.893 -175.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 173.58 -25.23 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 131.362 3.865 . . . . 7.2599999999999998 112.765 -178.096 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -132.28 142.6 49.44 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 127.131 2.172 . . . . 3.5099999999999998 111.443 -169.342 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 46.5 mm -83.23 110.29 17.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 125.15 1.38 . . . . 2.2400000000000002 109.383 172.937 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -74.45 163.18 28.08 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.86 1.664 . . . . 3.0800000000000001 110.557 161.552 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.62 -36.31 78.31 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 120.16 -1.588 . . . . 4.1600000000000001 112.627 178.446 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -71.89 -15.78 62.12 Favored 'General case' 0 CA--C 1.556 1.194 0 O-C-N 120.631 -1.293 . . . . 7.3700000000000001 111.876 177.433 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -81.14 -58.8 2.9 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.293 1.437 . . . . 1.8700000000000001 108.898 164.172 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -45.93 -45.3 15.37 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.344 2.257 . . . . 3.0600000000000001 114.032 -175.532 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 56.3 m -53.76 -27.52 29.22 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.291 0.849 . . . . 2.5299999999999998 113.291 178.477 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . 0.436 ' CG2' ' HZ1' ' B' ' 61' ' ' LYS . 87.5 t -62.16 -36.53 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 119.995 1.271 . . . . 2.7400000000000002 111.211 178.959 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -51.45 -62.08 1.84 Allowed 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.446 0.698 . . . . 2.6800000000000002 111.062 174.135 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 77.9 mt -72.61 -22.72 60.92 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.993 0.917 . . . . 3.0899999999999999 112.328 -175.483 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.7 m -60.62 -56.16 24.69 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.631 1.173 . . . . 1.79 110.197 169.378 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 58.1 mtm -55.58 -42.32 74.61 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 118.299 0.5 . . . . 2.5299999999999998 112.099 -179.507 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 31.1 mt -71.18 -40.01 71.49 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.688 0.795 . . . . 2.29 112.366 -177.145 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 14.7 t -64.42 -34.12 77.44 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.88 0.696 . . . . 3.2400000000000002 112.88 177.458 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 2.9 mtm -70.96 -36.59 72.63 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.596 -0.69 . . . . 4.4900000000000002 112.012 170.161 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.68 -34.66 78.36 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.76 1.164 . . . . 1.98 112.755 175.383 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -68.43 -35.6 77.84 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 119.182 0.901 . . . . 3.8100000000000001 112.343 171.922 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -64.93 -41.58 95.4 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.179 0.992 . . . . 2.5299999999999998 112.633 173.95 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -72.47 -29.78 63.96 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.043 0.937 . . . . 3.5600000000000001 111.347 179.054 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -58.75 -52.16 66.91 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.201 1.0 . . . . 3.3999999999999999 111.094 167.731 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -58.24 -32.62 68.51 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.161 1.385 . . . . 4.0300000000000002 112.13 -179.869 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 42.4 mt -72.34 -16.24 61.87 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.468 1.285 . . . . 2.73 114.468 175.972 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . 0.521 ' CD ' ' HZ3' ' B' ' 92' ' ' LYS . 72.8 mm-40 -97.95 -18.23 18.76 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.743 1.217 . . . . 4.5 113.839 172.915 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -101.17 -40.79 7.01 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.21 1.804 . . . . 2.9300000000000002 113.268 -169.282 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -89.34 24.23 2.28 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 124.598 1.159 . . . . 2.8500000000000001 112.989 177.65 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . 0.521 ' HZ3' ' CD ' ' B' ' 89' ' ' GLU . 38.4 mttp . . . . . 0 C--O 1.246 0.916 0 C-N-CA 126.828 2.051 . . . . 4.7000000000000002 115.14 174.496 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 . . . . . 0 CA--C 1.535 0.388 0 N-CA-C 109.215 -0.661 . . . . 4.3899999999999997 109.215 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.4 p -136.05 153.24 76.71 Favored Pre-proline 0 N--CA 1.468 0.461 0 C-N-CA 124.814 1.246 . . . . 2.7400000000000002 108.145 169.912 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.18 -17.75 59.45 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.221 1.947 . . . . 1.53 112.486 176.333 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 17.1 tp -85.74 -44.64 12.35 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 118.044 -0.979 . . . . 4.0899999999999999 112.524 -179.09 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -58.2 -49.47 76.95 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.84 1.2 . . . . 4.0499999999999998 109.48 165.615 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -29.9 67.19 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.473 -0.767 . . . . 5.3499999999999996 112.213 178.767 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.8 -51.2 58.5 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 117.449 -1.262 . . . . 1.8500000000000001 112.112 172.369 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.7 mt -55.85 -48.3 75.76 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 120.208 1.367 . . . . 2.29 111.01 174.94 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 36.9 m -52.81 -49.93 64.67 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 125.175 1.39 . . . . 2.2000000000000002 110.405 173.292 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 86.4 m -61.38 -45.8 92.85 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 120.077 1.308 . . . . 2.48 112.494 177.858 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 79.0 mtp -54.24 -48.45 71.1 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.427 1.091 . . . . 3.8100000000000001 111.711 175.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 78.0 t -78.53 -33.81 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.484 0.714 . . . . 3.8199999999999998 112.059 -176.405 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.1 m -56.37 -55.84 28.53 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.458 1.103 . . . . 2.3300000000000001 110.322 170.28 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.8 t -67.84 -33.35 74.6 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 117.376 -1.297 . . . . 3.1099999999999999 110.15 -172.822 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -55.17 -48.88 73.15 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.702 0.683 . . . . 2.8799999999999999 111.504 172.962 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 23.1 m170 -64.68 -34.95 79.52 Favored 'General case' 0 CA--C 1.549 0.925 0 O-C-N 120.863 -1.148 . . . . 3.9900000000000002 112.736 178.291 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.4 tmtm? -61.12 -25.22 66.83 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.692 1.197 . . . . 6.7000000000000002 113.503 173.468 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -88.27 -30.51 19.6 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 120.677 -1.264 . . . . 4.5599999999999996 112.084 168.924 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.5 p -60.26 -19.5 55.03 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 117.425 2.38 . . . . 4.21 117.425 -172.092 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.61 -7.67 53.33 Favored Glycine 0 CA--C 1.537 1.412 0 CA-C-O 118.394 -1.226 . . . . 1.75 115.721 -178.893 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 88.5 mtt-85 -77.54 53.07 1.03 Allowed 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 120.278 2.039 . . . . 6.1100000000000003 112.785 176.197 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.468 ' CD ' ' HZ2' ' A' ' 32' ' ' LYS . 19.1 tt0 121.2 175.33 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 131.221 3.808 . . . . 4.1100000000000003 108.945 -176.031 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 9.68 113.18 0.0 OUTLIER Glycine 0 N--CA 1.481 1.66 0 C-N-CA 128.615 3.007 . . . . 2.6699999999999999 117.964 178.187 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.3 m 69.86 155.51 0.13 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.59 1.156 . . . . 3.5600000000000001 113.69 166.153 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -101.05 52.26 0.85 Allowed 'General case' 0 N--CA 1.483 1.194 0 O-C-N 120.541 -1.35 . . . . 6.21 111.136 171.883 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 tt -161.03 -58.3 0.05 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.345 1.058 . . . . 4.1500000000000004 112.338 -172.515 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.451 ' HG1' ' CD ' ' A' ' 66' ' ' GLU . 20.9 p -84.64 156.07 21.7 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 127.453 2.301 . . . . 2.3500000000000001 113.284 -173.883 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 18.6 mt -92.07 94.77 9.41 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 114.704 -1.134 . . . . 2.5499999999999998 109.303 161.05 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.0 m -74.37 133.55 42.49 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 125.231 1.413 . . . . 3.9199999999999999 109.304 170.486 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -0.12 -70.34 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 127.687 2.395 . . . . 5.1799999999999997 117.107 -173.476 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.468 ' HZ2' ' CD ' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -62.56 -36.68 83.43 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 119.481 -2.012 . . . . 4.9400000000000004 114.539 -175.583 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -57.74 -41.63 82.23 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.846 1.659 . . . . 2.77 110.563 175.518 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -66.05 -40.67 91.15 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.755 1.222 . . . . 3.71 110.711 178.944 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.1 mtpt -65.3 -41.55 93.99 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 120.712 -1.242 . . . . 4.0999999999999996 113.154 175.327 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -56.23 -51.46 68.01 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-O 117.995 -1.002 . . . . 5.0800000000000001 112.543 170.075 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -52.61 -57.64 9.36 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.078 0.854 . . . . 3.9100000000000001 111.154 -178.506 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 46.0 mt -54.43 -46.35 70.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 118.367 0.531 . . . . 1.9099999999999999 110.784 -178.807 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.42 ' HZ2' ' CD ' ' A' ' 49' ' ' GLU . 98.2 mttt -70.08 -9.6 55.96 Favored 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 113.767 1.025 . . . . 5.3799999999999999 113.767 -176.624 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.38 -13.34 9.79 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.527 1.931 . . . . 5.1799999999999997 113.15 -178.089 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -71.45 -51.91 21.32 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.801 1.641 . . . . 4.5599999999999996 108.776 158.062 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -115.81 124.18 50.08 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.471 2.309 . . . . 3.7599999999999998 108.439 179.779 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 62.0 m -107.27 -8.86 16.24 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.767 1.025 . . . . 4.7699999999999996 113.767 -178.68 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -60.99 154.77 21.67 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 119.559 1.072 . . . . 4.7400000000000002 113.409 172.172 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -72.85 11.88 4.2 Favored Glycine 0 CA--C 1.537 1.423 0 N-CA-C 116.281 1.273 . . . . 4.6200000000000001 116.281 -169.315 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -85.45 -27.03 25.98 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.964 2.105 . . . . 5.6900000000000004 112.08 178.366 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.69 86.92 7.34 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 123.2 1.476 . . . . 2.71 112.151 -178.518 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 72.7 mttt -132.14 170.63 14.72 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 127.662 2.385 . . . . 5.9299999999999997 111.245 -177.552 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.42 ' CD ' ' HZ2' ' A' ' 39' ' ' LYS . 0.5 OUTLIER -53.96 -46.8 71.71 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.293 -0.88 . . . . 4.2000000000000002 113.039 -164.81 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.8 m -63.04 -25.49 68.4 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.366 1.617 . . . . 3.1200000000000001 115.366 176.403 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.6 p -94.56 6.78 47.8 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.513 1.125 . . . . 3.52 112.735 171.554 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 28.2 mt -125.32 -35.48 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.885 1.274 . . . . 2.3399999999999999 113.448 -173.546 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -82.55 -29.47 30.31 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.478 1.035 . . . . 3.9700000000000002 112.244 179.27 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -66.62 -45.09 80.23 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 118.513 0.597 . . . . 2.46 110.052 158.683 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.5 tp -59.75 -39.38 84.57 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 118.552 -0.737 . . . . 2.75 110.636 -177.806 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.1 tpt -51.75 -59.5 4.23 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 119.241 0.928 . . . . 2.6499999999999999 109.996 165.853 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.19 -19.16 19.04 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 125.808 1.643 . . . . 4.8700000000000001 115.008 176.367 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.8 m -98.98 -29.42 12.93 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.723 2.009 . . . . 3.7799999999999998 113.515 -178.006 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 97.5 mt -83.27 -42.81 16.76 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.494 1.518 . . . . 2.9199999999999999 111.814 170.873 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -73.76 81.28 1.59 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.418 2.287 . . . . 2.0099999999999998 111.663 -175.694 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -51.7 -32.45 30.06 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 115.247 1.573 . . . . 4.2400000000000002 115.247 -173.014 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -81.88 -11.96 58.67 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.973 1.101 . . . . 2.6600000000000001 113.973 178.793 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.8 t 55.4 45.53 25.16 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.558 1.143 . . . . 3.1400000000000001 111.72 -169.387 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -102.33 -131.89 0.27 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.575 1.95 . . . . 2.96 107.796 178.876 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -142.47 1.06 1.34 Allowed 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 120.337 1.426 . . . . 4.4100000000000001 114.741 164.326 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.451 ' CD ' ' HG1' ' A' ' 28' ' ' THR . 5.5 mm-40 -103.07 134.17 46.95 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 126.485 1.914 . . . . 2.3500000000000001 109.324 173.548 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.7 mm -96.47 114.06 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 126.581 1.952 . . . . 2.6000000000000001 109.914 171.965 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -88.77 157.2 18.57 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.879 1.271 . . . . 2.6899999999999999 108.759 163.401 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -49.85 -42.17 46.82 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.326 -1.484 . . . . 3.8399999999999999 114.44 -177.394 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -11.43 60.85 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 114.524 1.305 . . . . 3.9399999999999999 114.524 176.791 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -84.84 -56.06 3.77 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 124.929 1.292 . . . . 1.8 108.004 162.157 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -50.02 -45.14 51.71 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.192 1.797 . . . . 3.75 115.771 -176.209 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.9 m -65.03 -8.61 16.84 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 120.793 -1.192 . . . . 2.3500000000000001 113.468 -177.313 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 99.7 t -62.24 -37.02 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 119.585 1.084 . . . . 3.1899999999999999 110.939 167.32 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -65.66 -52.35 52.35 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.18 0.992 . . . . 3.2599999999999998 110.036 178.083 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -55.67 -44.51 77.33 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.627 1.171 . . . . 3.4199999999999999 110.783 176.844 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.3 m -58.53 -52.32 66.15 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.764 0.826 . . . . 2.0099999999999998 111.855 173.831 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 73.3 mtm -61.92 -35.58 78.82 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.229 0.922 . . . . 2.3999999999999999 112.404 -179.476 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.75 -50.5 42.74 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 123.857 0.863 . . . . 4.0499999999999998 111.623 175.715 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 28.1 m -60.66 -33.79 73.33 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 118.42 -0.8 . . . . 2.0499999999999998 112.737 174.428 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 62.6 mtp -70.58 -37.36 73.94 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.008 0.822 . . . . 3.29 111.795 172.554 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.51 -41.63 92.97 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 119.571 1.078 . . . . 1.76 111.047 173.5 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -70.85 -32.7 69.8 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.702 1.137 . . . . 3.73 113.614 175.406 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -58.41 -52.28 66.28 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.407 1.083 . . . . 3.5499999999999998 110.718 168.189 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -67.95 -41.59 82.25 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.558 1.143 . . . . 4.1600000000000001 112.643 -177.262 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.63 -48.93 79.73 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.909 1.684 . . . . 3.75 110.576 173.055 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -58.59 -36.96 74.82 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 123.974 0.91 . . . . 4.79 111.991 -179.89 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 54.5 mt -72.87 -15.89 61.59 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.37 1.068 . . . . 3.23 113.264 177.365 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -106.41 -7.85 17.44 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.433 1.493 . . . . 3.7599999999999998 114.505 175.963 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 11.2 t70 . . . . . 0 N--CA 1.47 0.573 0 C-N-CA 125.412 1.485 . . . . 3.48 112.375 -175.114 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 44.3 p . . . . . 0 N--CA 1.468 0.461 0 CA-C-O 119.276 -0.392 . . . . 3.0899999999999999 111.279 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -62.06 -21.21 72.0 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 121.887 1.725 . . . . 1.5900000000000001 111.696 171.122 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -85.96 -39.54 16.8 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-O 116.683 -1.627 . . . . 3.6800000000000002 113.837 178.101 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -57.69 -37.9 74.25 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 121.925 2.148 . . . . 5.1799999999999997 110.665 166.663 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -72.95 -26.71 61.47 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.087 -1.008 . . . . 5.4000000000000004 112.718 178.14 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.05 -44.53 38.67 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.218 0.607 . . . . 2.1400000000000001 112.004 171.454 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 58.2 mt -57.13 -45.61 83.35 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.987 1.315 . . . . 2.9199999999999999 110.936 175.843 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 20.6 p -68.16 -43.57 77.94 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 116.875 -1.536 . . . . 3.2799999999999998 112.501 175.385 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 52.7 m -55.55 -43.18 75.61 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 120.567 1.531 . . . . 2.5899999999999999 111.028 172.312 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -51.88 66.35 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.121 0.968 . . . . 4.8600000000000003 110.019 178.815 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 75.7 t -64.26 -31.78 54.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 O-C-N 121.158 -0.964 . . . . 2.9199999999999999 112.907 176.436 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 81.2 m -60.72 -57.89 10.76 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.543 1.137 . . . . 2.46 109.841 176.135 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.44 -28.34 61.91 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 123.918 0.761 . . . . 3.6899999999999999 110.006 -173.598 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -55.85 -53.87 51.46 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-O 119.129 -0.462 . . . . 3.1400000000000001 110.571 166.573 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 49.0 m80 -70.28 -33.62 71.79 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 120.18 1.355 . . . . 3.0099999999999998 113.076 -178.609 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -64.26 -27.52 69.1 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.042 1.127 . . . . 5.71 114.042 174.483 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -100.23 -34.55 9.97 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.993 1.317 . . . . 3.52 112.995 177.8 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 7.4 t -82.03 -33.19 30.1 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 126.003 1.721 . . . . 2.4300000000000002 113.331 -178.69 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.54 -11.17 83.47 Favored Glycine 0 CA--C 1.525 0.68 0 O-C-N 120.949 -1.095 . . . . 1.6100000000000001 112.514 170.046 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -57.52 -41.14 80.28 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.671 1.236 . . . . 5.2999999999999998 112.402 -167.791 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -139.22 152.88 47.7 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 126.606 1.962 . . . . 4.9699999999999998 111.676 179.529 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 60.75 2.2 2.35 Favored Glycine 0 CA--C 1.535 1.324 0 O-C-N 121.112 -0.993 . . . . 2.6499999999999999 113.509 -165.302 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 6.0 t 59.47 -154.54 0.37 Allowed 'General case' 0 C--O 1.254 1.315 0 C-N-CA 126.022 1.729 . . . . 7.7800000000000002 111.477 -159.398 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 72.4 mttt 85.07 174.79 0.06 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 129.975 3.31 . . . . 11.43 113.738 156.16 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -76.71 19.33 0.28 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.68 0.792 . . . . 3.7999999999999998 112.721 158.0 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 69.7 p -121.06 132.83 55.12 Favored 'General case' 0 C--O 1.251 1.168 0 CA-C-O 122.978 1.371 . . . . 2.1000000000000001 113.588 -177.096 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -111.42 111.15 21.98 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 112.537 -2.12 . . . . 3.3300000000000001 110.913 177.13 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -88.29 170.02 11.34 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 121.517 0.675 . . . . 3.4700000000000002 111.789 166.364 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 -43.93 -29.59 0.59 Allowed 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 118.928 2.936 . . . . 4.4400000000000004 118.928 -162.803 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.92 -36.47 23.29 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.389 1.255 . . . . 6.2199999999999998 114.389 173.0 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -63.58 -49.58 72.81 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 106.845 -1.539 . . . . 2.1200000000000001 106.845 171.609 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 57.9 tp -56.13 -47.56 77.92 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.644 0.778 . . . . 3.8900000000000001 112.808 174.18 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -58.33 -44.4 88.65 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.394 0.997 . . . . 3.6400000000000001 111.865 -176.245 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -79.79 -17.66 52.83 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.215 1.561 . . . . 4.1900000000000004 115.215 -179.65 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 2.3 tt -72.32 -54.99 7.9 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.983 1.265 . . . . 3.0899999999999999 110.695 165.795 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 33.4 mt -53.24 -44.57 53.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 CA-C-N 119.42 1.009 . . . . 1.8700000000000001 110.688 -173.565 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -63.13 -13.93 42.58 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.044 1.127 . . . . 5.25 114.044 -177.091 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -95.06 -18.67 20.81 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.471 1.908 . . . . 3.8700000000000001 112.607 176.159 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -96.02 -56.62 2.59 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.828 1.651 . . . . 5.8700000000000001 109.894 178.189 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -99.19 71.65 1.82 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.122 1.369 . . . . 3.6000000000000001 109.574 -179.237 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 14.2 p -73.33 -2.42 22.03 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.014 0.926 . . . . 4.6200000000000001 113.285 167.245 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -138.39 162.57 34.08 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.854 2.461 . . . . 4.7800000000000002 110.371 -178.88 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.13 -129.83 10.03 Favored Glycine 0 N--CA 1.468 0.83 0 N-CA-C 108.884 -1.687 . . . . 6.8099999999999996 108.884 -165.43 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -148.62 64.73 1.06 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 122.761 1.267 . . . . 5.7000000000000002 111.805 168.139 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.15 66.78 3.01 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 123.871 1.795 . . . . 2.2200000000000002 112.019 176.303 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -63.31 143.92 57.39 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.106 -1.406 . . . . 5.21 109.614 165.199 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -57.78 -24.92 59.53 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.643 1.349 . . . . 4.9000000000000004 114.643 -174.342 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 8.6 t -78.45 -27.74 46.46 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 120.732 -1.23 . . . . 3.23 113.71 172.332 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 3.6 m -65.87 -17.01 64.36 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.247 0.931 . . . . 3.0800000000000001 111.848 175.307 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 39.9 mm -64.53 -38.96 83.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 125.34 1.456 . . . . 2.6000000000000001 112.031 177.475 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.28 -30.07 65.83 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.509 1.123 . . . . 3.1600000000000001 112.311 -177.1 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -83.71 -40.67 18.58 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.776 0.83 . . . . 2.5899999999999999 112.27 172.793 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.35 -35.32 77.12 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.343 -0.848 . . . . 3.8700000000000001 110.819 173.483 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 2.5 ttt -52.79 -51.62 60.0 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 118.874 -0.584 . . . . 2.8500000000000001 110.93 167.574 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -71.81 -27.14 62.72 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.58 1.082 . . . . 6.7400000000000002 113.008 -178.112 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 8.6 t -61.08 -31.82 71.49 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 113.868 1.062 . . . . 2.2000000000000002 113.868 168.64 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -114.6 -29.69 6.74 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 116.939 2.2 . . . . 3.8300000000000001 116.939 -176.119 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -76.29 85.14 3.08 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 124.725 1.21 . . . . 1.6399999999999999 107.809 168.419 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -47.43 -35.67 8.83 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.832 1.419 . . . . 5.7800000000000002 114.832 -164.943 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 44.1 p30 -96.58 -14.5 22.17 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.724 1.379 . . . . 3.1800000000000002 114.724 -179.917 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 70.9 m 53.98 62.97 2.35 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.932 1.293 . . . . 4.1600000000000001 111.644 -167.158 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 14.2 p30 -87.92 -79.49 0.29 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.044 1.338 . . . . 2.9300000000000002 108.787 177.306 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -178.92 -27.54 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 129.812 3.245 . . . . 5.5899999999999999 112.66 168.57 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -113.64 142.41 46.04 Favored 'General case' 0 C--O 1.242 0.667 0 C-N-CA 126.475 1.91 . . . . 2.7200000000000002 108.942 -174.366 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 6.3 mt -119.99 109.59 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 123.586 0.754 . . . . 2.6800000000000002 111.18 -176.451 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -84.06 157.61 21.73 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.008 2.123 . . . . 3.8100000000000001 110.987 172.731 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.93 -33.96 39.73 Favored 'General case' 0 CA--C 1.551 1.01 0 O-C-N 120.578 -1.326 . . . . 3.79 114.11 179.92 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -75.67 -19.28 59.26 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 119.982 -1.699 . . . . 6.0199999999999996 112.874 176.669 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -78.64 -63.65 1.36 Allowed 'General case' 0 CA--C 1.551 0.981 0 O-C-N 121.004 -1.06 . . . . 2.1800000000000002 108.624 160.727 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -58.03 -22.49 50.15 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.381 2.672 . . . . 3.2599999999999998 117.093 -172.387 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 2.3 p -58.54 -21.35 52.17 Favored 'General case' 0 N--CA 1.481 1.075 0 O-C-N 119.117 -2.24 . . . . 3.9100000000000001 112.718 170.48 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.4 p -71.2 -33.33 50.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 O-C-N 121.55 -0.718 . . . . 3.5600000000000001 112.432 171.93 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -62.97 -51.72 65.78 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.197 0.908 . . . . 2.9300000000000002 110.833 174.611 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 92.2 mt -53.51 -37.65 62.97 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.069 0.948 . . . . 2.8599999999999999 111.687 174.678 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 55.1 m -74.26 -39.33 63.08 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.42 1.088 . . . . 2.6800000000000002 113.205 179.315 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.1 mtm -64.05 -44.97 90.87 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.491 1.041 . . . . 3.0600000000000001 110.95 172.837 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 71.6 mt -63.31 -46.09 88.32 Favored 'General case' 0 CA--C 1.528 0.098 0 CA-C-O 118.495 -0.764 . . . . 2.9700000000000002 112.176 178.191 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.9 p -59.71 -34.61 73.12 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.793 1.179 . . . . 4.6200000000000001 112.655 178.834 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 20.9 mtp -72.34 -30.73 65.01 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.519 1.303 . . . . 3.5600000000000001 114.519 173.002 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.27 -33.26 74.93 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 120.62 1.555 . . . . 2.3399999999999999 111.536 171.543 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -73.07 -26.54 61.3 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.723 1.008 . . . . 4.1299999999999999 113.723 173.773 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -55.44 -53.8 51.81 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.93 1.241 . . . . 3.6400000000000001 110.213 166.008 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.17 -31.94 72.69 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.367 1.067 . . . . 3.6200000000000001 113.082 -175.861 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.0 -40.89 99.15 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.814 1.246 . . . . 3.5299999999999998 112.186 170.837 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -74.45 -30.3 61.83 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.331 1.452 . . . . 4.4199999999999999 112.134 176.563 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 34.9 mt -66.84 -30.1 70.2 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 117.289 -1.339 . . . . 3.4900000000000002 113.589 179.915 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -83.21 -6.31 59.43 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 114.363 1.246 . . . . 4.1699999999999999 114.363 174.834 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -92.92 -53.39 4.17 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.663 0.785 . . . . 4.5499999999999998 110.897 169.141 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -75.84 12.84 0.96 Allowed 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.798 1.407 . . . . 4.0599999999999996 114.798 -168.296 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.937 0 C-N-CA 128.978 2.911 . . . . 5.1900000000000004 113.334 179.71 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.3 mp0 . . . . . 0 CA--C 1.54 0.577 0 CA-C-O 120.04 -0.028 . . . . 4.4800000000000004 110.953 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -140.72 155.83 69.21 Favored Pre-proline 0 N--CA 1.474 0.753 0 C-N-CA 124.648 1.179 . . . . 3.4500000000000002 109.352 176.781 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.18 -20.78 27.93 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.434 2.089 . . . . 1.5800000000000001 112.963 -179.066 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 tt -82.68 -41.15 19.71 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.271 1.028 . . . . 3.6299999999999999 110.438 174.482 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.429 ' CD ' ' HZ2' ' A' ' 7' ' ' LYS . 4.0 tm-20 -64.97 -38.69 91.8 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.632 0.73 . . . . 3.73 109.944 175.315 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.478 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -70.57 -34.14 71.87 Favored 'General case' 0 C--O 1.232 0.159 0 O-C-N 120.546 -1.346 . . . . 6.0700000000000003 113.32 176.569 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.82 -47.61 82.13 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.567 0.747 . . . . 1.8500000000000001 111.934 169.23 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.3 mt -64.7 -36.02 82.93 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.463 1.029 . . . . 2.6699999999999999 112.857 173.406 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 57.8 m -61.06 -42.33 98.3 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.995 0.918 . . . . 2.23 111.437 172.537 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.5 m -57.93 -34.15 69.57 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.084 1.353 . . . . 2.27 111.689 -178.958 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 10.2 mmt -53.65 -65.94 0.48 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.087 1.355 . . . . 4.29 111.068 174.355 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.3 m -63.1 -28.39 44.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 CA-C-N 118.792 0.724 . . . . 3.3900000000000001 112.546 -176.162 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.0 m -70.01 -48.24 58.88 Favored 'General case' 0 CA--C 1.502 -0.877 0 C-N-CA 125.618 1.567 . . . . 2.4500000000000002 112.691 -178.826 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.24 -35.48 48.24 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 117.772 -1.109 . . . . 3.6200000000000001 108.859 177.524 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.4 t80 -53.24 -45.13 68.62 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.994 0.918 . . . . 3.1600000000000001 111.897 -177.168 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.3 m80 -69.38 -11.97 61.27 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.671 1.36 . . . . 3.0 114.671 -175.839 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -30.11 66.17 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 120.661 -1.274 . . . . 4.7300000000000004 111.11 170.562 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -102.98 -46.59 4.61 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.922 1.289 . . . . 3.3700000000000001 112.234 -176.888 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.7 p -65.41 -24.3 67.17 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 124.629 1.172 . . . . 2.6099999999999999 113.764 -178.597 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.09 7.42 60.07 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 127.357 2.408 . . . . 1.3400000000000001 115.6 177.607 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -87.26 -102.35 0.07 Allowed 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.053 1.426 . . . . 5.5499999999999998 109.903 170.792 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -66.78 161.99 22.46 Favored 'General case' 0 C--O 1.246 0.889 0 C-N-CA 124.772 1.229 . . . . 4.9800000000000004 113.421 -176.482 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.42 -134.55 51.75 Favored Glycine 0 C--N 1.341 0.816 0 C-N-CA 125.266 1.412 . . . . 2.27 111.925 163.759 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.0 t -69.23 151.38 46.37 Favored 'General case' 0 C--O 1.251 1.159 0 CA-C-O 123.26 1.505 . . . . 3.6600000000000001 112.262 163.359 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -73.26 -22.2 60.45 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.989 0.916 . . . . 6.5199999999999996 112.958 171.174 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 28.8 tp -83.55 -11.18 57.71 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.307 1.043 . . . . 4.8799999999999999 112.65 175.748 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.0 p -115.59 154.33 29.61 Favored 'General case' 0 C--O 1.246 0.873 0 C-N-CA 125.981 1.712 . . . . 2.25 112.118 -177.367 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . 0.316 0.3 OUTLIER -121.6 108.18 13.27 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.862 1.06 . . . . 2.8999999999999999 113.862 166.582 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.0 t -71.77 174.16 7.23 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 124.661 1.184 . . . . 3.2999999999999998 113.993 174.336 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.432 HH21 ' CG ' ' A' ' 53' ' ' ASP . 19.1 ttt-85 -66.33 8.95 0.18 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 115.75 1.759 . . . . 5.29 115.75 -170.181 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.06 -37.92 2.89 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 119.979 -1.7 . . . . 6.1900000000000004 112.381 166.279 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -52.67 -54.55 31.95 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.434 1.016 . . . . 1.54 111.007 165.834 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 22.0 tp -74.66 -32.55 62.28 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.54 0.736 . . . . 3.3700000000000001 112.476 -176.423 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -51.92 -47.85 64.46 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.631 0.651 . . . . 4.2800000000000002 111.119 171.519 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.473 ' HG3' ' HE2' ' A' ' 40' ' ' LYS . 13.1 tp10 -91.64 4.06 53.58 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.08 1.141 . . . . 4.8099999999999996 114.08 -175.222 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 tt -78.49 -61.93 1.85 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.452 1.101 . . . . 3.0899999999999999 108.849 154.661 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.8 mt -51.32 -44.61 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 125.095 1.358 . . . . 1.95 110.65 -178.214 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.02 -20.01 64.91 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.838 1.051 . . . . 4.8600000000000003 113.838 -177.007 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.473 ' HE2' ' HG3' ' A' ' 36' ' ' GLU . 43.2 mttm -102.36 -38.71 7.49 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 124.883 1.273 . . . . 3.48 112.336 179.508 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -58.9 -77.56 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 128.958 2.903 . . . . 4.7300000000000004 109.464 171.29 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.5 mt -81.04 48.2 1.09 Allowed 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.569 -1.332 . . . . 3.6400000000000001 112.798 -179.265 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.37 14.04 0.08 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 125.19 1.396 . . . . 4.0099999999999998 114.485 176.794 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -122.69 -3.15 8.77 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.181 2.192 . . . . 4.5599999999999996 114.436 -178.045 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -114.75 -178.99 18.85 Favored Glycine 0 N--CA 1.473 1.154 0 C-N-CA 124.867 1.223 . . . . 4.6699999999999999 114.208 -177.694 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -71.67 34.12 0.06 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 127.906 2.482 . . . . 6.3600000000000003 113.897 -176.359 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -81.46 53.98 2.22 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.668 2.387 . . . . 2.5699999999999998 115.821 -153.478 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.6 tttt -81.85 166.64 19.78 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 128.282 2.633 . . . . 7.1799999999999997 111.259 -179.899 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -45.79 -53.39 9.65 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.31 1.044 . . . . 5.71 113.332 -174.111 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.7 m -70.88 -31.15 67.73 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 113.923 1.082 . . . . 3.2000000000000002 113.923 178.819 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.2 m -65.16 -20.46 66.46 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.908 0.883 . . . . 3.29 112.225 171.531 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 59.1 mt -93.8 -30.67 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 126.288 1.835 . . . . 2.0499999999999998 111.314 174.043 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.432 ' CG ' HH21 ' A' ' 31' ' ' ARG . 5.6 t0 -70.45 -43.54 69.66 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.505 1.122 . . . . 3.1099999999999999 112.316 -178.233 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.409 ' CG ' ' HZ3' ' A' ' 57' ' ' LYS . 12.1 t70 -69.11 -31.92 70.96 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.141 -0.974 . . . . 3.4500000000000002 111.502 174.431 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.71 -54.66 42.58 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.395 1.078 . . . . 3.6299999999999999 109.482 172.03 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.5 mmm -52.33 -41.14 62.75 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 127.257 2.223 . . . . 3.5499999999999998 112.038 174.403 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.409 ' HZ3' ' CG ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -67.25 -26.94 66.82 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.561 1.545 . . . . 5.4400000000000004 113.043 177.639 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.6 t -92.69 -20.53 20.72 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.346 -1.471 . . . . 3.77 113.272 171.97 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.3 -42.37 93.14 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 127.759 2.424 . . . . 4.1299999999999999 111.682 172.159 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -87.2 154.86 20.39 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 115.148 1.536 . . . . 1.96 115.148 -177.051 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -125.76 10.99 7.79 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 126.074 1.75 . . . . 3.8900000000000001 113.805 177.408 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -137.37 -34.94 0.69 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 116.064 1.876 . . . . 2.6299999999999999 116.064 -162.563 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 75.07 26.95 1.18 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.701 1.601 . . . . 3.98 111.551 -161.825 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 39.1 p-10 -93.73 -16.88 23.78 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.482 1.513 . . . . 2.3300000000000001 112.64 -169.84 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 68.78 -0.09 2.49 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.659 2.383 . . . . 5.0099999999999998 115.59 -178.333 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -101.25 140.85 34.98 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 122.244 1.021 . . . . 2.75 110.035 160.546 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 48.6 mm -100.25 113.5 36.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 106.622 -1.622 . . . . 2.3599999999999999 106.622 164.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.66 161.05 28.85 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.903 1.281 . . . . 2.5699999999999998 111.465 172.701 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -58.38 -26.69 63.49 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 115.008 1.485 . . . . 3.7799999999999998 115.008 -176.272 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.2 mtmm -79.82 -32.54 40.68 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.755 -1.215 . . . . 4.8700000000000001 112.397 173.222 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -60.67 -46.97 88.32 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 109.319 -0.623 . . . . 1.8999999999999999 109.319 168.94 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -58.28 -32.41 68.39 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.189 1.796 . . . . 3.77 113.856 173.281 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.3 m -61.21 -29.84 70.06 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 119.603 -1.936 . . . . 3.0 113.178 168.127 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 43.1 t -73.85 -36.07 44.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 O-C-N 121.127 -0.983 . . . . 3.9900000000000002 110.881 175.926 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -61.94 -51.44 68.09 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 118.911 0.778 . . . . 3.0600000000000001 112.853 170.842 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.4 mt -59.3 -33.29 70.92 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.467 0.707 . . . . 2.96 111.578 174.95 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 92.7 m -60.52 -47.48 85.98 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 118.231 -0.89 . . . . 2.0600000000000001 111.346 168.919 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 16.1 mtm -58.08 -44.51 87.62 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 120.118 1.326 . . . . 2.6200000000000001 112.022 177.441 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.0 mt -71.21 -43.63 66.98 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.546 0.612 . . . . 2.6000000000000001 112.632 -179.189 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 9.9 t -66.09 -26.37 67.44 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.294 -0.878 . . . . 2.4399999999999999 112.852 175.462 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 76.7 mtp -72.45 -40.11 67.28 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.306 -0.871 . . . . 2.5499999999999998 112.472 166.03 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.17 -38.5 89.27 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.571 1.078 . . . . 2.52 112.757 -178.963 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -65.11 -24.07 67.33 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.839 1.052 . . . . 3.5800000000000001 113.839 171.648 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -70.92 -44.11 66.86 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.3 0.954 . . . . 4.1399999999999997 112.864 179.009 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -60.22 -47.32 86.46 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.766 1.227 . . . . 3.1400000000000001 110.66 170.959 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -50.84 -40.84 56.92 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.907 1.283 . . . . 4.0800000000000001 112.672 176.919 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -70.61 -30.78 67.53 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.001 1.321 . . . . 3.2599999999999998 112.966 179.304 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 60.2 mt -78.55 -20.6 50.3 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.21 1.004 . . . . 2.3199999999999998 112.278 176.612 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -90.01 -6.67 55.34 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.553 1.316 . . . . 3.79 114.553 174.487 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 21.5 t70 . . . . . 0 N--CA 1.472 0.647 0 C-N-CA 126.359 1.863 . . . . 2.8100000000000001 112.946 178.63 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.473 0.691 0 CA-C-O 118.751 -0.642 . . . . 3.6200000000000001 110.727 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -62.54 -18.84 65.63 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 122.961 2.441 . . . . 1.5 114.089 175.869 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.7 -54.65 6.36 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.93 1.241 . . . . 3.6899999999999999 111.169 179.49 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -62.88 -30.97 71.92 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.931 0.787 . . . . 4.7599999999999998 110.657 174.482 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -62.98 -45.78 90.81 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 119.927 -1.733 . . . . 8.7799999999999994 111.471 166.512 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.5 -50.62 73.1 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.426 1.09 . . . . 1.6699999999999999 111.1 177.566 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 70.5 mt -56.99 -47.04 81.74 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.493 1.117 . . . . 2.4100000000000001 111.704 172.696 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 96.9 m -56.53 -44.38 80.76 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.488 0.715 . . . . 2.6499999999999999 111.362 175.222 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 91.8 m -63.69 -44.56 93.32 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.406 1.482 . . . . 2.1699999999999999 109.842 179.336 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 79.7 mtp -57.13 -51.36 69.62 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.561 0.744 . . . . 3.7000000000000002 110.617 174.376 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 53.2 t -63.39 -30.45 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 N-CA-C 113.367 0.877 . . . . 2.8100000000000001 113.367 176.422 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 82.4 m -62.79 -52.6 62.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.877 1.271 . . . . 1.8300000000000001 110.246 174.717 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -31.78 69.37 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 118.545 -0.741 . . . . 2.23 111.311 169.636 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -69.06 -58.41 4.13 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 118.642 0.655 . . . . 3.5099999999999998 111.942 -175.398 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 6.5 m170 -73.53 -12.31 60.73 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 120.307 1.412 . . . . 2.73 114.281 177.287 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -67.51 -66.92 0.5 Allowed 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.247 -0.908 . . . . 4.96 111.626 157.702 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -70.93 -32.53 69.46 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.73 1.011 . . . . 3.27 113.73 -172.517 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 8.2 p -65.1 -18.32 65.2 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 120.477 -1.389 . . . . 2.4100000000000001 112.225 169.301 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.64 9.25 77.45 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 126.048 1.785 . . . . 1.74 114.777 171.058 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -72.72 -24.22 60.96 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.597 1.698 . . . . 4.7800000000000002 112.304 174.262 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.435 ' CD ' ' HZ1' ' B' ' 32' ' ' LYS . 31.0 tt0 -161.4 152.67 18.67 Favored 'General case' 0 C--O 1.252 1.214 0 C-N-CA 125.415 1.486 . . . . 3.3399999999999999 111.91 179.494 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.84 -131.34 52.0 Favored Glycine 0 C--N 1.339 0.697 0 C-N-CA 126.013 1.768 . . . . 2.79 111.061 168.018 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.5 m -57.65 125.49 23.16 Favored 'General case' 0 C--O 1.248 1.025 0 O-C-N 122.139 -0.624 . . . . 3.7400000000000002 110.246 166.34 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -74.83 66.86 1.56 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.997 2.119 . . . . 8.9700000000000006 109.667 158.226 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 63.8 tp -167.97 -53.88 0.02 OUTLIER 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 127.526 2.33 . . . . 3.6099999999999999 107.728 -176.54 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 60.7 p -94.84 158.1 15.64 Favored 'General case' 0 C--O 1.252 1.196 0 C-N-CA 125.752 1.621 . . . . 2.29 112.911 176.429 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -103.82 116.8 32.95 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 127.05 2.14 . . . . 3.8799999999999999 109.701 169.112 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 3.0 p -74.34 165.98 24.26 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.141 0.576 . . . . 3.2799999999999998 111.602 164.674 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 15.8 tpp180 -41.49 -33.01 0.38 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.517 1.927 . . . . 5.5499999999999998 113.778 167.98 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.435 ' HZ1' ' CD ' ' B' ' 23' ' ' GLU . 0.0 OUTLIER -89.61 -40.11 12.81 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 120.698 -1.251 . . . . 5.1500000000000004 113.753 -179.353 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -56.84 -44.08 81.75 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.45 0.643 . . . . 2.02 110.457 170.564 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 tp -66.75 -44.31 81.81 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.35 1.06 . . . . 3.02 112.138 -179.498 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -57.38 -37.25 72.36 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.804 1.242 . . . . 3.6600000000000001 113.175 178.631 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -62.96 -65.76 0.64 Allowed 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 117.839 -1.077 . . . . 3.75 111.087 168.831 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 tp -48.06 -57.31 5.98 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 127.779 2.432 . . . . 3.1299999999999999 112.024 -175.107 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 34.9 mt -56.17 -56.87 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.065 0.848 . . . . 2.5299999999999998 110.135 -177.395 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -24.02 66.13 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.632 0.773 . . . . 6.2599999999999998 112.446 -174.111 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.95 -31.84 12.89 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.092 1.757 . . . . 7.2199999999999998 112.835 -173.586 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.6 mm-40 -97.04 -21.22 17.51 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 119.407 1.003 . . . . 5.25 112.712 176.924 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -113.31 118.27 34.15 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 119.712 1.142 . . . . 3.0099999999999998 108.488 171.755 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 15.7 p -139.55 10.73 2.49 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.756 1.222 . . . . 3.4100000000000001 113.623 -175.103 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -68.92 -42.9 76.18 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.615 1.566 . . . . 3.7599999999999998 111.088 -177.265 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -96.88 165.4 23.13 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 110.211 -1.156 . . . . 3.8199999999999998 110.211 156.475 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . 0.424 ' O ' ' HE2' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -66.91 96.88 0.45 Allowed 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.899 -1.149 . . . . 6.5700000000000003 107.899 165.891 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 8.0 tpt -72.27 75.93 0.99 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.396 1.879 . . . . 3.3100000000000001 112.263 -168.088 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' B' ' 46' ' ' GLU . 0.0 OUTLIER -83.49 163.73 20.29 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.731 1.613 . . . . 5.0199999999999996 114.45 -161.669 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -47.82 -59.95 2.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.775 1.63 . . . . 5.0 112.057 177.839 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 13.1 m -71.77 6.09 2.17 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 115.179 1.548 . . . . 3.1400000000000001 115.179 178.973 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 34.3 p -119.83 16.73 12.67 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.768 -1.208 . . . . 3.3900000000000001 112.554 163.708 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 35.1 mt -110.42 -47.64 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.018 0.927 . . . . 2.7200000000000002 111.976 171.691 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -71.89 -30.43 65.38 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.996 1.271 . . . . 3.0699999999999998 113.255 -173.386 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.447 ' CG ' ' HZ1' ' B' ' 57' ' ' LYS . 12.2 t70 -65.52 -37.05 85.64 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.924 0.784 . . . . 2.4199999999999999 111.5 167.56 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 10.0 tt -60.93 -43.54 98.49 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 117.73 -1.129 . . . . 3.73 110.097 176.092 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 6.3 ttt -59.34 -50.55 73.55 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 120.099 1.318 . . . . 2.9900000000000002 113.276 170.632 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . 0.447 ' HZ1' ' CG ' ' B' ' 54' ' ' ASP . 2.0 tmtt? -52.49 -33.32 44.25 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.71 1.204 . . . . 4.9800000000000004 112.195 173.272 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 63.3 m -86.58 -22.94 25.98 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.758 1.623 . . . . 3.0800000000000001 113.532 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 9.5 mt -70.16 -42.18 72.84 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 120.159 1.345 . . . . 2.98 110.877 169.386 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.71 141.53 43.58 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.235 1.414 . . . . 3.1299999999999999 113.093 -179.929 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 33.9 mmtm -124.21 -1.06 8.23 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.69 1.196 . . . . 4.1200000000000001 113.066 172.432 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 31.4 p-10 -113.47 -48.84 2.92 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.642 1.977 . . . . 3.0 111.125 167.345 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 5.0 t 94.62 111.12 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 129.399 3.08 . . . . 2.77 107.879 -167.29 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 p30 -155.69 -135.46 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 122.037 0.922 . . . . 3.0800000000000001 109.0 -173.475 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -140.58 5.63 2.02 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 114.544 1.313 . . . . 5.2999999999999998 114.544 175.856 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -132.32 136.89 47.19 Favored 'General case' 0 C--O 1.246 0.898 0 C-N-CA 127.393 2.277 . . . . 3.5099999999999998 111.998 -174.306 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 31.8 mm -108.71 122.27 63.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 126.08 1.752 . . . . 2.3900000000000001 108.456 169.186 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -98.44 -174.48 2.83 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.594 1.957 . . . . 3.0699999999999998 110.994 169.239 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -25.11 65.31 Favored 'General case' 0 CA--C 1.551 0.985 0 O-C-N 120.456 -1.402 . . . . 4.0899999999999999 114.374 177.456 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -71.65 -46.68 58.26 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.436 -1.415 . . . . 6.96 112.079 174.137 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -63.11 -48.73 77.31 Favored 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 118.829 0.741 . . . . 1.77 110.177 171.329 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -59.48 -23.43 62.74 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 120.029 -1.669 . . . . 3.0099999999999998 114.33 -179.33 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 41.4 t -53.01 -35.18 59.12 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.612 -1.305 . . . . 2.77 111.904 167.887 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 59.7 t -64.63 -40.54 89.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 CA-C-N 119.181 0.9 . . . . 2.8500000000000001 111.357 178.383 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -62.94 -50.98 68.67 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.881 0.873 . . . . 2.6400000000000001 111.26 176.867 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.9 -43.81 98.02 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.167 0.987 . . . . 2.6699999999999999 110.961 178.546 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 95.0 m -60.93 -52.12 66.37 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.909 1.284 . . . . 2.02 112.07 177.841 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 30.6 ttp -61.06 -41.16 96.09 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.097 0.959 . . . . 3.5299999999999998 111.93 -175.22 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 98.0 mt -72.45 -45.3 60.2 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 123.796 0.838 . . . . 2.8799999999999999 112.219 175.784 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.4 t -67.19 -28.46 68.11 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.111 0.869 . . . . 2.6699999999999999 112.998 -177.99 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -50.01 71.48 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.013 0.824 . . . . 4.4199999999999999 111.338 166.63 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.9 -30.56 70.24 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.742 0.701 . . . . 1.99 112.865 -178.71 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -74.64 -24.73 58.88 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.768 1.025 . . . . 3.5099999999999998 113.768 172.282 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -78.59 -42.26 29.54 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.069 0.948 . . . . 3.4700000000000002 111.537 172.725 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -60.8 -35.89 77.62 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.664 0.786 . . . . 3.8100000000000001 110.703 171.589 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -57.24 -46.33 83.09 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.185 0.994 . . . . 4.2800000000000002 112.203 171.527 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -65.5 -34.95 79.47 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.503 1.121 . . . . 3.5099999999999998 112.217 -179.057 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 98.0 mt -69.58 -30.98 68.87 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.776 0.83 . . . . 2.71 112.816 175.749 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . 0.407 ' CD ' ' HZ3' ' B' ' 92' ' ' LYS . 46.8 mm-40 -89.31 -6.44 56.71 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 114.498 1.295 . . . . 4.5199999999999996 114.498 178.656 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -93.54 -50.01 5.62 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.395 1.478 . . . . 3.0800000000000001 112.142 170.852 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.73 44.26 0.72 Allowed 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 123.09 1.424 . . . . 2.79 112.963 -178.303 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . 0.407 ' HZ3' ' CD ' ' B' ' 89' ' ' GLU . 28.8 mmtm . . . . . 0 C--O 1.25 1.116 0 C-N-CA 129.7 3.2 . . . . 4.79 115.234 171.399 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 . . . . . 0 CA--C 1.539 0.532 0 N-CA-C 107.844 -1.169 . . . . 4.1399999999999997 107.844 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 46.3 p -120.21 174.75 2.69 Favored Pre-proline 0 N--CA 1.469 0.522 0 C-N-CA 124.052 0.941 . . . . 2.3500000000000001 113.372 -153.703 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -75.11 -29.52 7.97 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 121.659 1.572 . . . . 2.21 111.485 159.222 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.0 tp -77.17 -53.77 7.34 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.318 0.963 . . . . 4.1500000000000004 113.064 -170.816 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -71.03 -26.82 63.27 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.876 1.217 . . . . 5.6200000000000001 111.068 -177.874 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -60.58 -40.99 93.75 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.122 -0.986 . . . . 5.5 111.67 164.38 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.97 -31.11 61.38 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.048 0.939 . . . . 2.0299999999999998 112.148 176.421 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.5 mt -66.36 -42.57 87.85 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.012 1.278 . . . . 2.5099999999999998 111.587 168.018 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 91.5 m -60.4 -43.35 96.74 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 121.341 -0.849 . . . . 2.3999999999999999 110.692 172.872 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 51.2 m -60.91 -38.4 85.62 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.205 1.002 . . . . 2.4700000000000002 111.158 172.065 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 43.1 ttm -62.85 -49.82 73.36 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.56 -1.21 . . . . 4.1699999999999999 111.952 175.764 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.3 m -66.36 -22.4 30.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 CA-C-N 120.804 1.638 . . . . 3.5499999999999998 113.317 174.938 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 60.2 m -67.75 -54.74 16.83 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 117.608 -1.187 . . . . 1.8700000000000001 109.72 173.069 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -52.99 -36.55 60.51 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-N 119.2 0.909 . . . . 3.1000000000000001 111.221 168.753 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -64.42 -44.79 90.12 Favored 'General case' 0 C--O 1.219 -0.503 0 O-C-N 123.849 0.718 . . . . 2.8199999999999998 111.3 -175.173 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -75.22 -37.28 61.17 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.999 1.272 . . . . 2.3399999999999999 112.895 173.375 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.436 ' HZ3' ' CD ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -59.17 -15.99 17.72 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.121 1.768 . . . . 6.7999999999999998 113.683 175.607 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -121.66 -20.18 6.58 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 116.718 2.118 . . . . 3.5899999999999999 116.718 162.966 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.7 t -71.44 -23.66 61.88 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 122.462 2.392 . . . . 2.5600000000000001 112.478 172.743 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.8 0.77 89.4 Favored Glycine 0 CA--C 1.535 1.31 0 CA-C-O 118.192 -1.338 . . . . 1.8999999999999999 114.062 166.103 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.4 tpt85 -62.84 -22.86 66.98 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 119.898 1.849 . . . . 6.5300000000000002 112.76 177.525 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -164.03 148.61 10.19 Favored 'General case' 0 C--O 1.252 1.218 0 C-N-CA 127.483 2.313 . . . . 5.0099999999999998 110.447 168.182 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 43.35 -126.55 5.33 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 126.573 2.035 . . . . 3.7200000000000002 114.772 163.185 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.5 m -44.68 137.65 3.79 Favored 'General case' 0 C--O 1.245 0.853 0 C-N-CA 126.686 1.994 . . . . 3.2000000000000002 114.149 178.557 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -110.5 -11.59 14.46 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 127.018 2.127 . . . . 4.8600000000000003 115.586 -163.011 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 28.2 tp -95.89 0.02 51.5 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.095 0.958 . . . . 4.7599999999999998 111.066 170.259 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.3 p -142.68 156.38 45.03 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 126.14 1.776 . . . . 1.8500000000000001 113.99 -162.174 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.9 mt -111.34 104.58 13.05 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.703 1.201 . . . . 2.4399999999999999 109.145 171.129 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.1 t -66.25 152.4 44.99 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.4 -0.813 . . . . 2.4500000000000002 110.683 168.044 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.7 ttp180 -42.51 -29.86 0.31 Allowed 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.926 2.09 . . . . 6.3099999999999996 115.693 -175.377 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -83.38 -33.17 25.85 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 116.592 2.071 . . . . 8.2300000000000004 116.592 171.479 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -60.81 -43.31 98.37 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.011 0.925 . . . . 1.98 109.948 165.874 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.9 tp -66.94 -45.14 78.72 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.669 0.788 . . . . 3.2000000000000002 112.656 -174.703 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -50.3 -47.29 55.66 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.383 0.992 . . . . 4.1399999999999997 111.44 174.757 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -70.89 -46.0 63.36 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 118.441 -0.79 . . . . 3.0499999999999998 111.615 -174.017 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.4 tp -55.47 -52.84 62.3 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.859 1.264 . . . . 3.3999999999999999 112.352 179.824 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 51.3 mt -54.05 -57.57 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 107.866 -1.161 . . . . 1.8600000000000001 107.866 -178.866 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.16 -16.7 60.5 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.883 1.068 . . . . 4.8099999999999996 113.883 -171.27 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.2 mmtp -81.99 -47.93 12.07 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.984 1.314 . . . . 4.0700000000000003 112.208 177.553 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.436 ' CD ' ' HZ3' ' A' ' 18' ' ' LYS . 11.0 mm-40 -101.98 15.23 29.69 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.604 1.162 . . . . 6.04 111.696 -172.23 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -164.83 122.11 1.59 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.217 2.207 . . . . 3.75 111.643 173.698 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 48.8 t -71.39 -53.69 13.25 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 114.045 1.128 . . . . 4.7300000000000004 114.045 -179.188 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 61.99 -56.52 0.13 Allowed 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 128.778 2.831 . . . . 6.6699999999999999 113.973 -170.993 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 161.42 26.45 0.02 OUTLIER Glycine 0 CA--C 1.536 1.369 1 C-N-CA 130.818 4.056 . . . . 3.5899999999999999 110.427 -174.355 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 65.09 132.79 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 128.706 2.802 . . . . 9.4299999999999997 111.458 -157.328 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 41.8 mmm -88.24 129.29 35.4 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.892 0.853 . . . . 3.5899999999999999 110.335 174.797 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -112.85 159.19 19.28 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.241 1.017 . . . . 4.7300000000000004 110.463 178.417 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -45.2 -46.29 12.17 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 114.673 1.36 . . . . 5.1900000000000004 114.673 -169.928 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -61.46 -7.29 2.96 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 115.588 1.699 . . . . 4.4299999999999997 115.588 179.884 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.3 m -115.44 -12.11 11.75 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.584 1.084 . . . . 3.0899999999999999 113.139 171.935 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 74.7 mt -84.39 -44.72 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 O-C-N 120.692 -1.255 . . . . 3.8300000000000001 112.287 -171.347 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -74.94 -12.68 60.41 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.237 0.458 . . . . 4.2599999999999998 112.237 176.742 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.449 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 1.0 OUTLIER -91.0 -28.75 17.79 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.43 1.092 . . . . 2.6200000000000001 113.383 169.375 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.0 -47.27 81.24 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.573 -0.704 . . . . 3.2799999999999998 109.654 156.925 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 6.4 tpt -56.35 -49.05 75.49 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.659 0.784 . . . . 2.8100000000000001 110.712 176.224 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.449 ' HE2' ' HA ' ' A' ' 54' ' ' ASP . 14.8 mtmm -60.05 -39.12 84.86 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.587 1.085 . . . . 5.1699999999999999 112.916 174.37 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 73.0 m -67.32 -25.04 65.82 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.091 0.774 . . . . 2.3199999999999998 113.091 175.575 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -86.67 -40.85 14.71 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.055 1.342 . . . . 3.8599999999999999 113.631 172.069 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -88.73 64.3 7.25 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 114.606 1.336 . . . . 1.9099999999999999 114.606 -156.378 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -47.6 -44.85 26.91 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.568 1.547 . . . . 4.0 114.28 -176.258 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . 0.281 0.4 OUTLIER -84.03 2.93 36.8 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 114.008 1.114 . . . . 3.4500000000000002 114.008 -175.159 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 69.2 m 60.14 79.68 0.23 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 127.659 2.384 . . . . 5.0899999999999999 113.253 168.998 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -158.3 -114.8 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.652 -0.655 . . . . 2.7799999999999998 110.153 -155.105 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -155.4 -10.58 0.12 Allowed 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 116.424 2.009 . . . . 5.3600000000000003 116.424 176.816 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -127.35 146.14 50.56 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.227 1.811 . . . . 2.4300000000000002 109.412 -173.467 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 9.4 mm -106.54 98.44 6.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 125.801 1.641 . . . . 2.1800000000000002 110.205 176.136 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -67.76 158.08 33.23 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.557 1.143 . . . . 3.2799999999999998 111.973 168.543 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -52.64 -31.38 36.52 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.216 1.561 . . . . 3.98 115.216 -176.533 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.2 -35.4 59.11 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 120.669 -1.269 . . . . 5.0199999999999996 112.581 175.309 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -62.55 -47.86 82.03 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.118 0.567 . . . . 1.72 109.532 166.433 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -60.8 -39.67 89.77 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 127.451 2.3 . . . . 3.8300000000000001 115.219 -170.758 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 38.9 m -53.62 -25.56 18.17 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.629 1.171 . . . . 2.7599999999999998 114.117 -171.29 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.7 m -69.59 -25.6 29.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 O-C-N 121.017 -1.052 . . . . 3.9399999999999999 113.548 178.351 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -62.88 -56.97 12.61 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.519 1.054 . . . . 3.54 110.866 -177.82 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.6 mt -65.41 -29.06 69.71 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 118.583 -0.723 . . . . 3.3199999999999998 112.009 176.115 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 66.6 m -60.72 -52.22 66.05 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.792 0.837 . . . . 2.0499999999999998 110.94 170.85 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 77.5 mtm -60.12 -41.69 93.16 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.557 0.743 . . . . 2.6600000000000001 111.65 177.088 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 77.2 mt -67.48 -41.59 84.35 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 118.582 -0.723 . . . . 2.3199999999999998 112.589 179.4 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 3.7 t -69.66 -28.13 65.62 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.735 1.152 . . . . 2.8199999999999998 113.053 175.329 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 27.2 mtp -65.52 -42.53 91.9 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.295 -0.878 . . . . 3.3399999999999999 112.515 165.896 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.04 -33.94 76.88 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 120.009 1.277 . . . . 1.6599999999999999 113.031 175.962 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -64.58 -24.16 67.5 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.221 -0.925 . . . . 3.8700000000000001 112.8 171.459 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.441 ' ND2' ' HD1' ' B' ' 17' ' ' HIS . 2.0 t-20 -75.51 -35.76 60.7 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.279 -0.888 . . . . 3.8999999999999999 113.0 178.379 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -62.37 -44.66 95.95 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.604 1.162 . . . . 3.9900000000000002 110.839 171.558 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.64 -50.75 62.52 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.048 1.339 . . . . 3.9700000000000002 111.728 171.673 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -62.78 -33.57 75.46 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.161 0.984 . . . . 3.5499999999999998 111.935 178.711 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 42.6 mt -69.63 -18.61 63.61 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 117.507 -1.235 . . . . 2.4500000000000002 113.308 178.297 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -91.24 -17.2 26.4 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 114.917 1.451 . . . . 2.7400000000000002 114.917 171.622 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.2 t70 . . . . . 0 N--CA 1.478 0.941 0 C-N-CA 124.663 1.185 . . . . 3.6400000000000001 112.835 -176.13 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 58.7 p . . . . . 0 N--CA 1.471 0.612 0 N-CA-C 112.24 0.459 . . . . 2.3799999999999999 112.24 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -62.56 -16.33 51.69 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 122.323 2.015 . . . . 1.8200000000000001 113.039 165.69 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -80.72 -32.04 35.89 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 117.516 -1.231 . . . . 3.2599999999999998 111.911 173.274 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -50.41 -46.07 56.07 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.194 0.906 . . . . 6.1200000000000001 109.118 159.675 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 7' ' ' LYS . . . . . 0.466 ' HA ' ' CE ' ' B' ' 7' ' ' LYS . 0.2 OUTLIER -77.67 -25.34 49.48 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 114.707 1.373 . . . . 4.9800000000000004 114.707 -177.544 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.38 -46.28 56.02 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.859 0.754 . . . . 1.8899999999999999 110.959 171.157 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 79.7 mt -68.86 -37.62 79.22 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.248 1.019 . . . . 2.75 111.834 175.568 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 97.2 m -54.22 -56.54 17.27 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 117.831 -1.08 . . . . 3.4300000000000002 108.657 167.098 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 43.9 m -53.18 -49.73 66.06 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.319 0.963 . . . . 2.48 110.527 -179.13 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 37.2 ttm -62.42 -46.17 89.78 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.666 0.786 . . . . 3.9399999999999999 112.556 -178.146 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 1.8 p -70.25 -26.46 29.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.871 1.214 . . . . 3.9500000000000002 112.691 175.685 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 65.6 m -70.82 -46.03 63.49 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.373 1.469 . . . . 2.3399999999999999 111.736 -177.898 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -64.79 -43.16 94.12 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.86 0.864 . . . . 2.0499999999999998 109.459 169.189 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 29.7 t80 -66.55 -49.75 65.43 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 120.081 -0.648 . . . . 3.4300000000000002 111.417 -168.671 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . 0.441 ' HD1' ' ND2' ' A' ' 84' ' ' ASN . 0.1 OUTLIER -67.94 -3.6 10.4 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 120.689 -1.257 . . . . 2.4700000000000002 114.337 178.086 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.63 -57.9 2.08 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.026 -1.046 . . . . 5.5700000000000003 110.806 171.291 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -61.97 -34.1 75.52 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.303 -0.873 . . . . 2.9500000000000002 112.717 177.056 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 67.5 m -70.02 -11.99 61.28 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.58 -1.325 . . . . 2.3599999999999999 114.121 171.645 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -94.11 -4.04 63.25 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 125.187 1.375 . . . . 1.3300000000000001 114.451 166.349 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 36.5 tpt85 -64.5 -23.48 67.29 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.138 1.469 . . . . 4.9100000000000001 112.502 176.941 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -151.59 175.52 12.25 Favored 'General case' 0 C--O 1.246 0.879 0 C-N-CA 127.225 2.21 . . . . 4.5700000000000003 108.658 172.08 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -41.31 153.8 0.1 OUTLIER Glycine 0 N--CA 1.474 1.176 0 C-N-CA 126.688 2.089 . . . . 3.46 115.122 -174.022 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 16.3 m 63.26 122.78 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.205 1.402 . . . . 4.0899999999999999 112.613 -179.358 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 23.2 mtpt -81.25 -25.39 36.65 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 114.819 1.414 . . . . 8.0999999999999996 114.819 -175.063 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -94.02 6.47 48.42 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.195 0.998 . . . . 4.5499999999999998 113.513 -173.882 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 19.0 p -144.63 154.39 42.76 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 127.159 2.184 . . . . 2.75 111.849 -166.929 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 77.1 mt -107.0 108.54 20.1 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.224 1.41 . . . . 2.77 109.722 167.686 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.42 160.9 4.86 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 120.156 -1.59 . . . . 2.3399999999999999 111.228 161.484 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -43.98 -35.21 1.96 Allowed 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.441 1.097 . . . . 4.3600000000000003 113.921 176.488 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.97 -40.5 39.09 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.245 1.018 . . . . 6.3300000000000001 113.331 178.623 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -59.17 -42.48 90.91 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.084 0.954 . . . . 2.2400000000000002 109.76 173.282 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tp -66.33 -47.02 74.84 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.265 -0.874 . . . . 2.9300000000000002 111.839 176.032 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -54.73 -54.21 44.88 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 120.354 1.434 . . . . 3.8999999999999999 112.045 176.994 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.402 ' HG3' ' HE3' ' B' ' 40' ' ' LYS . 4.8 tp10 -41.81 -62.61 0.87 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.262 1.425 . . . . 3.48 112.601 170.66 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 tp -48.93 -62.96 1.24 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.114 1.766 . . . . 3.3500000000000001 110.433 -177.871 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 22.3 mt -62.01 -38.01 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 109.546 -0.539 . . . . 2.1800000000000002 109.546 -171.942 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 51.2 mttm -58.12 -33.24 68.92 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.907 0.706 . . . . 5.8399999999999999 112.907 179.955 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . 0.402 ' HE3' ' HG3' ' B' ' 36' ' ' GLU . 14.2 mttt -82.97 -47.69 11.48 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 122.979 0.512 . . . . 5.8799999999999999 111.927 177.835 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -75.63 -55.71 5.4 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 124.335 1.022 . . . . 5.5300000000000002 111.014 -172.598 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -83.01 49.13 1.47 Allowed 'General case' 0 CA--C 1.546 0.814 0 O-C-N 119.679 -1.888 . . . . 3.6200000000000001 110.928 -177.899 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 15.4 t -75.92 16.62 0.39 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.617 1.967 . . . . 4.6100000000000003 114.573 -176.521 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.48 18.05 0.18 Allowed 'General case' 0 N--CA 1.478 0.955 0 O-C-N 120.084 -1.635 . . . . 5.0 115.093 -177.029 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.95 -40.93 1.45 Allowed Glycine 0 CA--C 1.534 1.245 0 C-N-CA 126.172 1.844 . . . . 4.96 114.72 -179.526 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . 0.461 ' CD ' ' HZ2' ' B' ' 48' ' ' LYS . 41.7 tp10 -64.27 -22.61 67.01 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.177 1.391 . . . . 5.2699999999999996 113.985 -175.82 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 7.6 tpt -74.85 76.83 2.12 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.759 1.624 . . . . 2.79 112.509 -175.866 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.461 ' HZ2' ' CD ' ' B' ' 46' ' ' GLU . 20.2 mttm -62.74 120.73 11.81 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 120.786 -1.196 . . . . 4.8399999999999999 111.029 -170.548 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.67 -34.9 69.87 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.923 1.453 . . . . 4.1200000000000001 114.923 -156.934 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 3.0 m -87.93 -14.68 38.65 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.299 -0.876 . . . . 5.9500000000000002 112.388 -178.442 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 17.9 t -70.48 -10.26 58.71 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.479 -1.388 . . . . 3.2799999999999998 111.979 166.426 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 5.4 mm -65.35 -35.34 75.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 124.191 0.996 . . . . 2.4300000000000002 111.532 172.138 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.78 -39.4 69.97 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.148 0.885 . . . . 3.5 111.821 -176.633 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.29 -30.9 66.82 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.543 0.737 . . . . 4.2999999999999998 112.985 170.895 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 7.8 tt -65.13 -45.83 83.47 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.617 -0.706 . . . . 3.4900000000000002 110.664 166.917 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -56.56 -48.77 76.62 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.576 1.55 . . . . 2.75 111.257 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 35.8 mtpt -54.75 -32.79 60.35 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.549 1.54 . . . . 5.4299999999999997 113.782 171.592 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 50.7 m -82.51 -30.21 29.97 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.291 1.037 . . . . 3.2599999999999998 113.065 178.618 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 19.1 mt -73.66 -36.07 65.31 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.893 0.877 . . . . 2.9900000000000002 111.988 173.856 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -74.82 74.88 2.12 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 123.178 1.466 . . . . 1.8799999999999999 110.24 -177.892 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.2 tmtm? -61.33 -16.22 43.74 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 114.137 -1.392 . . . . 5.9800000000000004 113.863 -158.424 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 48.1 p-10 -105.89 -14.44 15.21 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 115.777 1.769 . . . . 4.2599999999999998 115.777 172.594 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 40.1 t 56.54 90.88 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.308 1.443 . . . . 4.3600000000000003 113.064 -162.341 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 11.3 p30 -123.91 -79.93 0.62 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.153 1.381 . . . . 3.21 109.864 176.48 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -168.74 -34.77 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 129.77 3.228 . . . . 8.2100000000000009 112.024 177.428 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -129.12 147.22 50.95 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 126.178 1.791 . . . . 2.5699999999999998 110.443 -167.349 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 75.2 mt -97.06 102.36 13.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 121.941 0.877 . . . . 2.6600000000000001 109.105 178.576 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -66.68 152.95 44.39 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.163 1.785 . . . . 3.1400000000000001 108.961 171.752 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -47.65 -41.85 23.14 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.062 1.345 . . . . 3.5299999999999998 113.57 -178.11 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.55 -8.37 59.12 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 115.612 1.708 . . . . 4.0899999999999999 115.612 177.031 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -83.28 -52.29 6.69 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 107.505 -1.295 . . . . 2.1099999999999999 107.505 160.528 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -52.98 -34.0 53.94 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.584 1.954 . . . . 4.2999999999999998 114.867 -174.765 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 79.6 p -63.07 -17.64 62.5 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 117.401 -1.285 . . . . 2.8999999999999999 113.992 174.695 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 92.6 t -56.71 -38.91 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-N 120.837 1.653 . . . . 2.3999999999999999 111.213 168.361 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -60.41 -54.23 48.06 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 118.634 0.652 . . . . 3.0 111.394 172.517 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 69.4 mt -62.8 -37.68 87.69 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 123.784 0.834 . . . . 2.54 110.768 -174.63 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 19.1 m -69.37 -43.35 73.75 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.634 1.574 . . . . 2.71 112.532 175.446 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 5.8 mmm -56.47 -46.11 80.57 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 120.191 1.359 . . . . 3.8700000000000001 111.801 173.101 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 97.3 mt -67.25 -50.72 59.5 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.43 0.692 . . . . 2.7000000000000002 111.365 175.949 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 2.0 t -66.45 -25.58 66.8 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.101 -0.999 . . . . 2.3700000000000001 113.131 -177.151 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 62.7 mtm -73.04 -37.34 66.92 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.156 -0.965 . . . . 4.1699999999999999 112.683 168.36 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.97 -33.87 76.3 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.164 0.893 . . . . 2.2200000000000002 112.049 170.929 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -70.68 -32.85 70.25 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 113.378 0.881 . . . . 3.3500000000000001 113.378 168.381 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -69.74 -42.99 73.21 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.28 0.945 . . . . 4.3300000000000001 112.087 179.845 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -58.04 -46.46 85.3 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.729 1.212 . . . . 3.0299999999999998 112.075 170.818 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.26 -50.67 64.34 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.879 1.272 . . . . 5.3399999999999999 111.424 175.615 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -66.67 -27.71 67.88 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.566 1.546 . . . . 3.6000000000000001 111.336 -177.695 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 34.1 mt -81.16 -9.53 59.78 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 125.414 1.485 . . . . 3.4700000000000002 114.488 177.757 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -87.76 -18.0 30.39 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 120.047 1.294 . . . . 5.5599999999999996 114.168 164.155 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -80.92 -52.92 6.92 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.108 0.963 . . . . 5.0499999999999998 110.821 164.406 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -98.46 28.13 4.34 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.297 1.839 . . . . 5.7999999999999998 113.11 -171.906 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.071 0 C-N-CA 128.272 2.629 . . . . 9.2899999999999991 114.445 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.1 mtt . . . . . 0 N--CA 1.476 0.871 0 N-CA-C 107.361 -1.348 . . . . 8.8399999999999999 107.361 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -154.5 132.99 12.0 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 106.39 -1.707 . . . . 3.9700000000000002 106.39 -165.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.7 p -71.05 168.07 24.04 Favored Pre-proline 0 N--CA 1.478 0.94 0 C-N-CA 123.379 0.671 . . . . 2.5499999999999998 112.805 -171.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -61.28 -20.82 69.73 Favored 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 122.484 2.123 . . . . 2.02 113.211 165.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.01 -41.59 42.11 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.637 1.175 . . . . 3.2999999999999998 111.327 173.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -61.08 -36.05 78.59 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.642 -1.286 . . . . 3.8599999999999999 110.741 169.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.9 mttp -69.97 -32.61 70.91 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.723 -1.236 . . . . 4.2400000000000002 112.749 172.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.05 -53.07 55.71 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.261 1.025 . . . . 1.6499999999999999 111.091 170.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.4 mt -55.31 -43.18 74.64 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.35 1.46 . . . . 2.3100000000000001 111.729 173.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 95.7 m -59.14 -40.95 87.08 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 117.611 -1.185 . . . . 2.5899999999999999 111.678 173.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 29.0 m -66.13 -39.45 89.89 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.397 1.079 . . . . 1.95 110.756 176.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 61.1 mtp -64.19 -40.42 96.06 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.89 1.276 . . . . 3.98 111.691 174.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.35 -33.19 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 123.493 0.717 . . . . 2.8900000000000001 112.291 167.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 94.0 m -71.15 -58.21 3.77 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 117.677 -1.154 . . . . 2.1099999999999999 110.464 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.3 p -65.09 -31.49 72.73 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 118.164 -0.922 . . . . 2.6200000000000001 110.271 178.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -67.32 -64.56 0.83 Allowed 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 119.288 -0.965 . . . . 2.98 110.508 176.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.47 -39.62 84.3 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 120.12 1.327 . . . . 2.3399999999999999 112.462 -176.243 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -60.1 -51.45 69.55 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.766 -1.209 . . . . 4.6200000000000001 112.345 176.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -78.24 -24.34 47.01 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.002 -1.061 . . . . 3.1899999999999999 112.185 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.6 t -68.67 -19.04 64.38 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 126.466 1.906 . . . . 2.5 112.715 173.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.84 2.47 87.18 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 126.057 1.789 . . . . 1.3600000000000001 115.393 167.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.34 -26.01 61.76 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 120.415 2.108 . . . . 4.8700000000000001 113.192 176.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -167.21 177.94 5.89 Favored 'General case' 0 C--O 1.245 0.848 0 C-N-CA 125.776 1.63 . . . . 4.1299999999999999 111.129 -172.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.77 -141.5 44.73 Favored Glycine 0 N--CA 1.468 0.831 0 C-N-CA 124.216 0.912 . . . . 2.2799999999999998 111.951 170.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.1 t -73.97 157.33 36.38 Favored 'General case' 0 CA--C 1.551 1.013 0 O-C-N 121.558 -0.966 . . . . 3.8199999999999998 111.979 159.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -71.48 -12.81 61.58 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 127.009 2.124 . . . . 5.54 112.952 173.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.8 mt -101.57 -11.5 19.2 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.126 1.37 . . . . 4.4500000000000002 112.96 176.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.483 ' HG1' ' CD ' ' A' ' 66' ' ' GLU . 23.9 p -111.04 144.22 40.5 Favored 'General case' 0 C--O 1.248 1.002 0 C-N-CA 125.089 1.355 . . . . 1.9199999999999999 112.86 176.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.8 mt -95.08 104.94 16.82 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.324 1.05 . . . . 2.5699999999999998 109.396 161.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.6 p -57.33 162.09 2.97 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 120.684 -1.26 . . . . 3.0699999999999998 111.223 168.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -50.55 -25.42 4.07 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 120.133 -1.604 . . . . 3.8399999999999999 114.267 174.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.87 -45.42 18.68 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.105 0.962 . . . . 5.1299999999999999 113.212 171.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -62.48 -41.64 98.93 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.888 0.875 . . . . 1.4299999999999999 110.947 175.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.2 tp -66.14 -46.65 76.74 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.176 0.591 . . . . 2.8799999999999999 110.09 176.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 15.4 ttmt -61.81 -46.14 90.79 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.054 0.843 . . . . 4.54 111.803 178.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -45.05 -59.87 2.38 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 117.406 -1.283 . . . . 3.6299999999999999 111.84 165.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.0 -54.14 49.54 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.974 1.261 . . . . 2.7400000000000002 112.407 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.7 mt -56.25 -42.66 74.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 119.592 1.087 . . . . 1.9099999999999999 109.509 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 26.1 mmmt -64.87 -14.41 59.48 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 113.524 0.935 . . . . 4.3099999999999996 113.524 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 32.2 mmtm -102.22 -38.28 7.74 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.988 1.267 . . . . 4.3600000000000003 113.726 169.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -82.99 -31.62 27.41 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.534 1.534 . . . . 3.6800000000000002 112.472 -166.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -117.34 94.71 4.66 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.574 1.149 . . . . 3.5 109.19 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.4 t -79.11 -6.25 56.02 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 115.048 1.499 . . . . 3.48 115.048 -166.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.31 33.77 0.08 Allowed 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 117.65 2.463 . . . . 4.6399999999999997 117.65 -161.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.78 -46.88 2.69 Favored Glycine 0 N--CA 1.477 1.383 0 C-N-CA 125.469 1.509 . . . . 3.7799999999999998 115.407 166.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.476 ' CD ' ' HZ3' ' A' ' 48' ' ' LYS . 38.0 mm-40 -86.07 7.23 25.5 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.357 1.243 . . . . 5.2400000000000002 114.357 -176.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.7 66.2 0.73 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 124.677 2.179 . . . . 3.1299999999999999 111.001 163.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.476 ' HZ3' ' CD ' ' A' ' 46' ' ' GLU . 60.7 mttp -101.4 165.55 11.2 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 128.363 2.665 . . . . 4.9900000000000002 110.839 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -62.8 -45.47 92.48 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 115.193 1.553 . . . . 3.7400000000000002 115.193 -160.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.3 t -73.83 -28.67 61.73 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 117.91 -1.043 . . . . 3.21 113.3 172.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.77 -38.69 79.04 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.548 1.522 . . . . 3.1699999999999999 110.61 170.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 65.3 mt -81.85 -39.22 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 124.875 1.27 . . . . 2.1699999999999999 112.73 -176.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -76.71 -26.87 55.17 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 118.99 0.814 . . . . 3.3500000000000001 112.787 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -78.6 -38.69 39.39 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.116 0.871 . . . . 2.25 112.208 168.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 39.3 tp -55.03 -54.06 47.91 Favored 'General case' 0 C--N 1.344 0.362 0 O-C-N 121.462 -0.774 . . . . 2.8399999999999999 109.964 168.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 8.9 tpt -48.61 -49.45 36.96 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.706 2.002 . . . . 2.1099999999999999 111.913 176.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.58 -25.6 60.24 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.037 1.335 . . . . 4.6299999999999999 113.66 176.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.7 t -96.3 -25.87 15.6 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.941 1.297 . . . . 2.3799999999999999 113.788 177.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.1 mt -73.37 -41.93 62.8 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.154 0.981 . . . . 3.1099999999999999 111.565 173.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -69.32 149.74 48.11 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.495 0.718 . . . . 1.6899999999999999 112.053 176.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.19 -10.14 19.86 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 120.954 -1.091 . . . . 3.9199999999999999 113.791 -176.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -148.52 -10.84 0.35 Allowed 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.962 1.467 . . . . 3.1200000000000001 114.962 -165.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.0 t 79.66 18.95 0.7 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.625 2.37 . . . . 3.9700000000000002 113.315 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.3 p30 -65.05 -24.3 67.43 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.331 1.452 . . . . 2.2400000000000002 110.928 -178.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 63.84 22.23 12.95 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 130.701 3.6 . . . . 5.0599999999999996 114.211 -172.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.483 ' CD ' ' HG1' ' A' ' 28' ' ' THR . 4.1 mm-40 -115.78 121.35 42.18 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 128.907 2.883 . . . . 2.6099999999999999 107.304 164.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 14.1 mm -93.03 105.02 16.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 124.998 1.319 . . . . 1.95 109.037 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.23 158.13 36.41 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.894 2.078 . . . . 2.52 111.379 167.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -54.82 -34.0 62.27 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.982 -1.074 . . . . 3.0699999999999998 113.704 -175.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm -78.88 -27.31 43.99 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 120.781 -1.199 . . . . 3.4900000000000002 112.347 177.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -64.82 -53.02 53.42 Favored 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 108.307 -0.997 . . . . 1.77 108.307 163.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -55.57 -31.38 62.14 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 119.866 -1.771 . . . . 3.2599999999999998 114.349 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.53 -24.04 63.34 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 119.543 -1.973 . . . . 2.3199999999999998 114.28 172.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 49.0 t -63.81 -41.33 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 CA-C-N 119.067 0.849 . . . . 2.8500000000000001 110.153 172.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -61.26 -51.83 67.29 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.036 0.934 . . . . 3.0600000000000001 111.116 176.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.8 mt -59.3 -38.11 79.42 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.894 1.278 . . . . 3.3300000000000001 112.204 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 83.2 m -59.87 -55.79 29.75 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.803 0.841 . . . . 1.76 110.545 175.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 75.0 mtm -61.44 -40.27 93.85 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 111.951 0.352 . . . . 2.04 111.951 -176.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 89.0 mt -69.15 -37.0 78.02 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.281 0.845 . . . . 2.5 113.281 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 5.7 t -73.94 -31.53 63.09 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.134 0.879 . . . . 2.8500000000000001 112.979 176.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 49.1 mtp -67.65 -42.76 81.72 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.319 0.509 . . . . 2.5800000000000001 111.652 167.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.07 -41.1 91.18 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.071 -1.018 . . . . 2.1200000000000001 112.621 -175.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -68.4 -26.94 65.8 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 113.12 0.785 . . . . 3.6099999999999999 113.12 174.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -67.88 -43.5 79.23 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 120.231 1.378 . . . . 2.3399999999999999 112.734 169.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -71.26 -28.8 64.41 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.731 0.813 . . . . 4.1100000000000003 110.973 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.46 -51.01 70.48 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.855 1.262 . . . . 2.8799999999999999 111.652 164.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 35.3 t80 -60.14 -33.43 72.15 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.104 1.362 . . . . 3.6400000000000001 112.316 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 41.1 mt -68.02 -20.28 64.98 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.859 1.264 . . . . 2.1899999999999999 113.87 173.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.538 ' CD ' ' HZ2' ' A' ' 92' ' ' LYS . 25.1 mm-40 -101.11 -9.95 20.9 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.632 1.173 . . . . 2.6400000000000001 114.09 176.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -109.75 -47.41 3.36 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.163 1.385 . . . . 2.7200000000000002 113.079 -173.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -82.6 10.05 8.19 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.912 0.885 . . . . 3.5 113.217 -179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.538 ' HZ2' ' CD ' ' A' ' 89' ' ' GLU . 15.0 pttm . . . . . 0 C--O 1.249 1.072 0 CA-C-O 115.482 -2.199 . . . . 3.8399999999999999 116.274 -174.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.822 0 N-CA-C 107.624 -1.25 . . . . 6.8799999999999999 107.624 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -144.44 140.36 28.92 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 125.84 1.656 . . . . 4.7699999999999996 106.818 -169.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 59.1 p -74.6 166.69 42.98 Favored Pre-proline 0 N--CA 1.473 0.71 0 C-N-CA 124.971 1.308 . . . . 2.7000000000000002 113.519 -167.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.69 -21.51 69.72 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.579 2.186 . . . . 1.6499999999999999 112.967 167.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.57 -44.11 36.03 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 119.397 0.999 . . . . 3.3399999999999999 110.842 173.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -58.93 -35.07 72.47 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.398 -0.814 . . . . 3.6299999999999999 111.026 170.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -74.94 -27.95 60.4 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 119.869 -1.769 . . . . 4.6100000000000003 113.72 173.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.8 -50.66 61.93 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.373 1.069 . . . . 1.5600000000000001 110.8 169.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 48.0 mt -56.83 -39.73 74.75 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.282 1.433 . . . . 2.46 111.898 169.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 88.0 m -62.39 -43.27 99.22 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 117.918 -1.039 . . . . 2.5499999999999998 111.033 173.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 62.0 m -57.74 -47.85 81.29 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.583 1.083 . . . . 2.0899999999999999 109.896 173.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 61.9 mtp -59.2 -43.41 92.22 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.086 1.354 . . . . 3.29 112.826 175.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 32.2 t -64.76 -32.59 58.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 O-C-N 121.009 -1.057 . . . . 2.8900000000000001 112.045 173.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 89.3 m -74.49 -45.23 47.37 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.336 1.455 . . . . 1.77 112.16 -178.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 22.4 p -70.64 -37.86 73.8 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.293 0.637 . . . . 2.1800000000000002 109.536 173.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -62.66 -66.59 0.52 Allowed 'General case' 0 C--O 1.219 -0.53 0 CA-C-O 117.383 -1.294 . . . . 3.2200000000000002 109.864 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -59.06 -29.5 67.36 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 121.544 1.975 . . . . 2.46 112.653 -173.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -62.17 -56.52 17.9 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.976 -1.078 . . . . 4.1299999999999999 113.455 173.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -81.24 -34.15 32.32 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.422 -0.799 . . . . 3.5299999999999998 112.979 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.5 t -64.76 -20.61 66.45 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 127.535 2.334 . . . . 2.5899999999999999 112.032 174.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.32 -5.44 79.56 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 127.307 2.384 . . . . 1.8600000000000001 116.133 170.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.52 -4.53 50.89 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-N 119.709 1.754 . . . . 3.9900000000000002 114.596 -163.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -165.35 161.6 19.11 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.393 1.477 . . . . 3.6699999999999999 111.843 174.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.13 -131.42 52.04 Favored Glycine 0 N--CA 1.472 1.082 0 O-C-N 120.985 -1.072 . . . . 2.7799999999999998 111.027 173.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 18.9 m -80.88 159.02 25.13 Favored 'General case' 0 CA--C 1.546 0.793 0 O-C-N 121.699 -0.883 . . . . 4.2000000000000002 111.184 166.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -93.35 -3.3 53.64 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 116.557 2.058 . . . . 6.7300000000000004 116.557 -167.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 22.9 tp -112.28 16.21 20.1 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.503 1.521 . . . . 4.29 110.625 178.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 23.3 p -148.78 133.1 17.48 Favored 'General case' 0 C--O 1.242 0.702 0 C-N-CA 127.029 2.132 . . . . 1.78 109.545 -161.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 5.7 mt -98.57 96.23 7.82 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.058 1.343 . . . . 2.7999999999999998 112.539 179.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 14.9 t -43.25 152.92 0.11 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.867 2.067 . . . . 2.8900000000000001 112.764 160.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.7 ttp85 -43.13 -27.96 0.25 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.779 1.632 . . . . 3.8599999999999999 113.323 171.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.6 -45.21 11.26 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.577 1.325 . . . . 4.9299999999999997 114.577 172.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -58.73 -38.22 77.87 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.686 1.194 . . . . 1.8999999999999999 111.47 174.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 29.4 tp -72.15 -44.57 62.89 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.862 1.265 . . . . 3.0 110.603 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.3 ttmm -67.58 -36.28 80.6 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 120.707 -1.246 . . . . 3.9300000000000002 112.396 -179.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -52.2 -68.01 0.2 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.578 1.551 . . . . 3.4100000000000001 111.619 157.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 tt -52.23 -49.41 64.03 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.67 1.188 . . . . 2.7799999999999998 112.875 -174.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 48.4 mt -58.62 -51.33 73.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 108.461 -0.94 . . . . 1.95 108.461 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -72.14 -9.11 57.98 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 112.841 0.682 . . . . 4.3600000000000003 112.841 -175.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -91.28 -37.22 13.42 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.707 1.603 . . . . 4.3499999999999996 113.664 168.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -88.89 -27.24 21.13 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.219 1.408 . . . . 3.9399999999999999 113.885 -175.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -117.46 108.26 15.32 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.588 1.155 . . . . 3.0600000000000001 110.631 -174.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 8.0 t -79.23 3.92 16.49 Favored 'General case' 0 CA--C 1.555 1.15 0 N-CA-C 115.064 1.505 . . . . 3.6000000000000001 115.064 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -61.88 -42.83 99.53 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.83 2.052 . . . . 3.5600000000000001 115.439 -161.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.23 -23.79 34.13 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 124.672 1.13 . . . . 4.0700000000000003 114.49 -178.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.476 ' CD ' ' HZ3' ' B' ' 48' ' ' LYS . 46.4 mm-40 -86.97 9.44 19.45 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 118.743 1.272 . . . . 5.1299999999999999 113.711 167.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.76 57.91 2.66 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 123.896 1.807 . . . . 2.9199999999999999 111.096 165.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.476 ' HZ3' ' CD ' ' B' ' 46' ' ' GLU . 59.6 mttp -89.56 161.47 16.17 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.733 2.413 . . . . 4.4800000000000004 112.334 -177.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -53.2 -53.17 54.61 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 115.902 1.816 . . . . 3.27 115.902 -166.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 5.2 m -73.01 -28.26 62.26 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 119.767 1.167 . . . . 3.27 114.002 178.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 1.2 t -61.72 -42.05 98.44 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.312 0.645 . . . . 3.2200000000000002 109.779 169.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 47.7 mt -73.82 -35.06 42.06 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.191 0 C-N-CA 124.353 1.061 . . . . 2.2799999999999998 112.61 176.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.66 -35.67 72.99 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.197 0.908 . . . . 2.8100000000000001 111.408 178.005 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -69.47 -46.47 66.58 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 119.199 0.909 . . . . 2.5099999999999998 111.425 167.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 51.7 tp -55.88 -49.36 73.58 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.151 0.98 . . . . 2.9300000000000002 110.628 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.22 -57.8 9.24 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.662 1.185 . . . . 2.4900000000000002 110.12 172.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -25.76 44.87 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.836 1.254 . . . . 4.1600000000000001 113.83 176.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 13.8 m -88.67 -27.42 21.28 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.639 1.976 . . . . 3.0800000000000001 113.028 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 66.6 mt -78.72 -39.25 36.9 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 125.705 1.602 . . . . 3.1099999999999999 111.096 174.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -76.27 73.1 3.07 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.872 2.069 . . . . 1.6899999999999999 112.808 -171.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.36 -30.71 0.88 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 125.927 1.691 . . . . 3.9900000000000002 114.614 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -112.95 -4.28 13.94 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.779 2.431 . . . . 2.3100000000000001 114.083 -168.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 8.5 t 65.31 14.94 9.75 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 115.322 1.601 . . . . 3.3199999999999998 115.322 173.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -79.74 -15.83 56.76 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.335 1.454 . . . . 2.3900000000000001 111.651 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 68.0 14.44 9.35 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 128.841 2.857 . . . . 5.1699999999999999 114.371 174.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -101.21 153.36 19.68 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-O 124.169 1.938 . . . . 2.7599999999999998 110.61 141.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 29.9 mm -99.62 101.41 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 127.477 2.311 . . . . 2.3500000000000001 108.296 171.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.82 162.52 3.14 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.404 1.482 . . . . 2.5099999999999998 112.143 162.753 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.61 -36.76 67.3 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.05 -1.031 . . . . 3.4300000000000002 113.083 -177.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -80.2 -17.66 51.73 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 120.939 -1.101 . . . . 4.2800000000000002 112.26 178.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -73.92 -44.94 53.46 Favored 'General case' 0 CA--C 1.552 1.046 0 O-C-N 121.156 -0.965 . . . . 1.8 109.233 163.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -62.88 -30.98 71.93 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.871 1.669 . . . . 3.1400000000000001 112.969 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 85.9 p -63.68 -24.39 67.76 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 119.973 -1.705 . . . . 2.3599999999999999 113.433 172.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 24.4 t -67.26 -36.13 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 CA-C-N 119.561 1.073 . . . . 2.5299999999999998 110.984 174.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -63.22 -53.13 57.97 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.836 0.854 . . . . 2.7200000000000002 110.916 173.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 83.7 mt -57.74 -36.54 72.22 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.217 1.007 . . . . 2.46 111.945 177.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 93.1 m -62.4 -54.06 45.83 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.894 1.278 . . . . 1.74 111.538 175.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.2 mtm -58.41 -39.42 79.68 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 118.164 0.438 . . . . 2.1800000000000002 111.662 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 94.3 mt -69.92 -45.25 67.95 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.669 -0.682 . . . . 2.6499999999999999 112.297 177.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 87.1 m -64.24 -32.46 74.06 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.672 1.124 . . . . 3.0299999999999998 113.205 176.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 52.6 mtp -71.24 -38.86 71.94 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.977 0.808 . . . . 2.9399999999999999 112.522 168.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.9 -36.78 75.68 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.084 1.311 . . . . 1.9199999999999999 112.955 -177.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -75.35 -26.15 58.34 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.787 -0.571 . . . . 3.8900000000000001 111.824 176.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -66.08 -42.99 88.63 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.793 0.837 . . . . 2.6200000000000001 112.267 166.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -71.17 -26.99 63.21 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.142 0.577 . . . . 3.7200000000000002 111.408 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -54.76 35.57 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.511 1.524 . . . . 3.29 112.266 162.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -59.48 -27.73 66.39 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.592 1.957 . . . . 3.1899999999999999 112.556 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 16.8 mt -72.38 -11.48 60.71 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 126.163 1.785 . . . . 2.5800000000000001 114.446 176.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -96.38 -3.93 42.8 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 113.625 0.972 . . . . 3.8999999999999999 113.625 170.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -117.43 -65.1 1.22 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.391 1.476 . . . . 3.1899999999999999 110.919 -178.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -87.37 40.47 0.93 Allowed 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 126.932 2.093 . . . . 4.7300000000000004 112.45 173.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp . . . . . 0 C--O 1.251 1.141 0 C-N-CA 129.558 3.143 . . . . 8.0199999999999996 116.493 -169.069 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.6 mtt . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 108.351 -0.981 . . . . 6.5099999999999998 108.351 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -96.58 -26.49 15.22 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 124.223 0.952 . . . . 5.0499999999999998 112.372 -149.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.443 ' HB ' ' H ' ' A' ' 5' ' ' LEU . 40.7 p -158.7 161.59 28.09 Favored Pre-proline 0 CA--C 1.534 0.338 0 C-N-CA 127.527 2.331 . . . . 3.1800000000000002 109.968 -176.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -70.74 -8.71 24.23 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.708 2.272 . . . . 2.0800000000000001 112.188 157.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.443 ' H ' ' HB ' ' A' ' 3' ' ' THR . 0.3 OUTLIER -73.32 -47.4 42.94 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.751 2.02 . . . . 3.6299999999999999 110.247 179.963 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.32 -40.61 71.37 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.066 0.848 . . . . 3.3399999999999999 111.199 167.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.9 mtpt -67.87 -28.15 67.29 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 119.829 -1.794 . . . . 6.6500000000000004 114.113 173.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.83 -50.6 19.67 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.471 1.108 . . . . 2.2200000000000002 110.653 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.0 mt -56.04 -50.6 70.48 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.862 1.265 . . . . 2.9100000000000001 110.497 175.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 32.5 p -65.89 -39.65 90.85 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 116.845 -1.55 . . . . 3.4500000000000002 112.398 178.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 50.0 m -57.55 -45.75 84.75 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 120.603 1.547 . . . . 2.4399999999999999 109.949 172.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 12.8 ttp -66.85 -45.11 79.21 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.444 1.098 . . . . 3.8100000000000001 112.126 -175.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -60.13 -41.62 87.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 124.799 1.24 . . . . 3.3799999999999999 112.023 171.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 90.4 m -61.43 -52.05 66.17 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.218 1.007 . . . . 2.3199999999999998 111.333 177.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.46 -36.93 67.1 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 119.148 -0.453 . . . . 2.8599999999999999 111.302 170.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -64.02 -37.51 87.7 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 120.81 -0.356 . . . . 3.0600000000000001 111.708 -177.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.3 m-70 -62.29 -50.26 72.37 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.098 0.863 . . . . 5.0999999999999996 111.718 170.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.75 -38.65 85.93 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.423 0.689 . . . . 7.8099999999999996 112.842 -176.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -76.58 -43.87 36.94 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.79 0.836 . . . . 4.5199999999999996 111.303 172.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.0 t -64.43 -38.73 92.06 Favored 'General case' 0 C--O 1.241 0.635 0 O-C-N 119.936 -1.727 . . . . 2.6899999999999999 113.244 -176.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.36 3.59 86.49 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 126.178 1.847 . . . . 1.76 115.325 -175.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.09 -43.23 61.03 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.464 1.505 . . . . 6.0999999999999996 113.958 175.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 178.29 -138.3 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 129.28 3.032 . . . . 3.77 107.116 -173.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -11.6 99.06 0.01 OUTLIER Glycine 0 N--CA 1.475 1.263 0 C-N-CA 127.939 2.685 . . . . 3.7599999999999998 114.284 -174.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.2 t 57.4 163.4 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 116.357 1.984 . . . . 3.1099999999999999 116.357 175.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -137.68 134.71 35.72 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.429 1.891 . . . . 5.8099999999999996 110.532 -171.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 92.9 mt 92.34 -9.08 0.2 Allowed 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 130.135 3.374 . . . . 4.2599999999999998 111.042 -158.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.1 p -132.49 152.16 51.64 Favored 'General case' 0 C--O 1.249 1.035 0 C-N-CA 127.68 2.392 . . . . 2.5699999999999998 114.021 -176.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 10.8 mt -104.62 103.63 13.32 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.163 1.385 . . . . 3.0 109.638 172.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.4 t -72.88 150.92 42.22 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 120.395 -1.441 . . . . 3.02 111.017 168.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -40.61 -45.31 2.3 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 116.444 2.016 . . . . 4.0300000000000002 116.444 -165.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.45 -31.45 69.77 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.178 -1.576 . . . . 4.8499999999999996 114.022 177.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -68.52 -47.07 67.9 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.441 1.897 . . . . 2.0299999999999998 109.812 173.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.1 tp -59.8 -37.85 80.28 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.148 0.579 . . . . 2.8799999999999999 111.117 175.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.1 ttmt -68.33 -42.63 79.03 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 121.654 -0.654 . . . . 3.9900000000000002 111.845 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -51.24 -44.0 61.61 Favored 'General case' 0 CA--C 1.55 0.956 0 CA-C-N 118.405 0.548 . . . . 5.4100000000000001 112.244 164.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.2 tt -63.23 -64.1 1.0 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.013 0.925 . . . . 2.96 111.324 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.3 mt -56.94 -50.08 77.01 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 N-CA-C 108.851 -0.796 . . . . 1.74 108.851 -175.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.3 tttt -66.22 -13.17 59.89 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 119.708 1.14 . . . . 4.75 113.941 -176.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -95.88 -32.89 12.43 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 117.914 -1.041 . . . . 3.9700000000000002 113.809 168.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -80.82 -46.82 14.75 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.963 1.705 . . . . 4.2999999999999998 111.554 -178.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 26.6 mt -147.44 80.8 1.51 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.157 1.783 . . . . 3.9300000000000002 110.409 -177.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 43.9 t -91.84 -51.01 5.43 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 120.398 -1.439 . . . . 5.54 111.969 169.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.6 mp 52.53 -143.6 0.69 Allowed 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.94 1.296 . . . . 4.5999999999999996 108.17 -165.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -95.64 10.8 68.72 Favored Glycine 0 CA--C 1.533 1.199 0 O-C-N 121.263 -0.898 . . . . 4.5599999999999996 112.312 157.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -107.32 -55.52 2.33 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 118.166 0.983 . . . . 5.5800000000000001 112.812 -157.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 42.7 tpp -76.59 88.01 3.29 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.337 1.455 . . . . 2.73 110.733 -171.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.8 mttp -87.11 166.97 14.6 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.569 1.548 . . . . 4.5599999999999996 112.737 -175.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -47.61 -53.17 15.49 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 115.593 1.701 . . . . 4.3700000000000001 115.593 -169.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.3 m -73.98 -26.58 60.54 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.139 0.792 . . . . 4.2800000000000002 113.139 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.8 m -71.27 -29.79 65.5 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 118.819 0.736 . . . . 3.1099999999999999 110.829 174.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.4 mt -68.55 -47.78 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.214 1.005 . . . . 2.3100000000000001 110.676 169.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -71.03 -30.92 67.26 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 112.787 0.662 . . . . 4.0499999999999998 112.787 -176.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.506 ' CG ' ' HZ3' ' A' ' 57' ' ' LYS . 13.4 t70 -73.9 -37.75 64.57 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.355 -0.841 . . . . 3.1200000000000001 112.229 170.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 64.8 tp -60.84 -40.32 92.37 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-O 117.738 -1.125 . . . . 3.1699999999999999 111.109 169.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -57.31 -51.51 69.08 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 120.278 1.399 . . . . 2.5699999999999998 110.213 176.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.506 ' HZ3' ' CG ' ' A' ' 54' ' ' ASP . 1.5 tttm -50.66 -30.39 13.44 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.228 1.411 . . . . 4.0599999999999996 113.673 168.055 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.35 -32.36 22.49 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.515 1.126 . . . . 2.5699999999999998 112.205 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.7 mt -67.27 -41.54 85.35 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.091 0.956 . . . . 3.4399999999999999 110.622 173.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -94.47 80.02 3.88 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.93 2.092 . . . . 1.6399999999999999 113.297 -167.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -58.77 -21.6 56.16 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 115.044 1.498 . . . . 4.4299999999999997 115.044 -166.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -106.69 -5.73 18.38 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.201 1.4 . . . . 2.9100000000000001 114.374 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.5 t 58.61 31.16 20.79 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.915 1.286 . . . . 3.3199999999999998 114.215 -175.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.6 p30 -69.68 -14.64 62.91 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.578 1.151 . . . . 2.6000000000000001 111.791 175.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 68.02 8.5 6.54 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 129.861 3.264 . . . . 5.3399999999999999 114.39 -178.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -112.56 120.13 40.52 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 127.092 2.157 . . . . 3.1299999999999999 107.554 172.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 15.4 mm -90.23 101.28 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 123.466 0.707 . . . . 2.3399999999999999 109.256 174.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -48.35 155.42 0.51 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.24 1.016 . . . . 3.5899999999999999 111.955 161.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.434 ' CZ ' ' HB3' ' B' ' 80' ' ' CYS . 0.1 OUTLIER -51.43 -41.85 61.11 Favored 'General case' 0 CA--C 1.548 0.865 0 O-C-N 120.634 -1.291 . . . . 4.6399999999999997 110.982 158.122 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.8 pttm -66.86 -21.08 66.02 Favored 'General case' 0 CA--C 1.552 1.023 0 O-C-N 120.035 -1.666 . . . . 4.6299999999999999 114.781 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -85.39 -48.78 8.69 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.147 1.379 . . . . 2.2799999999999998 110.834 170.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -55.89 -33.8 64.96 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 126.029 1.732 . . . . 3.2000000000000002 112.43 174.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.3 t -58.94 -29.1 66.87 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.542 -1.349 . . . . 2.6600000000000001 113.333 170.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 19.2 t -69.34 -36.86 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 O-C-N 120.563 -1.335 . . . . 3.04 110.407 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -63.32 -51.72 64.87 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.525 1.13 . . . . 4.0300000000000002 111.722 169.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 65.9 mt -58.01 -33.77 69.31 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 118.512 0.596 . . . . 2.9100000000000001 112.388 176.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 50.0 m -62.41 -54.73 35.95 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.642 1.177 . . . . 2.04 110.344 171.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 45.6 mtp -53.27 -45.99 69.08 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.401 1.08 . . . . 2.96 112.028 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.8 mt -66.83 -48.83 67.68 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 123.898 0.879 . . . . 2.3999999999999999 112.211 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 9.0 t -66.76 -34.4 77.74 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.695 -0.628 . . . . 2.3500000000000001 112.406 -178.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 89.9 mtp -64.61 -39.1 93.11 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.289 0.636 . . . . 2.2200000000000002 112.258 168.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.32 -34.68 78.52 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.669 1.122 . . . . 1.5700000000000001 112.743 177.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -63.42 -23.18 67.29 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 113.357 0.873 . . . . 4.0199999999999996 113.357 170.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.65 -40.45 88.69 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 119.923 1.238 . . . . 3.1000000000000001 112.472 170.081 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -71.58 -39.24 70.71 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.681 0.792 . . . . 3.1400000000000001 110.825 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.2 -43.35 67.12 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.25 1.42 . . . . 2.98 112.287 170.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -67.76 -27.46 66.79 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.234 1.414 . . . . 3.8999999999999999 112.971 177.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.3 mt -74.31 -15.49 60.96 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 113.454 0.909 . . . . 3.0499999999999998 113.454 172.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.555 ' CD ' ' HZ2' ' A' ' 92' ' ' LYS . 13.0 mm-40 -95.07 -4.84 45.64 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.873 1.269 . . . . 4.5300000000000002 114.394 173.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -97.95 -51.18 4.14 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.131 1.372 . . . . 3.77 111.805 175.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -77.58 9.6 3.24 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.036 1.334 . . . . 2.98 114.597 -174.155 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.555 ' HZ2' ' CD ' ' A' ' 89' ' ' GLU . 15.2 pttm . . . . . 0 C--O 1.25 1.122 0 CA-C-O 115.443 -2.218 . . . . 5.3499999999999996 116.54 -174.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 108.369 -0.974 . . . . 6.1500000000000004 108.369 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.74 154.83 37.92 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 126.748 2.019 . . . . 6.04 110.521 172.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 74.2 p -67.53 164.2 40.72 Favored Pre-proline 0 N--CA 1.466 0.37 0 C-N-CA 126.602 1.961 . . . . 3.1200000000000001 111.601 177.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.46 -21.95 69.9 Favored 'Trans proline' 0 CA--C 1.537 0.65 0 C-N-CA 121.987 1.791 . . . . 1.5900000000000001 113.235 170.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -83.89 -42.35 16.46 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.757 1.162 . . . . 4.2599999999999998 112.417 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -59.81 -43.18 94.63 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 118.918 0.781 . . . . 4.1799999999999997 110.214 168.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -62.76 -39.29 93.71 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 120.855 -1.153 . . . . 4.8499999999999996 112.471 171.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.97 -52.68 62.06 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.44 1.018 . . . . 1.8 111.23 176.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 37.6 mt -57.38 -39.04 75.22 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.785 1.234 . . . . 2.5499999999999998 112.231 176.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 94.8 m -61.75 -51.98 66.1 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.451 0.7 . . . . 2.4199999999999999 110.793 171.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 86.5 m -55.54 -36.22 66.53 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.396 1.478 . . . . 2.3799999999999999 112.28 -179.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 75.1 mmm -55.63 -51.98 65.37 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 122.926 0.49 . . . . 4.0999999999999996 111.943 170.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.17 -26.07 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.158 0.89 . . . . 3.3999999999999999 112.842 -178.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 25.4 m -56.67 -56.49 20.75 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.078 1.351 . . . . 1.97 110.844 169.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.98 -35.94 77.29 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 118.08 -0.962 . . . . 3.27 109.482 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -59.73 -49.25 78.45 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 118.448 -0.787 . . . . 3.6099999999999999 111.972 177.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 15.8 m80 -56.82 -48.69 77.44 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 120.012 1.278 . . . . 2.71 111.544 173.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -26.62 65.93 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 124.144 0.978 . . . . 6.8300000000000001 113.082 178.216 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -87.96 -30.24 20.18 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.6 -1.313 . . . . 4.7300000000000004 113.281 168.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 42.2 p -87.24 -36.99 17.63 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 120.914 1.688 . . . . 2.0600000000000001 114.678 -162.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.45 3.15 85.85 Favored Glycine 0 CA--C 1.533 1.166 0 O-C-N 119.714 -1.866 . . . . 1.55 112.922 169.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -43.23 91.68 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 119.042 1.421 . . . . 5.7300000000000004 111.81 -172.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -138.27 157.78 45.59 Favored 'General case' 0 C--O 1.249 1.073 0 C-N-CA 127.237 2.215 . . . . 4.5599999999999996 111.153 173.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.88 7.1 10.92 Favored Glycine 0 CA--C 1.534 1.233 0 CA-C-N 114.703 -1.135 . . . . 2.7400000000000002 113.25 -167.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 53.9 m 48.1 -145.51 0.32 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.044 1.737 . . . . 7.96 111.464 -161.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 32.3 mtpt 71.53 -163.94 0.13 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 127.324 2.25 . . . . 12.16 111.938 169.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 5.4 mp -106.68 14.07 27.34 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.655 1.582 . . . . 5.6299999999999999 111.63 168.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 74.7 p -108.72 149.44 29.0 Favored 'General case' 0 C--O 1.248 1.023 0 C-N-CA 126.223 1.809 . . . . 2.3700000000000001 113.402 -174.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -115.13 90.62 3.38 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.712 2.405 . . . . 3.0899999999999999 109.45 -157.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.2 m -81.53 160.58 23.86 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.324 1.45 . . . . 2.8500000000000001 113.304 -173.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -40.44 -41.26 1.37 Allowed 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 116.41 2.004 . . . . 4.2300000000000004 116.41 -175.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? -78.63 -43.04 27.22 Favored 'General case' 0 CA--C 1.546 0.827 0 O-C-N 119.971 -1.706 . . . . 7.1900000000000004 112.034 175.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -53.7 -44.16 69.56 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.364 0.983 . . . . 1.72 109.6 172.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.43 -49.33 77.27 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.889 2.076 . . . . 3.27 112.029 176.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -52.39 -47.1 66.42 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 121.093 -1.005 . . . . 3.4700000000000002 111.795 169.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -68.67 -24.21 64.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.108 1.763 . . . . 3.4199999999999999 114.381 177.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.5 tt -71.58 -59.32 2.82 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.001 1.32 . . . . 3.2200000000000002 108.912 172.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 78.8 mt -53.76 -58.71 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.386 0.674 . . . . 2.54 110.419 -176.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -9.15 8.56 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 114.07 1.137 . . . . 6.0499999999999998 114.07 -172.595 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.29 -40.79 3.59 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 125.942 1.697 . . . . 6.9900000000000002 110.836 -177.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -68.04 -49.9 58.58 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.187 1.358 . . . . 3.9199999999999999 110.839 176.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -115.21 178.24 4.36 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.979 2.512 . . . . 3.9300000000000002 111.93 -171.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.1 m -138.55 -43.35 0.49 Allowed 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 114.774 1.398 . . . . 4.4800000000000004 114.774 165.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 7.4 mp 50.92 -112.73 0.65 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.626 1.571 . . . . 6.6399999999999997 111.759 -176.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -157.99 -58.12 0.01 OUTLIER Glycine 0 N--CA 1.471 1.023 0 CA-C-N 119.067 0.848 . . . . 4.6699999999999999 113.934 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.71 -23.43 66.11 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 117.45 0.625 . . . . 6.7300000000000004 112.018 174.279 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 2.0 ttm -58.5 104.88 0.24 Allowed 'General case' 0 C--N 1.338 0.105 0 C-N-CA 124.988 1.315 . . . . 3.3399999999999999 113.538 -157.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -163.62 176.7 9.4 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 128.122 2.569 . . . . 5.0999999999999996 109.532 -171.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 33.7 tp10 -39.35 -58.9 1.14 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.912 1.685 . . . . 4.8399999999999999 113.639 -171.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 3.7 m -74.18 -4.88 38.55 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 116.439 2.014 . . . . 3.0 116.439 -176.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 97.6 p -102.21 -28.72 12.13 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 120.979 1.718 . . . . 3.0299999999999998 112.5 161.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 54.0 mt -69.5 -39.77 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.645 1.578 . . . . 2.8599999999999999 112.826 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -72.33 -37.4 68.9 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.637 0.653 . . . . 2.9300000000000002 112.546 -177.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.403 ' CG ' ' HZ1' ' B' ' 57' ' ' LYS . 11.6 t70 -67.92 -45.39 74.5 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.42 -0.8 . . . . 2.96 111.315 169.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 4.7 tt -51.86 -51.37 57.17 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 117.588 -1.196 . . . . 3.2400000000000002 110.211 176.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.6 ppp? -64.72 -44.83 88.95 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.128 0.876 . . . . 2.7599999999999998 112.021 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . 0.403 ' HZ1' ' CG ' ' B' ' 54' ' ' ASP . 0.7 OUTLIER -58.54 -32.29 68.75 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.607 1.163 . . . . 4.7000000000000002 111.832 174.356 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 58.9 m -80.49 -16.92 53.14 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.969 1.307 . . . . 2.6000000000000001 113.663 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 17.7 mt -73.78 -40.32 63.53 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 119.124 0.874 . . . . 3.2000000000000002 110.442 165.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -76.32 149.27 37.07 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.696 1.199 . . . . 2.1499999999999999 114.2 -176.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.77 -2.73 9.28 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.756 1.222 . . . . 3.7200000000000002 112.997 171.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -103.86 -27.47 12.18 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.547 1.314 . . . . 3.0899999999999999 114.547 -168.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 16.4 t 69.5 30.62 4.0 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.246 1.819 . . . . 3.9100000000000001 111.9 -158.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 42.5 p30 -91.21 -24.92 19.75 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.376 1.071 . . . . 2.4100000000000001 112.629 -172.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 63.38 16.8 9.81 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 129.24 3.016 . . . . 5.9900000000000002 113.697 -171.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -116.8 122.23 43.84 Favored 'General case' 0 C--O 1.24 0.565 0 C-N-CA 129.173 2.989 . . . . 2.6800000000000002 108.826 176.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 25.1 mm -101.37 87.87 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 125.779 1.632 . . . . 2.2999999999999998 109.169 -177.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -62.55 165.98 5.74 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.986 0.914 . . . . 4.1500000000000004 111.442 171.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.71 -34.15 37.54 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 120.563 -1.336 . . . . 3.46 113.262 -177.443 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -73.66 -17.5 61.14 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.486 1.514 . . . . 6.0999999999999996 114.825 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -93.03 -44.17 8.54 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.38 1.872 . . . . 1.8600000000000001 108.896 169.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -54.07 -36.97 63.7 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.409 1.484 . . . . 3.1699999999999999 113.152 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 90.8 p -68.7 -19.95 64.39 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 119.993 -1.692 . . . . 2.0800000000000001 114.243 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 46.9 t -61.61 -41.78 91.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 120.658 1.572 . . . . 2.5 109.724 172.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -61.4 -52.41 64.69 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.567 1.147 . . . . 2.7000000000000002 110.397 175.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 76.7 mt -58.22 -33.3 69.17 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.379 0.672 . . . . 2.1000000000000001 112.066 177.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 28.0 m -67.33 -51.91 46.69 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.401 1.08 . . . . 1.73 110.974 175.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 70.7 mtp -55.13 -44.37 74.99 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.539 1.136 . . . . 3.1899999999999999 111.312 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.91 -51.19 65.64 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.617 1.167 . . . . 4.0 111.639 178.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . 0.434 ' HB3' ' CZ ' ' A' ' 69' ' ' PHE . 86.2 m -70.48 -33.58 71.41 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 114.065 1.135 . . . . 3.04 114.065 -175.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 94.0 mtp -68.06 -41.34 82.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 118.934 0.788 . . . . 2.8199999999999998 111.256 171.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.98 -35.82 77.17 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 118.659 -0.686 . . . . 1.8999999999999999 112.78 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -76.84 -29.79 56.04 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.729 1.149 . . . . 4.2800000000000002 112.366 177.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -56.37 -47.67 78.4 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.213 0.915 . . . . 2.48 111.551 165.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -69.75 -35.38 74.92 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.183 0.993 . . . . 3.6200000000000001 112.01 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -60.67 -48.78 80.26 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.438 1.495 . . . . 4.4000000000000004 111.722 173.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -63.86 -34.95 79.09 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.049 0.94 . . . . 5.5199999999999996 111.214 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 83.4 mt -70.77 -11.72 61.12 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.658 0.985 . . . . 3.4900000000000002 113.658 175.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -99.06 -6.12 29.05 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.601 1.561 . . . . 3.6699999999999999 113.747 169.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -110.65 -42.74 3.98 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.061 1.745 . . . . 3.6800000000000002 112.552 -171.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -81.96 24.26 0.64 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.125 1.37 . . . . 3.8900000000000001 113.027 173.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 77.1 tttt . . . . . 0 C--O 1.254 1.306 0 C-N-CA 129.584 3.154 . . . . 5.25 115.78 -163.73 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.501 -0.922 0 N-CA-C 108.267 -1.012 . . . . 6.1200000000000001 108.267 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -136.32 140.51 43.39 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 126.289 2.243 . . . . 4.2000000000000002 105.835 -164.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 12.8 p -73.48 168.52 24.6 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 124.367 1.067 . . . . 3.73 112.03 -175.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -63.58 -29.23 70.11 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.756 1.637 . . . . 2.0600000000000001 112.946 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 42.7 tp -70.33 -39.66 74.6 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 118.555 0.616 . . . . 4.0599999999999996 111.111 174.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -65.43 -39.09 91.67 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.108 0.563 . . . . 3.8799999999999999 111.923 173.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.1 -43.25 95.71 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.211 -0.931 . . . . 4.1799999999999997 111.723 172.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.95 -51.95 67.5 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.403 1.081 . . . . 1.6299999999999999 112.738 175.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.5 pp -64.82 -28.47 69.59 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.387 0.994 . . . . 4.3099999999999996 113.195 175.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 90.7 m -58.73 -49.94 75.75 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 118.286 -0.864 . . . . 2.5800000000000001 109.853 167.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.4 m -57.43 -37.27 72.51 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 119.537 1.062 . . . . 2.2799999999999998 111.717 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 80.6 mmm -59.78 -58.27 9.29 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.778 0.831 . . . . 3.8500000000000001 111.541 174.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.2 m -66.94 -29.18 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 O-C-N 121.242 -0.911 . . . . 3.23 112.233 -176.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 52.4 m -61.55 -55.38 31.54 Favored 'General case' 0 CA--C 1.506 -0.742 0 C-N-CA 125.591 1.556 . . . . 1.8300000000000001 111.313 176.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -75.87 -35.34 59.91 Favored 'General case' 0 CA--C 1.522 -0.116 0 O-C-N 125.28 1.613 . . . . 3.3900000000000001 109.417 -176.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -57.24 -44.04 83.48 Favored 'General case' 0 C--O 1.226 -0.177 0 CA-C-O 118.504 -0.76 . . . . 3.7799999999999998 111.156 177.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -70.26 -35.71 73.95 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.127 1.33 . . . . 2.9100000000000001 112.594 175.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -70.65 -12.22 61.42 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.712 1.004 . . . . 7.1900000000000004 113.712 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.431 ' HH ' ' HG3' ' A' ' 40' ' ' LYS . 26.7 m-85 -107.58 -47.99 3.51 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.903 2.081 . . . . 3.1800000000000002 112.94 171.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.5 t -62.0 -29.74 70.47 Favored 'General case' 0 C--O 1.249 1.04 0 C-N-CA 126.554 1.941 . . . . 2.8700000000000001 113.553 176.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.56 -4.84 87.86 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 127.763 2.601 . . . . 1.3899999999999999 114.009 173.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -78.53 60.22 2.61 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.812 1.806 . . . . 7.54 110.365 171.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 51.86 -151.07 0.28 Allowed 'General case' 0 C--O 1.252 1.196 0 C-N-CA 126.154 1.782 . . . . 8.3699999999999992 112.803 -175.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.91 -151.59 8.53 Favored Glycine 0 CA--C 1.529 0.966 0 N-CA-C 109.659 -1.376 . . . . 2.4900000000000002 109.659 -145.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.5 m -69.3 161.19 29.8 Favored 'General case' 0 C--O 1.25 1.125 0 CA-C-O 123.338 1.542 . . . . 4.0599999999999996 111.032 155.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.1 mtmt -139.01 108.55 6.18 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.201 1.4 . . . . 8.7899999999999991 108.228 -160.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 43.4 mt 114.6 -17.74 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.482 1 C-N-CA 132.592 4.357 . . . . 4.2800000000000002 110.459 -154.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.3 p -121.62 161.97 21.49 Favored 'General case' 0 C--O 1.246 0.91 0 C-N-CA 127.177 2.191 . . . . 2.27 112.0 173.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 39.8 mt -104.95 117.45 34.04 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.73 1.212 . . . . 2.9300000000000002 110.1 170.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 13.0 t -80.61 160.29 25.13 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 118.28 0.491 . . . . 2.9900000000000002 111.0 160.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.72 -46.77 2.7 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 127.149 2.18 . . . . 4.4900000000000002 114.045 -169.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -76.01 -27.36 57.35 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 120.706 -1.246 . . . . 7.3399999999999999 112.718 -175.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -65.37 -57.27 8.78 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.733 1.213 . . . . 1.49 108.573 173.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.3 tp -56.39 -45.02 80.78 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.136 0.975 . . . . 3.3100000000000001 112.152 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -31.76 71.69 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.5 -0.75 . . . . 5.5800000000000001 112.846 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -82.33 -28.95 31.32 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.943 0.897 . . . . 4.0599999999999996 112.837 174.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.3 tt -73.34 -52.05 15.25 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.552 1.141 . . . . 3.3799999999999999 110.947 178.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.5 mt -50.88 -60.27 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-N 119.853 1.206 . . . . 1.8799999999999999 111.114 -175.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.273 0.0 OUTLIER -78.1 9.33 3.8 Favored 'General case' 0 CA--C 1.56 1.328 0 N-CA-C 114.197 1.184 . . . . 5.8399999999999999 114.197 -175.778 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.431 ' HG3' ' HH ' ' A' ' 19' ' ' TYR . 23.0 mmtm -106.53 -31.04 8.69 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 127.441 2.296 . . . . 3.3799999999999999 112.556 166.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -71.18 -56.74 5.45 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 126.371 1.868 . . . . 4.6200000000000001 108.463 173.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -102.69 125.36 49.4 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 127.863 2.465 . . . . 3.4700000000000002 108.248 172.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 30.4 m -107.07 26.14 10.5 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.455 1.102 . . . . 4.7300000000000004 112.693 176.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -147.44 172.72 13.5 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.716 1.206 . . . . 4.6299999999999999 113.352 -175.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.78 -178.96 53.5 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 124.787 1.184 . . . . 5.4500000000000002 112.919 -175.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.444 ' CD ' ' HZ1' ' A' ' 48' ' ' LYS . 27.4 tp10 -82.83 51.87 2.01 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.92 1.288 . . . . 6.5199999999999996 110.025 177.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.2 tpt -83.85 56.65 3.76 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 123.249 1.5 . . . . 2.4500000000000002 112.876 -168.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.444 ' HZ1' ' CD ' ' A' ' 46' ' ' GLU . 83.2 mttt -102.68 175.16 5.59 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.11 1.764 . . . . 5.3600000000000003 112.171 -173.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -58.26 -39.52 79.42 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.14 -0.975 . . . . 3.6200000000000001 113.412 -170.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -71.54 6.23 1.97 Allowed 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 114.571 1.323 . . . . 4.1299999999999999 114.571 175.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 29.7 t -121.75 -48.07 2.17 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.278 1.831 . . . . 3.2000000000000002 109.889 170.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 37.1 mt -54.1 -39.21 40.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.778 1.231 . . . . 2.1400000000000001 113.304 174.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.69 -54.07 37.37 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.778 0.717 . . . . 4.0099999999999998 111.695 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.96 -30.21 65.05 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.149 0.426 . . . . 2.9300000000000002 112.149 -176.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.8 tt -57.89 -51.61 68.89 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 116.895 -1.526 . . . . 3.1499999999999999 110.135 165.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.9 ttt -52.22 -48.94 64.85 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 120.98 1.718 . . . . 2.3599999999999999 112.176 174.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.0 mtpt -62.63 -27.23 69.07 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.515 0.726 . . . . 5.5800000000000001 112.676 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.5 m -89.0 -25.73 21.85 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.48 1.512 . . . . 3.1899999999999999 113.91 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 14.5 mt -63.56 -42.02 98.39 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.685 1.13 . . . . 3.1299999999999999 110.676 171.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -87.13 142.34 27.99 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 124.588 1.155 . . . . 1.8 113.509 -169.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.98 9.6 42.07 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.55 1.54 . . . . 3.9300000000000002 112.779 178.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -143.48 -25.65 0.58 Allowed 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 115.969 1.841 . . . . 2.8100000000000001 115.969 -164.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.6 m 56.45 34.31 24.04 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.432 1.493 . . . . 3.0699999999999998 112.88 -161.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -79.43 1.17 26.45 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.116 1.767 . . . . 2.1699999999999999 111.558 178.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 58.53 -13.43 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 129.475 3.11 . . . . 4.5700000000000003 116.569 -163.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -101.45 123.65 45.86 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-O 124.071 1.891 . . . . 2.7200000000000002 112.239 -176.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.6 mm -92.49 93.81 4.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 113.747 -1.57 . . . . 2.4500000000000002 109.013 171.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -53.15 147.22 10.16 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 127.283 2.233 . . . . 2.5 110.542 164.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -47.44 -37.19 11.11 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.58 1.152 . . . . 3.9300000000000002 113.079 178.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -69.56 -31.08 69.05 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.714 2.405 . . . . 3.5899999999999999 113.862 176.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -77.49 -47.66 19.06 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.595 1.158 . . . . 2.0899999999999999 109.06 170.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -55.05 -28.16 50.12 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.297 1.439 . . . . 3.0699999999999998 112.277 173.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 52.1 m -62.03 -26.93 68.53 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 119.882 -1.761 . . . . 3.1899999999999999 113.683 171.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 m -78.68 -28.94 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 CA-C-N 121.004 1.729 . . . . 3.77 112.831 175.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -59.97 -55.14 37.76 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.357 1.063 . . . . 2.8999999999999999 110.678 169.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.1 mt -56.06 -38.84 71.16 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.754 0.822 . . . . 2.8199999999999998 112.438 175.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 75.8 m -60.74 -55.53 32.12 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.495 1.118 . . . . 1.6799999999999999 111.562 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 16.3 ptp -61.07 -38.08 84.95 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.986 0.812 . . . . 3.1200000000000001 112.333 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 85.5 mt -64.74 -41.44 95.94 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.829 0.851 . . . . 2.75 113.047 175.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 40.4 t -71.7 -32.16 67.51 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.656 0.613 . . . . 2.2200000000000002 112.656 178.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 77.2 mtp -65.83 -43.27 89.07 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.284 0.475 . . . . 2.7000000000000002 112.284 167.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.22 -38.07 89.73 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.659 0.663 . . . . 1.9099999999999999 111.95 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -61.35 -20.56 63.13 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.18 1.178 . . . . 3.6699999999999999 114.18 174.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.25 -40.88 70.73 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 120.77 1.623 . . . . 3.7000000000000002 112.332 171.109 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -69.51 -45.12 69.64 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.872 1.269 . . . . 3.46 109.833 -177.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.68 -46.43 67.25 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.539 1.936 . . . . 4.1799999999999997 111.224 171.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -68.58 -27.28 65.92 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.252 1.021 . . . . 4.6699999999999999 113.645 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 58.5 mt -72.0 -8.26 53.48 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 120.759 -1.213 . . . . 3.48 113.51 175.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -98.56 0.23 44.54 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 114.73 1.382 . . . . 5.21 114.73 167.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -92.31 -59.61 2.04 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.148 1.379 . . . . 3.8599999999999999 111.466 165.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -86.25 1.73 49.79 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 117.221 2.304 . . . . 4.3499999999999996 117.221 -158.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.036 0 C-N-CA 128.453 2.701 . . . . 5.9800000000000004 117.308 -170.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 11.0 mtt . . . . . 0 CA--C 1.501 -0.914 0 N-CA-C 107.206 -1.405 . . . . 6.2000000000000002 107.206 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -138.21 152.7 48.88 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 106.57 -1.641 . . . . 5.7800000000000002 106.57 -171.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.41 150.12 45.6 Favored Pre-proline 0 N--CA 1.479 0.991 0 CA-C-O 119.301 -0.381 . . . . 2.8700000000000001 110.536 -178.668 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -63.17 -14.86 44.44 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.273 1.982 . . . . 2.25 112.446 173.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.01 -48.1 15.03 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.316 1.447 . . . . 3.7000000000000002 111.155 171.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -52.1 -42.21 63.06 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.494 1.043 . . . . 3.9199999999999999 110.753 167.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . 0.442 ' HA ' ' CE ' ' B' ' 7' ' ' LYS . 0.0 OUTLIER -71.77 -25.87 62.21 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 114.781 1.4 . . . . 5.9299999999999997 114.781 178.965 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.31 -51.57 59.75 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 117.685 -1.15 . . . . 1.74 111.439 165.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.2 mp -59.41 -40.64 87.33 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 121.05 1.75 . . . . 3.9300000000000002 111.898 173.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 40.3 m -53.78 -51.63 62.81 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.455 1.102 . . . . 2.3900000000000001 110.001 173.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 90.8 m -53.48 -37.43 62.69 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.516 1.126 . . . . 2.0600000000000001 112.638 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 11.5 mtp -61.49 -47.04 87.44 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.105 0.562 . . . . 4.7599999999999998 111.671 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 4.0 p -76.02 -32.4 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-O 118.438 -0.791 . . . . 3.6200000000000001 113.008 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 89.1 m -54.86 -56.72 16.43 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.171 1.35 . . . . 1.9199999999999999 110.547 175.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.43 -37.21 77.3 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.543 -0.753 . . . . 3.3599999999999999 109.705 -175.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -60.68 -52.93 63.05 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.626 0.77 . . . . 3.7799999999999998 112.673 175.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -66.23 -38.0 86.86 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.75 0.82 . . . . 2.5699999999999998 111.312 -178.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 3.7 ttpm? -56.19 -58.94 5.8 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.86 1.264 . . . . 6.3700000000000001 112.069 170.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -67.36 -25.91 66.21 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 121.259 -0.901 . . . . 3.0099999999999998 112.699 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 61.1 m -63.33 -10.08 14.78 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.839 1.051 . . . . 2.2000000000000002 113.839 171.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -88.11 -7.4 73.68 Favored Glycine 0 CA--C 1.536 1.399 0 CA-C-O 118.347 -1.252 . . . . 1.4299999999999999 115.216 170.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 7.0 mmt180 -70.26 -3.59 17.86 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 120.406 2.103 . . . . 4.6100000000000003 114.489 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -175.0 174.0 2.56 Favored 'General case' 0 C--O 1.247 0.94 0 C-N-CA 129.328 3.051 . . . . 3.6400000000000001 108.39 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -40.28 153.69 0.06 OUTLIER Glycine 0 N--CA 1.468 0.822 0 C-N-CA 126.469 1.985 . . . . 3.1699999999999999 114.459 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 35.6 m 63.76 124.53 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.245 1.418 . . . . 4.1699999999999999 111.753 -176.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 24.1 tttt -102.08 -4.19 26.34 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 114.05 1.13 . . . . 8.0399999999999991 114.05 -178.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -103.49 0.12 30.62 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.105 1.762 . . . . 4.6799999999999997 112.94 169.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 9.6 p -132.16 153.84 50.13 Favored 'General case' 0 C--O 1.249 1.052 0 C-N-CA 125.609 1.563 . . . . 1.9299999999999999 109.155 173.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -110.42 124.56 51.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.375 -1.284 . . . . 2.96 109.537 158.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 9.7 p -59.25 165.63 2.57 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.015 0.526 . . . . 2.9100000000000001 111.225 167.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . 0.423 HH21 ' C ' ' B' ' 52' ' ' ILE . 23.4 ttt180 -52.5 -29.74 26.63 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 120.562 -1.336 . . . . 6.6399999999999997 114.117 174.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 tmtt? -79.34 -36.36 39.56 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.716 -1.24 . . . . 5.9199999999999999 112.863 177.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -63.85 -53.79 45.14 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.589 0.709 . . . . 1.9099999999999999 109.512 169.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 20.2 tp -51.74 -41.21 61.39 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 128.058 2.543 . . . . 3.46 112.427 176.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 15.8 mttt -56.37 -46.85 79.84 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 121.079 -1.013 . . . . 3.8799999999999999 112.476 -178.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -60.91 -53.22 59.91 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 117.761 -1.114 . . . . 3.8300000000000001 111.718 173.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -51.98 -53.47 41.1 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.429 1.013 . . . . 3.5600000000000001 111.48 177.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 96.4 mt -60.35 -55.49 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-N 119.575 1.08 . . . . 2.23 109.12 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 25.6 ttpt -69.15 -15.19 63.35 Favored 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 113.281 0.845 . . . . 5.1699999999999999 113.281 -169.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 18.3 mmtp -85.77 -63.11 1.38 Allowed 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 127.49 2.316 . . . . 4.9699999999999998 112.402 170.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -75.41 -9.03 58.21 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.856 0.862 . . . . 4.8700000000000001 112.584 -171.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 89.6 mt -125.83 42.3 3.33 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.416 1.486 . . . . 4.54 110.727 165.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 19.5 p -68.13 11.59 0.15 Allowed 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 115.444 1.646 . . . . 4.0599999999999996 115.444 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -103.49 -6.3 21.94 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.005 1.722 . . . . 4.1600000000000001 113.843 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -131.87 -171.43 12.82 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 124.395 0.998 . . . . 3.4199999999999999 115.07 -170.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -74.65 53.78 0.58 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.213 1.805 . . . . 5.29 112.583 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.91 19.16 9.32 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.327 1.851 . . . . 3.3999999999999999 113.219 -179.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.0 ptmt -52.44 152.42 3.53 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.898 1.679 . . . . 4.9000000000000004 112.886 165.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -39.29 -54.77 1.8 Allowed 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 116.41 2.004 . . . . 3.8100000000000001 116.41 -163.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 8.7 m -67.53 -23.19 65.42 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 114.458 1.281 . . . . 4.0 114.458 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 8.2 t -65.79 -26.16 67.57 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 120.757 -1.214 . . . . 3.2000000000000002 111.125 169.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . 0.423 ' C ' HH21 ' B' ' 31' ' ' ARG . 74.7 mt -88.21 -8.75 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.988 1.315 . . . . 2.9300000000000002 111.449 175.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -72.94 -44.93 60.59 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.051 -1.031 . . . . 3.4300000000000002 109.03 160.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.548 ' HA ' ' HE3' ' B' ' 57' ' ' LYS . 9.9 t0 -71.17 -47.34 58.21 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.508 0.594 . . . . 3.3700000000000001 112.355 176.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -59.17 -39.74 83.45 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 118.169 -0.919 . . . . 3.9900000000000002 111.05 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 27.6 tpp -53.79 -65.11 0.62 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.866 0.866 . . . . 3.3500000000000001 109.26 169.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . 0.548 ' HE3' ' HA ' ' B' ' 54' ' ' ASP . 12.1 ttpp -48.16 -34.78 10.47 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.845 1.658 . . . . 5.1799999999999997 114.034 177.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 52.4 m -87.14 -30.57 20.96 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.312 1.045 . . . . 3.21 113.595 -174.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.1 pp -90.99 -36.27 14.18 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.211 -0.931 . . . . 3.8700000000000001 112.087 174.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . 0.433 ' O ' ' HE3' ' B' ' 61' ' ' LYS . 30.5 t70 -76.06 153.66 36.22 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.412 1.485 . . . . 2.7400000000000002 112.404 171.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . 0.433 ' HE3' ' O ' ' B' ' 60' ' ' ASP . 6.4 mmtp -130.36 15.35 5.56 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.401 1.26 . . . . 4.4000000000000004 114.401 -171.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -161.4 -3.42 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 117.028 2.233 . . . . 2.9300000000000002 117.028 -165.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 74.0 m 60.65 41.81 14.7 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.077 2.151 . . . . 3.8799999999999999 112.877 179.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 59.0 p30 -95.39 -17.98 21.11 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.495 1.518 . . . . 2.5699999999999998 112.76 -174.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 62.76 -12.31 0.08 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 129.85 3.26 . . . . 5.5800000000000001 115.806 -172.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -79.46 131.35 36.04 Favored 'General case' 0 C--O 1.249 1.07 0 CA-C-N 120.906 1.685 . . . . 3.8500000000000001 111.224 161.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 33.6 mm -107.09 94.18 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 115.131 -0.94 . . . . 2.2999999999999998 109.579 174.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -60.11 154.9 18.33 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.355 1.862 . . . . 2.96 112.262 168.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -46.55 -38.0 8.81 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.99 1.716 . . . . 3.9300000000000002 113.418 178.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -78.81 -38.22 38.79 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 120.648 -1.282 . . . . 3.8500000000000001 112.568 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -56.18 -52.56 63.93 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 119.237 0.926 . . . . 2.3399999999999999 108.749 168.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -52.09 -41.86 62.76 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.932 1.293 . . . . 4.0300000000000002 113.454 174.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.7 -24.61 65.41 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.681 -1.262 . . . . 2.6600000000000001 113.514 176.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 79.7 t -73.67 -35.52 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 119.148 0.885 . . . . 2.7000000000000002 110.666 172.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -59.98 -51.2 70.68 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.728 0.695 . . . . 2.7799999999999998 111.191 167.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 93.4 mt -58.87 -36.18 74.2 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 118.865 -0.588 . . . . 2.2799999999999998 112.329 176.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 95.1 m -59.88 -47.4 85.91 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.313 1.045 . . . . 1.8300000000000001 111.109 173.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 57.4 mtm -58.17 -42.74 86.68 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.467 1.03 . . . . 2.4399999999999999 112.437 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 70.6 mt -65.6 -48.41 72.4 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.191 0.596 . . . . 2.5 112.182 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 69.0 m -59.55 -43.14 93.63 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.284 0.634 . . . . 2.8399999999999999 111.839 176.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 23.8 mtp -64.97 -34.94 79.62 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.253 0.933 . . . . 3.1200000000000001 112.577 175.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.9 -45.51 77.74 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.808 0.731 . . . . 1.6599999999999999 112.154 176.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -67.65 -25.26 65.63 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.305 0.854 . . . . 3.8100000000000001 113.305 175.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -66.0 -47.25 75.12 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 119.066 0.848 . . . . 2.3799999999999999 111.058 176.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -67.2 -37.77 84.22 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.591 1.156 . . . . 2.71 112.23 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.16 -48.98 77.38 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.811 1.244 . . . . 3.04 111.036 174.263 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -57.01 -33.03 66.75 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.07 0.948 . . . . 3.7200000000000002 113.008 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.86 -42.61 97.52 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.394 0.997 . . . . 4.6600000000000001 112.08 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.586 ' CD ' ' HZ2' ' B' ' 92' ' ' LYS . 26.6 mm-40 -72.76 -32.25 65.51 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 114.777 1.399 . . . . 3.71 114.777 179.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 -75.22 -29.43 60.27 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.347 1.859 . . . . 4.3399999999999999 114.062 -177.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -105.83 10.1 32.67 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.362 1.065 . . . . 3.54 112.926 -172.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . 0.586 ' HZ2' ' CD ' ' B' ' 89' ' ' GLU . 3.3 ttpm? . . . . . 0 C--O 1.249 1.079 0 C-N-CA 129.584 3.154 . . . . 5.2000000000000002 116.69 -177.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.607 ' HA ' ' OE1' ' A' ' 6' ' ' GLU 0.262 24.4 mtt . . . . . 0 N--CA 1.473 0.708 0 CA-C-O 118.567 -0.73 . . . . 10.42 111.23 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -155.81 -110.08 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 126.281 1.833 . . . . 6.2199999999999998 107.497 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 35.3 p -70.94 166.88 33.37 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 126.441 1.896 . . . . 2.52 111.835 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -59.61 -25.02 77.58 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 121.961 1.774 . . . . 1.53 113.567 169.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tt -85.42 -38.07 19.09 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.521 1.055 . . . . 3.4199999999999999 112.272 178.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.607 ' OE1' ' HA ' ' A' ' 1' ' ' MET . 11.2 tm-20 -54.34 -46.48 72.93 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.619 1.1 . . . . 4.7400000000000002 109.639 161.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.3 mtpt -64.91 -23.19 67.15 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 121.477 -0.765 . . . . 6.0499999999999998 111.991 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.06 -46.55 56.46 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.575 1.15 . . . . 2.0600000000000001 110.997 173.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -70.0 -39.61 75.78 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.793 1.237 . . . . 4.1399999999999997 112.942 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.3 m -58.88 -43.5 90.92 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.431 1.492 . . . . 2.98 110.793 168.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 53.5 m -60.32 -47.57 85.45 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.614 1.097 . . . . 2.1400000000000001 109.531 169.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.1 ttm -57.6 -49.61 75.85 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 117.316 -1.325 . . . . 3.9700000000000002 111.915 -175.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.9 p -69.68 -25.41 28.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 CA-C-N 119.992 1.269 . . . . 3.2599999999999998 112.978 174.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.8 m -66.58 -53.35 35.49 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 117.537 -1.221 . . . . 1.8400000000000001 110.104 174.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -53.48 -42.78 67.61 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.822 0.737 . . . . 3.2200000000000002 109.113 167.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -63.31 -44.03 96.13 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 119.588 -0.845 . . . . 4.0300000000000002 111.326 -170.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.3 m80 -73.19 -34.8 66.18 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 115.03 1.493 . . . . 2.4700000000000002 115.03 171.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -67.86 -24.74 65.28 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.632 1.106 . . . . 5.7000000000000002 113.301 175.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.401 ' CE2' ' HA ' ' A' ' 37' ' ' LEU . 38.8 m-85 -102.95 -42.66 5.75 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.769 1.628 . . . . 3.4900000000000002 113.048 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.0 m -67.58 -15.28 63.57 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 120.173 1.351 . . . . 2.9399999999999999 113.122 172.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.93 14.94 60.54 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 125.69 1.614 . . . . 1.8899999999999999 114.68 168.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.5 mmp_? -94.28 -3.16 51.08 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 119.627 1.714 . . . . 7.0999999999999996 113.465 176.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 177.23 176.1 0.38 Allowed 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 129.39 3.076 . . . . 4.5599999999999996 110.558 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.65 -147.55 36.31 Favored Glycine 0 N--CA 1.47 0.944 0 C-N-CA 126.0 1.762 . . . . 2.1899999999999999 113.595 167.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.9 t -66.68 155.95 36.59 Favored 'General case' 0 C--O 1.25 1.085 0 O-C-N 120.718 -1.46 . . . . 4.1299999999999999 110.751 163.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.7 pttp -65.8 -24.11 66.84 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.745 1.218 . . . . 7.79 112.165 169.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.3 tp -70.61 -52.54 20.74 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.192 1.397 . . . . 4.5099999999999998 109.339 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 65.4 p -96.12 155.97 16.53 Favored 'General case' 0 C--O 1.253 1.269 0 C-N-CA 124.719 1.208 . . . . 1.8500000000000001 112.948 -165.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -89.91 116.25 27.84 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 112.122 -2.308 . . . . 4.0999999999999996 108.827 153.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.4 p -75.47 170.44 16.11 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.163 0.585 . . . . 2.7799999999999998 110.751 158.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.37 -45.31 3.03 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 125.51 1.524 . . . . 4.6399999999999997 113.195 178.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? -70.07 -45.01 67.94 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 119.943 -1.723 . . . . 6.9199999999999999 113.102 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -61.07 -41.46 96.65 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.951 0.9 . . . . 1.5900000000000001 110.693 -176.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.52 -40.86 98.16 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.303 1.841 . . . . 3.6099999999999999 112.077 -179.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.6 ttmt -64.74 -43.08 94.5 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.028 -1.045 . . . . 4.2999999999999998 112.277 171.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -64.24 -36.25 83.46 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.848 0.859 . . . . 4.1600000000000001 111.738 176.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.401 ' HA ' ' CE2' ' A' ' 19' ' ' TYR . 58.1 tp -65.88 -69.59 0.29 Allowed 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 128.058 2.543 . . . . 3.6899999999999999 111.608 177.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.3 mt -56.81 -51.35 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 CA-C-N 119.641 1.109 . . . . 2.0899999999999999 110.32 -174.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -72.55 -4.35 30.09 Favored 'General case' 0 CA--C 1.555 1.156 0 O-C-N 121.279 -0.888 . . . . 4.8899999999999997 112.11 -173.458 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -96.56 -45.31 6.78 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-O 117.155 -1.402 . . . . 4.7699999999999996 112.715 159.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -51.81 -44.61 63.57 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 119.897 1.226 . . . . 4.2800000000000002 111.76 175.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.2 mt -139.19 66.5 1.41 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.632 2.773 . . . . 3.6000000000000001 108.798 -169.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.6 t -70.91 21.52 0.04 OUTLIER 'General case' 0 CA--C 1.559 1.304 0 O-C-N 120.534 -1.354 . . . . 4.4000000000000004 114.556 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -83.51 162.2 20.99 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 120.186 -1.571 . . . . 4.9000000000000004 113.169 -174.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.38 -0.68 24.31 Favored Glycine 0 N--CA 1.477 1.381 0 N-CA-C 116.451 1.34 . . . . 4.0599999999999996 116.451 -171.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -75.4 -32.09 60.63 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 118.599 1.199 . . . . 7.1699999999999999 110.971 166.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.53 151.41 27.76 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.597 1.159 . . . . 3.0800000000000001 111.083 174.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.88 176.83 0.52 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 130.413 3.485 . . . . 5.3099999999999996 108.639 178.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -55.58 -51.4 67.26 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 120.942 1.701 . . . . 6.2199999999999998 110.344 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.0 m -67.34 60.26 0.06 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.799 2.04 . . . . 3.8399999999999999 113.302 168.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.6 t 172.63 -54.53 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 129.311 3.045 . . . . 2.6699999999999999 108.877 -176.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 13.9 mm -61.72 -39.57 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.376 1.47 . . . . 2.7400000000000002 111.802 174.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -69.9 -26.63 64.26 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.276 0.843 . . . . 3.3300000000000001 113.276 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -85.63 -32.25 22.13 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.286 0.948 . . . . 2.1800000000000002 112.266 173.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.54 -43.67 76.04 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.4 0.68 . . . . 3.9399999999999999 109.941 163.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.7 tpt -54.33 -29.71 48.88 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 119.526 1.057 . . . . 2.54 113.374 173.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.0 mttm -83.49 -31.71 26.35 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.617 1.167 . . . . 6.0599999999999996 112.703 174.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 46.3 t -81.69 -32.94 31.49 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 126.217 1.807 . . . . 2.46 113.699 -177.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -68.59 -39.04 81.1 Favored 'General case' 0 C--N 1.334 -0.065 0 C-N-CA 126.223 1.809 . . . . 3.29 111.178 173.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -84.67 144.41 28.58 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.24 1.416 . . . . 2.2400000000000002 111.225 -176.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.7 ttmt -116.25 -27.75 6.75 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.256 1.206 . . . . 5.2800000000000002 114.256 -163.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -96.84 -67.42 0.85 Allowed 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.224 1.81 . . . . 3.0499999999999998 113.243 165.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 53.1 m 137.56 38.78 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.489 1 C-N-CA 133.071 4.548 . . . . 3.7599999999999998 110.71 -172.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.9 p30 -91.36 -15.8 28.44 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.205 -1.56 . . . . 2.3199999999999998 112.784 -177.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.4 5.49 1.18 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 128.324 2.65 . . . . 6.46 115.287 -168.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -102.12 129.39 48.46 Favored 'General case' 0 C--O 1.24 0.599 0 C-N-CA 125.188 1.395 . . . . 3.6800000000000002 110.929 164.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 10.7 mm -99.69 105.91 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 124.467 1.107 . . . . 2.2799999999999998 110.908 175.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -79.94 154.1 28.51 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.721 2.409 . . . . 3.2000000000000002 109.366 166.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.02 -39.18 62.98 Favored 'General case' 0 CA--C 1.547 0.833 0 O-C-N 120.172 -1.58 . . . . 3.6600000000000001 113.867 -178.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.3 pttm -71.51 -12.96 61.65 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.393 1.257 . . . . 3.8199999999999998 114.393 175.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 73.2 mt-10 -79.67 -63.37 1.43 Allowed 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 108.299 -1.0 . . . . 1.72 108.299 158.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -49.97 -33.44 17.79 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 126.915 2.086 . . . . 3.5 115.618 -171.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.2 t -58.14 -22.56 51.66 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.721 -1.237 . . . . 3.9399999999999999 112.597 176.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 5.5 p -58.23 -46.22 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 CA-C-N 119.108 0.867 . . . . 3.3199999999999998 111.137 173.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -70.27 -48.23 57.71 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 125.783 1.633 . . . . 4.1900000000000004 111.93 178.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.5 mt -53.85 -37.61 63.82 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 122.924 0.49 . . . . 3.02 111.384 175.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 42.8 m -68.21 -51.31 46.99 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.733 1.213 . . . . 2.27 111.751 173.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 40.1 mtm -54.88 -42.58 72.26 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.803 1.183 . . . . 2.9300000000000002 112.668 177.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.97 -47.53 82.77 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.403 0.681 . . . . 2.3300000000000001 111.653 174.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 88.4 m -62.72 -35.7 80.59 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.511 0.93 . . . . 2.77 113.511 175.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 58.9 mtp -62.25 -43.65 98.33 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 118.797 0.726 . . . . 3.3700000000000001 111.267 174.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.29 -41.26 85.72 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 122.844 0.458 . . . . 1.8400000000000001 111.522 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -72.3 -29.23 63.66 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.634 -0.666 . . . . 4.29 111.868 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -65.15 -44.22 89.28 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.292 0.951 . . . . 2.5499999999999998 111.753 171.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -61.01 -45.31 95.31 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.258 1.023 . . . . 2.6800000000000002 111.515 174.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -53.29 -48.24 68.52 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.56 1.544 . . . . 3.8399999999999999 111.991 176.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -61.8 -34.47 75.97 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.78 1.232 . . . . 3.7599999999999998 112.275 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 79.9 mt -72.33 -16.86 61.88 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.62 0.97 . . . . 2.3799999999999999 113.62 178.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -95.16 -11.66 27.77 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.336 1.236 . . . . 3.1099999999999999 114.336 172.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -109.59 -39.07 5.26 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.818 1.647 . . . . 2.8399999999999999 113.034 -168.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -88.32 24.16 1.98 Allowed 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 124.76 1.224 . . . . 3.4399999999999999 112.586 174.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 79.7 tttt . . . . . 0 C--O 1.249 1.074 0 C-N-CA 130.252 3.421 . . . . 3.7999999999999998 116.131 -164.083 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.475 0.823 0 N-CA-C 107.948 -1.13 . . . . 6.4900000000000002 107.948 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 19.6 mp0 -115.65 -108.96 0.36 Allowed 'General case' 0 CA--C 1.537 0.473 0 O-C-N 125.319 1.637 . . . . 4.6299999999999999 107.715 -158.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.7 p -132.68 151.56 78.35 Favored Pre-proline 0 N--CA 1.47 0.545 0 C-N-CA 123.861 0.864 . . . . 2.5499999999999998 111.238 174.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -67.91 -16.69 45.98 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 122.211 1.941 . . . . 1.5700000000000001 111.742 173.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.26 -46.65 27.02 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-O 118.143 -0.932 . . . . 3.2000000000000002 110.576 173.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -57.6 -48.13 80.26 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.708 1.14 . . . . 4.6600000000000001 109.612 172.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -62.5 -29.62 70.68 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.351 -0.843 . . . . 4.8300000000000001 112.978 178.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.04 -43.31 79.02 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.491 1.117 . . . . 1.8999999999999999 111.822 171.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 32.8 mt -66.3 -40.83 90.26 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 119.346 0.975 . . . . 3.0299999999999998 111.3 173.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 90.3 m -59.95 -42.51 94.21 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.993 1.317 . . . . 1.97 111.686 172.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 92.2 m -59.47 -43.77 93.18 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.139 0.976 . . . . 2.1400000000000001 110.654 171.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -59.99 -51.82 68.04 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.605 0.762 . . . . 4.4299999999999997 111.286 177.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 48.5 t -56.94 -31.6 36.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 125.078 1.351 . . . . 2.7400000000000002 113.15 175.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 33.3 m -65.47 -55.26 18.92 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.406 1.082 . . . . 1.6100000000000001 110.491 175.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.8 -39.58 71.51 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.347 0.659 . . . . 2.3199999999999998 110.9 170.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -59.91 -53.84 53.11 Favored 'General case' 0 C--O 1.225 -0.196 0 O-C-N 123.778 0.674 . . . . 3.5499999999999998 109.285 -174.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 28.0 m80 -56.39 -49.25 75.01 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.598 -0.689 . . . . 3.0600000000000001 112.522 172.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.39 -26.44 67.84 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 114.13 1.159 . . . . 6.9400000000000004 114.13 -176.18 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -107.04 -32.42 7.86 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 120.438 -1.414 . . . . 3.6699999999999999 113.162 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 42.3 t -72.34 -38.22 68.67 Favored 'General case' 0 C--O 1.247 0.935 0 C-N-CA 125.191 1.396 . . . . 2.1899999999999999 113.167 176.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.69 2.86 81.63 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 125.58 1.562 . . . . 1.74 114.299 176.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -43.96 25.98 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.498 1.149 . . . . 4.1799999999999997 111.782 -171.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -159.97 -163.0 1.06 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.865 1.666 . . . . 3.9500000000000002 110.787 177.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 58.48 -135.94 51.48 Favored Glycine 0 N--CA 1.468 0.768 0 N-CA-C 109.301 -1.52 . . . . 3.1800000000000002 109.301 -171.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 5.3 t -82.84 162.08 21.74 Favored 'General case' 0 C--O 1.248 0.985 0 CA-C-O 124.4 2.048 . . . . 3.9500000000000002 112.105 152.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -91.65 143.31 26.69 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.543 1.537 . . . . 7.3300000000000001 108.674 171.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.3 tp 82.31 -15.04 0.72 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 128.174 2.59 . . . . 3.7400000000000002 112.868 -164.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 54.8 p -112.38 144.62 41.52 Favored 'General case' 0 C--O 1.246 0.874 0 C-N-CA 125.859 1.664 . . . . 2.0800000000000001 114.542 169.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 52.5 mt -94.11 101.41 13.43 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.069 2.148 . . . . 3.1800000000000002 109.514 167.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.2 t -71.59 162.0 30.13 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 120.69 -1.257 . . . . 2.6400000000000001 111.452 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 tmm_? -53.93 -14.28 0.97 Allowed 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 116.345 1.98 . . . . 6.2400000000000002 116.345 -174.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.01 -45.74 8.16 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.318 -1.488 . . . . 6.75 113.302 164.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -52.36 -45.62 65.82 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.488 1.115 . . . . 1.6399999999999999 109.893 175.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -61.15 -56.62 18.74 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.5 1.52 . . . . 3.48 111.924 -178.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -69.93 -27.45 64.78 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 119.933 -1.73 . . . . 4.4199999999999999 112.935 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -70.78 -26.02 63.15 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.992 0.738 . . . . 3.3399999999999999 112.992 169.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 34.5 tp -72.66 -58.16 3.57 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-O 117.339 -1.315 . . . . 3.1800000000000002 110.813 172.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 38.2 mt -53.03 -49.24 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 CA-C-N 119.864 1.211 . . . . 2.1099999999999999 110.423 -178.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 22.6 mtpp -64.45 -12.15 40.64 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.262 1.208 . . . . 5.2400000000000002 114.262 -175.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -109.12 -27.15 9.76 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.524 1.53 . . . . 4.3899999999999997 113.256 172.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -72.22 -38.84 68.88 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 127.878 2.471 . . . . 4.96 113.22 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 43.1 mt -147.56 79.78 1.49 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.505 1.522 . . . . 4.29 109.215 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 15.7 p -90.19 -16.48 29.38 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.397 1.258 . . . . 3.6600000000000001 114.397 -172.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -57.93 -2.24 0.15 Allowed 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 119.228 3.047 . . . . 4.5599999999999996 119.228 -170.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 163.65 161.98 13.78 Favored Glycine 0 N--CA 1.472 1.056 0 CA-C-N 120.562 1.528 . . . . 3.9199999999999999 114.45 174.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 73.97 -45.69 0.6 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 127.504 2.321 . . . . 5.96 113.534 172.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 33.4 tpp -78.12 71.68 4.6 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 124.19 1.948 . . . . 3.0800000000000001 115.41 -148.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -84.84 168.77 14.79 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.555 2.342 . . . . 5.6500000000000004 111.879 170.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -52.96 -48.42 67.39 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.688 0.795 . . . . 3.54 112.085 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 53.3 p -68.14 -4.2 12.97 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.495 1.665 . . . . 5.2000000000000002 115.495 178.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 16.4 m -97.73 -26.71 14.64 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.641 1.11 . . . . 3.5600000000000001 112.229 165.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 81.2 mt -82.09 -49.0 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 125.27 1.428 . . . . 3.0099999999999998 111.713 -177.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -75.82 -15.4 60.24 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.042 0.386 . . . . 4.04 112.042 -165.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -75.33 -41.95 55.55 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.436 0.695 . . . . 4.0300000000000002 112.021 160.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.34 -43.89 79.51 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.041 0.936 . . . . 4.25 110.621 172.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 9.7 tpt -56.87 -47.87 79.43 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.951 2.1 . . . . 2.3999999999999999 111.495 172.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.6 tmtt? -66.23 -24.91 66.69 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.409 1.084 . . . . 6.04 113.487 173.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.7 t -84.06 -41.2 17.43 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 120.695 -1.253 . . . . 3.2000000000000002 112.086 -178.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 14.1 mt -57.01 -59.55 4.9 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 127.395 2.278 . . . . 3.8599999999999999 111.155 164.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -85.64 56.29 3.89 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 123.139 1.447 . . . . 1.7 110.856 -171.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -58.05 -19.62 33.03 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.535 1.534 . . . . 7.4800000000000004 114.026 -169.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -95.55 -10.7 28.91 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 116.441 2.015 . . . . 2.4500000000000002 116.441 174.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 23.0 t 62.2 32.69 17.17 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.2 1.4 . . . . 3.3599999999999999 114.4 -178.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 46.2 p30 -73.56 -18.5 61.07 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 121.106 -0.996 . . . . 2.2000000000000002 111.388 172.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 78.63 6.64 2.35 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 131.572 3.949 . . . . 4.3499999999999996 115.918 179.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -131.21 140.43 49.88 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.865 1.666 . . . . 2.3500000000000001 111.278 175.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 28.7 mt -110.15 118.96 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 O-C-N 121.152 -0.967 . . . . 2.5 111.988 -173.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -93.6 164.3 13.22 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 127.136 2.174 . . . . 3.1800000000000002 111.032 165.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -49.06 -32.52 9.72 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.016 1.726 . . . . 3.48 115.142 -176.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.92 -45.95 69.53 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.121 -0.987 . . . . 4.5099999999999998 111.164 179.34 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -58.25 -48.95 78.81 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.66 1.184 . . . . 1.76 109.326 171.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -56.54 -24.51 47.33 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 114.785 1.402 . . . . 3.1800000000000002 114.785 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 29.3 t -55.86 -27.83 53.53 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 120.422 -1.424 . . . . 3.2999999999999998 114.003 170.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 89.5 t -64.45 -50.53 75.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-N 119.244 0.929 . . . . 2.3199999999999998 109.981 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -61.28 -45.58 93.9 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.107 0.963 . . . . 2.8100000000000001 111.853 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 87.9 mt -56.26 -41.93 76.57 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 122.966 0.506 . . . . 3.1400000000000001 112.014 174.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 39.0 m -62.05 -46.72 87.89 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.91 0.884 . . . . 2.0800000000000001 111.34 174.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 88.5 mtp -61.17 -42.55 98.77 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.002 0.819 . . . . 3.3500000000000001 112.324 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 79.4 mt -61.36 -54.1 48.04 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.511 0.724 . . . . 3.02 111.171 174.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 52.5 m -56.19 -40.95 74.76 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 114.048 1.129 . . . . 2.79 114.048 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 50.4 mtp -74.3 -31.06 62.34 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 118.666 -0.683 . . . . 3.4700000000000002 111.927 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.13 -36.46 72.1 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.73 0.696 . . . . 1.8700000000000001 111.411 172.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -65.23 -26.85 68.3 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 121.389 -0.82 . . . . 3.8199999999999998 112.784 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -61.53 -44.02 97.81 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 120.264 1.393 . . . . 3.1800000000000002 112.013 171.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -74.21 -35.16 63.9 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.92 0.888 . . . . 3.48 111.982 178.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -56.29 -45.9 79.99 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.829 1.251 . . . . 3.3999999999999999 111.094 170.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -63.38 -15.72 58.36 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.476 1.51 . . . . 3.3199999999999998 112.677 175.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 56.9 mt -98.92 -5.11 31.35 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.824 1.65 . . . . 3.29 114.216 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -84.38 -32.72 24.04 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.655 1.182 . . . . 4.6200000000000001 112.809 161.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -75.35 -47.35 28.06 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.954 1.302 . . . . 3.0099999999999998 112.936 -174.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -83.44 28.65 0.54 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 125.255 1.422 . . . . 3.48 113.627 -176.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 44.1 mttp . . . . . 0 C--O 1.251 1.184 0 CA-C-O 115.01 -2.424 . . . . 5.5800000000000001 115.145 173.321 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mmt . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 108.821 -0.807 . . . . 6.4400000000000004 108.821 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -150.99 141.02 22.07 Favored 'General case' 0 C--O 1.241 0.606 0 C-N-CA 126.615 1.966 . . . . 4.96 106.658 -160.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 75.9 p -55.9 161.33 3.58 Favored Pre-proline 0 N--CA 1.475 0.807 0 C-N-CA 126.657 1.983 . . . . 2.7000000000000002 112.166 175.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.44 -14.84 47.0 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 122.07 1.847 . . . . 2.1400000000000001 113.258 173.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -80.32 -48.37 13.09 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.893 1.224 . . . . 4.1799999999999997 111.375 173.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -55.55 -37.17 67.63 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 121.854 0.835 . . . . 4.2800000000000002 110.432 168.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.84 -37.51 87.86 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.719 -1.238 . . . . 4.2199999999999998 113.149 170.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.6 -44.05 91.82 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.228 1.011 . . . . 2.5299999999999998 112.026 174.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.0 mt -63.83 -45.31 90.14 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.692 0.797 . . . . 3.2200000000000002 110.711 175.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 49.2 m -52.61 -53.47 46.31 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.22 1.408 . . . . 2.8700000000000001 111.514 170.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.3 t -69.99 -31.52 69.24 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 118.051 -0.976 . . . . 4.1600000000000001 112.123 -177.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 37.8 mtt -60.59 -44.77 95.88 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.193 0.997 . . . . 4.2699999999999996 112.092 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 33.6 m -75.27 -25.7 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 119.571 1.078 . . . . 3.8900000000000001 112.812 175.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.3 m -69.29 -50.2 48.94 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.385 1.474 . . . . 1.9199999999999999 111.555 177.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.4 p -60.53 -41.94 95.45 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.155 -0.684 . . . . 2.6600000000000001 109.155 172.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -65.0 -49.46 70.14 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 118.563 -0.732 . . . . 4.4800000000000004 111.236 -173.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.6 m80 -59.61 -43.96 93.59 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 120.301 1.409 . . . . 3.0499999999999998 113.276 172.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -63.45 -44.49 94.37 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.228 1.011 . . . . 4.5 112.712 -175.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -76.55 -43.59 38.45 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.978 0.911 . . . . 3.3999999999999999 112.343 172.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.7 t -62.94 -26.0 68.61 Favored 'General case' 0 C--O 1.242 0.669 0 N-CA-C 115.347 1.61 . . . . 2.7000000000000002 115.347 -163.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.37 2.85 75.6 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 125.053 1.311 . . . . 2.2599999999999998 114.913 173.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.61 63.95 7.82 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.18 1.49 . . . . 7.8499999999999996 108.167 169.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.439 ' CD ' ' HZ3' ' A' ' 32' ' ' LYS . 30.2 mt-10 78.71 -171.37 0.06 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.927 1.691 . . . . 4.1200000000000001 112.984 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.84 -149.66 29.32 Favored Glycine 0 C--N 1.341 0.833 0 N-CA-C 109.363 -1.495 . . . . 3.3599999999999999 109.363 -159.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 63.7 m -76.98 166.83 22.79 Favored 'General case' 0 C--O 1.248 1.005 0 O-C-N 121.286 -1.126 . . . . 2.9100000000000001 112.017 151.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.8 ptmt -85.94 4.87 35.69 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 126.364 1.866 . . . . 5.5499999999999998 113.923 169.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 40.8 tp -96.93 -5.14 38.67 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.463 1.905 . . . . 4.4400000000000004 110.73 167.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.51 ' HG1' ' CD ' ' A' ' 66' ' ' GLU . 42.2 p -146.45 149.73 34.25 Favored 'General case' 0 C--O 1.253 1.263 0 N-CA-C 114.799 1.407 . . . . 1.8600000000000001 114.799 -161.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.2 mt -107.99 102.35 11.53 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 113.512 -1.676 . . . . 2.6499999999999999 110.137 173.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.3 t -75.85 173.24 11.42 Favored 'General case' 0 CA--C 1.552 1.031 0 O-C-N 120.884 -1.135 . . . . 3.6600000000000001 112.764 173.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -55.52 -9.82 0.55 Allowed 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 127.615 2.366 . . . . 4.2800000000000002 117.272 -171.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.439 ' HZ3' ' CD ' ' A' ' 23' ' ' GLU . 7.0 ptmt -93.39 -50.39 5.47 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.741 1.385 . . . . 4.5999999999999996 114.741 164.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -54.2 -41.12 68.26 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.663 1.985 . . . . 2.4199999999999999 108.933 176.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.79 -47.94 67.72 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 114.333 -1.303 . . . . 3.2400000000000002 110.78 -175.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -55.24 -49.53 71.77 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.165 -0.959 . . . . 5.4199999999999999 112.108 171.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.472 ' CD ' ' HZ1' ' A' ' 40' ' ' LYS . 28.3 tp10 -66.78 -10.29 45.92 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.263 1.425 . . . . 3.4199999999999999 114.437 -178.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.7 tt -94.27 -54.27 3.62 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.887 1.221 . . . . 2.9199999999999999 111.402 165.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.6 mt -53.52 -50.83 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 CA-C-N 119.978 1.263 . . . . 2.1000000000000001 110.999 -175.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.5 mtpt -71.99 -2.57 18.67 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.599 0.963 . . . . 4.6600000000000001 113.599 -177.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.472 ' HZ1' ' CD ' ' A' ' 36' ' ' GLU . 44.9 mmtm -101.97 -15.74 16.71 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.45 1.9 . . . . 3.96 113.63 167.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -94.45 -55.07 3.29 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.423 1.489 . . . . 4.4199999999999999 112.544 178.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -68.69 91.04 0.42 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.806 2.042 . . . . 3.0499999999999998 110.332 -177.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.4 t -62.58 -17.04 59.26 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.876 1.27 . . . . 5.7599999999999998 112.5 173.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 28.0 mt -59.13 -25.74 64.12 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 127.908 2.483 . . . . 4.7000000000000002 113.765 171.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.67 -34.72 0.85 Allowed Glycine 0 CA--C 1.538 1.479 0 C-N-CA 125.233 1.397 . . . . 4.3899999999999997 116.456 170.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.501 ' CD ' ' HZ1' ' A' ' 48' ' ' LYS . 8.8 mm-40 -67.17 -4.62 10.77 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.19 1.796 . . . . 5.25 114.762 -178.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.5 tpt -69.89 78.71 0.47 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 123.514 1.626 . . . . 2.6400000000000001 109.795 167.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.501 ' HZ1' ' CD ' ' A' ' 46' ' ' GLU . 3.6 ttmp? -94.53 147.65 23.06 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 127.894 2.478 . . . . 5.7300000000000004 111.658 -160.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -47.64 -44.39 26.92 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.984 2.113 . . . . 4.6100000000000003 115.463 -160.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.4 m -71.91 -35.46 69.7 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.002 1.274 . . . . 2.9399999999999999 113.36 176.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.7 m -74.36 -9.38 58.54 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.871 1.269 . . . . 3.2000000000000002 112.608 173.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.2 mm -79.75 -29.51 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-O 118.447 -0.787 . . . . 3.6400000000000001 110.908 166.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.36 -33.73 75.83 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.848 1.204 . . . . 2.5099999999999998 110.726 173.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -70.54 -43.42 69.57 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.174 0.897 . . . . 3.3100000000000001 112.507 168.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 37.1 tp -62.67 -46.42 88.29 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.387 -0.816 . . . . 3.0299999999999998 111.559 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.09 -53.92 36.63 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 124.199 1.0 . . . . 2.7000000000000002 110.768 166.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 tmpt? -56.59 -28.81 61.16 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 120.243 1.383 . . . . 5.5300000000000002 113.25 177.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.2 m -83.76 -37.29 22.82 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.119 1.767 . . . . 2.4100000000000001 112.642 -177.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 11.0 mp -65.0 -49.87 68.54 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.538 0.735 . . . . 3.5899999999999999 110.661 163.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -88.97 59.69 5.13 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 127.406 2.283 . . . . 1.5700000000000001 112.139 -170.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.9 mtmp? -40.57 -32.69 0.22 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 127.456 2.302 . . . . 4.5999999999999996 115.764 -177.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -98.94 -6.51 28.66 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 115.651 1.722 . . . . 2.9500000000000002 115.651 -178.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.8 t 57.87 31.54 20.67 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.852 1.661 . . . . 3.2799999999999998 114.331 -178.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -69.07 -16.82 63.78 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.969 0.907 . . . . 2.2000000000000002 111.397 173.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.58 15.37 2.13 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 130.214 3.405 . . . . 4.46 114.368 178.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.51 ' CD ' ' HG1' ' A' ' 28' ' ' THR . 4.1 mm-40 -131.18 133.84 45.92 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 127.841 2.456 . . . . 2.52 110.48 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.2 mm -107.34 99.45 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.129 0.972 . . . . 2.6899999999999999 111.097 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -68.32 157.11 36.35 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.531 1.933 . . . . 2.8599999999999999 110.343 170.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.5 -35.23 52.56 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 120.13 1.332 . . . . 3.2000000000000002 113.001 179.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -63.91 -30.2 71.3 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.238 -0.914 . . . . 4.1100000000000003 113.182 174.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -83.56 -45.83 13.1 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.862 1.265 . . . . 2.6000000000000001 110.434 175.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -49.7 -44.16 47.97 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 126.19 1.796 . . . . 4.8499999999999996 111.812 176.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.5 t -60.56 -22.75 64.02 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 120.594 -1.317 . . . . 2.7799999999999998 114.121 176.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.7 t -68.89 -32.91 56.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 O-C-N 120.015 -1.678 . . . . 3.5600000000000001 110.882 176.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -60.55 -57.15 13.95 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.993 0.917 . . . . 3.02 110.961 171.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -53.59 -43.49 68.61 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.965 0.906 . . . . 3.3399999999999999 111.344 176.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 58.9 m -51.97 -54.97 23.43 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.615 1.166 . . . . 2.1499999999999999 111.291 173.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 78.8 mtm -63.44 -43.04 98.57 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 118.817 -0.611 . . . . 2.9100000000000001 112.412 -177.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 63.1 mt -63.21 -39.37 94.45 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.492 0.587 . . . . 2.3599999999999999 112.182 176.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.425 ' HB3' ' CZ ' ' B' ' 69' ' ' PHE . 87.9 m -65.06 -38.1 89.71 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 118.674 -0.679 . . . . 2.8599999999999999 112.514 172.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 15.1 mtp -64.75 -36.07 83.13 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.453 1.024 . . . . 3.3399999999999999 113.165 171.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.66 -53.08 53.06 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.295 0.952 . . . . 1.96 111.946 174.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -65.04 -25.97 68.06 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.573 0.953 . . . . 3.7200000000000002 113.573 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -60.31 -43.07 96.68 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.52 1.128 . . . . 3.8700000000000001 113.074 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -75.23 -45.02 42.97 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.014 1.326 . . . . 2.8100000000000001 111.358 178.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -49.76 -48.68 50.17 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.346 1.859 . . . . 3.0800000000000001 110.939 175.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -56.11 -27.12 52.67 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.462 1.505 . . . . 3.2999999999999998 113.386 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 43.6 mt -80.12 -27.87 39.08 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.184 -0.947 . . . . 2.3100000000000001 112.432 178.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -87.36 -20.04 27.29 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.747 1.219 . . . . 2.73 113.888 175.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -82.28 -31.8 29.9 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 128.401 2.68 . . . . 2.8199999999999998 113.669 -178.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -92.82 16.35 12.63 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 125.185 1.394 . . . . 2.98 113.298 -176.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 36.4 mtpt . . . . . 0 C--O 1.252 1.199 0 CA-C-O 115.323 -2.275 . . . . 4.3499999999999996 116.104 -175.094 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 19.5 mtt . . . . . 0 N--CA 1.473 0.693 0 N-CA-C 108.223 -1.028 . . . . 7.1900000000000004 108.223 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.443 ' CD ' ' H ' ' B' ' 2' ' ' GLU . 1.6 mp0 -87.01 169.53 12.34 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 129.027 2.931 . . . . 6.04 109.461 178.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 41.3 p -65.95 156.04 85.07 Favored Pre-proline 0 N--CA 1.471 0.607 0 C-N-CA 123.663 0.785 . . . . 3.5299999999999998 110.41 170.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -63.96 -23.9 67.68 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.341 2.027 . . . . 1.8999999999999999 112.218 173.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 73.7 mt -75.07 -43.21 54.54 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.187 0.995 . . . . 4.3200000000000003 111.895 174.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -66.99 -28.57 68.36 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.011 1.278 . . . . 3.8700000000000001 112.086 168.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -36.07 82.88 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.188 -1.57 . . . . 5.8899999999999997 112.551 167.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.0 -44.79 68.64 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.287 1.035 . . . . 2.1200000000000001 112.371 171.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 50.2 mt -60.82 -42.36 97.54 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.86 1.209 . . . . 2.77 111.838 175.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 20.8 p -68.81 -37.48 79.25 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 117.776 -1.107 . . . . 3.52 111.904 173.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 85.3 m -59.09 -42.81 91.37 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.944 1.247 . . . . 1.9399999999999999 111.45 169.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 8.4 mtt -58.24 -51.44 69.77 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.678 0.791 . . . . 4.4000000000000004 110.61 175.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.32 -36.58 64.52 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 113.883 1.068 . . . . 2.8599999999999999 113.883 173.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 90.7 m -63.22 -52.66 61.31 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.443 1.497 . . . . 1.6200000000000001 110.928 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.16 -39.1 65.92 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 114.878 -1.056 . . . . 3.1899999999999999 108.525 -175.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -57.53 -45.65 84.79 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.039 0.535 . . . . 3.6299999999999999 111.019 176.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 6.7 m80 -68.7 -29.46 67.9 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.776 1.028 . . . . 2.6800000000000002 113.776 177.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 18.7 ttmm -68.04 -28.31 67.28 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.35 1.06 . . . . 4.2599999999999998 113.475 176.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -85.79 -45.83 11.24 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.927 0.891 . . . . 4.04 112.08 166.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 38.3 t -60.69 -27.25 67.73 Favored 'General case' 0 C--O 1.249 1.054 0 N-CA-C 114.524 1.305 . . . . 2.4199999999999999 114.524 -175.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.96 -2.25 90.28 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 116.637 -2.201 . . . . 1.46 115.268 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.4 mtp85 -75.11 -110.71 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.559 1.544 . . . . 4.8200000000000003 110.207 172.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -44.37 129.55 6.49 Favored 'General case' 0 C--O 1.248 1.0 0 CA-C-N 120.48 1.491 . . . . 4.1699999999999999 111.201 171.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.43 -35.41 91.67 Favored Glycine 0 N--CA 1.469 0.848 0 CA-C-N 114.533 -1.212 . . . . 3.29 115.64 -132.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 2.0 t -62.25 138.27 58.39 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.089 1.756 . . . . 4.6399999999999997 111.754 172.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -130.95 155.87 46.06 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.836 1.654 . . . . 6.8700000000000001 111.861 -169.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.0 mp 76.16 3.44 3.67 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 128.877 2.871 . . . . 5.0099999999999998 111.921 -157.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 10.9 p -143.47 149.03 36.98 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 131.322 3.849 . . . . 2.27 112.082 -166.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 50.4 mt -118.65 121.21 39.62 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.182 1.793 . . . . 3.1899999999999999 111.799 -176.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 4.7 t -91.77 -178.72 5.12 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.089 1.356 . . . . 2.6099999999999999 113.926 166.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 29.8 ttp85 -60.5 -23.91 64.9 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.144 2.177 . . . . 6.21 116.597 -161.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 mptt -110.47 -19.44 12.93 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 115.095 1.517 . . . . 9.0 115.095 172.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -54.8 -59.59 4.52 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.093 0.957 . . . . 2.3100000000000001 109.32 160.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -61.86 -39.66 92.64 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 127.101 2.16 . . . . 3.2599999999999998 110.963 -177.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -39.67 82.04 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.177 -1.577 . . . . 6.8799999999999999 113.993 178.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 32.7 tp10 -90.31 -21.46 22.04 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 118.003 -0.999 . . . . 4.0 112.611 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.7 tt -54.46 -62.37 1.7 Allowed 'General case' 0 C--N 1.343 0.315 0 CA-C-O 118.086 -0.959 . . . . 3.5 109.499 164.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 35.1 mt -47.61 -57.62 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 C-N-CA 123.892 0.877 . . . . 2.0 110.479 -175.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -72.96 -2.39 20.78 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 113.894 1.072 . . . . 5.7699999999999996 113.894 -168.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 24.9 mttp -117.7 -33.6 4.48 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 120.358 -1.464 . . . . 3.7599999999999998 114.331 170.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -60.32 -41.32 93.24 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.839 1.255 . . . . 5.25 110.151 170.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -102.0 117.23 34.38 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 106.281 -1.748 . . . . 3.3300000000000001 106.281 158.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 9.2 t -110.1 -9.71 14.7 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.3 1.04 . . . . 3.9399999999999999 112.811 -171.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -54.61 -2.76 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 117.915 2.561 . . . . 4.0300000000000002 117.915 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.37 17.32 59.04 Favored Glycine 0 N--CA 1.476 1.307 0 CA-C-N 120.116 1.325 . . . . 5.3499999999999996 115.208 174.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.7 -163.4 1.02 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.359 1.464 . . . . 6.46 111.652 177.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 78.18 178.04 0.14 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.515 2.726 . . . . 3.2599999999999998 114.713 176.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -165.58 139.95 4.74 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.182 1.793 . . . . 8.3699999999999992 108.517 -175.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -61.56 -31.88 71.93 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 121.057 1.753 . . . . 4.7400000000000002 111.643 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.3 m -70.44 24.81 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.263 1.825 . . . . 3.7599999999999998 115.285 165.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -139.77 15.54 2.5 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.411 1.485 . . . . 3.4900000000000002 111.939 154.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 71.7 mt -112.28 -46.59 5.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.612 1.165 . . . . 2.5600000000000001 111.204 -176.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.83 -30.03 71.02 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.055 0.843 . . . . 3.71 111.586 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -78.6 -46.38 19.45 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 128.696 2.798 . . . . 5.3499999999999996 113.967 171.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 48.9 tp -58.25 -35.98 72.54 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.18 0.446 . . . . 3.73 111.157 173.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.4 mmm -49.29 -46.24 46.24 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.899 1.28 . . . . 2.9199999999999999 111.194 171.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.3 mptt -68.72 -39.78 80.26 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.745 -1.222 . . . . 8.2300000000000004 112.129 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.5 t -64.98 -29.57 70.5 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-O 122.229 1.014 . . . . 2.1299999999999999 113.303 -176.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.2 mp -76.66 -21.35 55.56 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.594 1.158 . . . . 4.1299999999999999 112.717 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -89.14 127.67 35.74 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.968 1.307 . . . . 2.3399999999999999 110.133 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.32 11.53 21.05 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 120.616 -1.302 . . . . 4.4900000000000002 112.753 -170.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 33.4 p30 -163.45 -27.01 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.69 1.737 . . . . 3.1000000000000001 115.69 -165.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 29.9 t 70.38 51.96 0.36 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.436 1.495 . . . . 3.6099999999999999 110.603 -170.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 11.7 p30 -82.86 -54.57 5.0 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.48 1.512 . . . . 3.8999999999999999 109.871 -174.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 171.74 -25.5 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 131.656 3.982 . . . . 8.7300000000000004 113.881 169.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -154.96 154.54 32.74 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 125.331 1.452 . . . . 2.27 110.49 -163.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 3.1 mm -92.99 105.37 16.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 126.072 1.749 . . . . 2.98 109.037 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.1 165.32 20.54 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.41 -0.806 . . . . 3.1499999999999999 110.631 167.091 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . 0.425 ' CZ ' ' HB3' ' A' ' 80' ' ' CYS . 0.4 OUTLIER -54.1 -38.57 65.51 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 120.421 -1.424 . . . . 5.0599999999999996 112.997 178.642 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -76.67 -21.7 55.06 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.75 -1.219 . . . . 5.4500000000000002 113.69 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -69.75 -61.45 1.78 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.182 0.993 . . . . 2.2999999999999998 109.507 160.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.04 -32.85 70.13 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 128.504 2.721 . . . . 3.2999999999999998 114.866 -172.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 60.2 p -61.85 -14.75 36.34 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 119.482 -2.011 . . . . 2.3799999999999999 113.299 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 5.1 p -60.67 -29.37 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 O-C-N 121.06 -1.025 . . . . 3.9399999999999999 112.486 170.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -75.77 -47.72 24.72 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.506 1.522 . . . . 3.2400000000000002 111.33 175.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 93.8 mt -54.67 -35.7 63.82 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.225 0.61 . . . . 2.46 111.555 169.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 19.3 m -63.14 -53.81 47.5 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.199 0.999 . . . . 2.0 111.312 172.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 19.8 mtm -56.45 -49.7 73.85 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.93 0.892 . . . . 2.8900000000000001 112.191 177.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 85.2 mt -60.94 -43.83 98.12 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.33 1.052 . . . . 2.46 111.589 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.6 t -72.59 -28.79 63.01 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 113.08 0.77 . . . . 3.6600000000000001 113.08 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 86.2 mtp -67.22 -42.74 83.57 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 118.996 0.816 . . . . 3.54 111.074 170.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.06 -27.25 69.27 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 118.711 0.687 . . . . 2.27 112.706 173.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -73.31 -28.62 62.18 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.311 1.226 . . . . 4.1100000000000003 114.311 170.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -65.65 -44.79 85.28 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 120.275 1.398 . . . . 3.3900000000000001 109.804 170.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -67.67 -31.84 72.1 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.135 0.974 . . . . 2.9199999999999999 110.614 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.11 -50.88 70.14 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.763 1.225 . . . . 4.3399999999999999 111.852 167.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -59.61 -33.08 71.04 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.501 1.52 . . . . 3.1899999999999999 112.243 -177.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 94.2 mt -79.27 -18.62 52.39 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.836 1.254 . . . . 2.54 113.782 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.485 ' CD ' ' HZ3' ' B' ' 92' ' ' LYS . 51.2 mm-40 -95.13 -11.79 27.56 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 114.381 1.252 . . . . 3.54 114.381 176.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -94.23 -50.21 5.38 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.556 1.542 . . . . 3.1899999999999999 112.798 174.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -82.0 52.63 2.01 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.274 1.43 . . . . 2.8599999999999999 111.792 -174.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . 0.485 ' HZ3' ' CD ' ' B' ' 89' ' ' GLU . 57.2 mmtt . . . . . 0 C--O 1.248 1.021 0 C-N-CA 128.558 2.743 . . . . 4.9299999999999997 114.609 171.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 108.471 -0.937 . . . . 7.96 108.471 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -144.8 144.84 31.36 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 126.807 2.043 . . . . 3.7400000000000002 106.126 -165.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.9 p -62.64 163.6 14.92 Favored Pre-proline 0 CA--C 1.54 0.561 0 C-N-CA 126.334 1.853 . . . . 2.3399999999999999 113.547 -167.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -67.86 -12.76 36.41 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 122.406 2.071 . . . . 1.49 113.342 169.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.08 -38.08 32.48 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.718 1.145 . . . . 3.2599999999999998 110.891 174.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -55.7 -53.97 49.98 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 108.473 -0.936 . . . . 4.7000000000000002 108.473 166.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.6 mttp -64.38 -25.08 67.87 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 112.316 0.488 . . . . 4.2400000000000002 112.316 -176.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.41 -47.02 58.65 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.203 0.91 . . . . 1.9399999999999999 111.722 171.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 43.5 mt -62.83 -44.53 95.9 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.02 0.928 . . . . 2.3599999999999999 111.387 176.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 88.1 m -61.51 -46.4 90.14 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.459 1.903 . . . . 2.2400000000000002 111.908 173.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.8 m -61.67 -45.48 93.83 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.215 0.916 . . . . 2.2200000000000002 110.468 177.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -60.49 -52.61 64.46 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.618 0.645 . . . . 4.6200000000000001 110.937 -177.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.7 p -63.95 -23.63 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 O-C-N 120.96 -1.088 . . . . 3.3500000000000001 113.318 177.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.9 m -65.87 -58.3 5.91 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 117.721 -1.133 . . . . 2.2200000000000002 109.826 172.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -40.3 66.57 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.822 0.849 . . . . 2.8300000000000001 110.291 175.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -57.31 -49.59 75.61 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 124.718 1.261 . . . . 3.6699999999999999 110.433 -174.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -61.97 -42.22 98.88 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.274 -0.892 . . . . 2.5800000000000001 112.633 175.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -69.5 -36.41 76.46 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.838 -1.164 . . . . 7.6500000000000004 112.764 -176.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -85.12 -20.08 30.85 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.414 1.486 . . . . 3.71 114.567 172.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.7 p -55.84 -32.23 63.43 Favored 'General case' 0 N--CA 1.485 1.303 0 O-C-N 119.79 -1.819 . . . . 3.52 113.509 171.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 109.72 -131.31 10.41 Favored Glycine 0 C--N 1.34 0.792 0 CA-C-N 114.255 -1.339 . . . . 3.9300000000000002 114.298 126.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -123.32 -14.64 7.39 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 127.112 2.165 . . . . 6.0199999999999996 111.85 -171.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -131.59 153.3 50.03 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 126.96 2.104 . . . . 4.2199999999999998 111.705 -170.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.64 -124.32 34.19 Favored Glycine 0 C--N 1.337 0.625 0 CA-C-N 113.302 -1.772 . . . . 2.3999999999999999 109.75 -169.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 42.2 t -98.08 168.99 9.93 Favored 'General case' 0 C--O 1.252 1.19 0 CA-C-O 122.651 1.215 . . . . 3.6000000000000001 111.434 160.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -107.95 22.37 16.06 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 129.594 3.157 . . . . 5.8099999999999996 111.987 175.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.4 tp -96.0 -5.02 42.12 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.463 1.105 . . . . 4.3700000000000001 110.386 153.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.1 p -150.6 135.69 17.68 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 113.173 0.805 . . . . 1.97 113.173 -151.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.5 mp -98.53 108.91 21.72 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.783 1.233 . . . . 3.27 112.297 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.1 p -64.26 158.15 24.03 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 124.562 1.145 . . . . 3.7200000000000002 112.54 167.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.7 tpt180 -44.39 -43.52 7.7 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.479 0.918 . . . . 5.75 113.479 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.77 -33.53 66.36 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.039 1.125 . . . . 4.7800000000000002 114.039 179.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -64.86 -51.46 61.91 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.518 1.527 . . . . 2.21 108.589 173.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.3 tp -58.34 -41.64 85.07 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.027 0.931 . . . . 3.5600000000000001 112.732 175.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tmpt? -53.79 -33.68 56.74 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.41 0.684 . . . . 7.9400000000000004 112.385 177.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -79.51 -48.76 13.33 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 118.538 -0.744 . . . . 3.9700000000000002 111.191 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.3 tp -49.15 -59.84 3.31 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.306 1.042 . . . . 3.04 111.263 177.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.5 mt -57.99 -35.0 50.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 123.242 0.617 . . . . 2.1400000000000001 110.556 -177.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -72.71 -2.88 21.99 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.563 1.32 . . . . 4.9299999999999997 114.563 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt -133.1 -28.34 1.54 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 127.124 2.17 . . . . 3.9399999999999999 112.476 -172.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -68.54 -123.29 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 107.701 -1.222 . . . . 4.1200000000000001 107.701 144.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -56.98 -53.12 61.69 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 115.869 1.803 . . . . 3.1099999999999999 115.869 -158.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 17.0 t 62.07 -4.06 0.22 Allowed 'General case' 0 CA--C 1.558 1.269 0 N-CA-C 116.59 2.07 . . . . 4.4900000000000002 116.59 172.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -42.82 -49.56 5.76 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 115.911 1.819 . . . . 5.7400000000000002 115.911 -151.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.81 -37.13 0.43 Allowed Glycine 0 N--CA 1.468 0.78 0 C-N-CA 124.781 1.181 . . . . 4.0199999999999996 112.98 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -61.87 -35.36 78.07 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.214 1.006 . . . . 7.3099999999999996 111.834 172.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -71.37 63.53 0.38 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 127.027 2.131 . . . . 2.4100000000000001 114.347 -178.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.6 mmmt -92.26 165.23 13.21 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 129.285 3.034 . . . . 8.7400000000000002 109.788 161.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.465 ' CD ' ' H ' ' A' ' 49' ' ' GLU . 3.0 mp0 -42.38 -51.41 4.91 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.106 1.762 . . . . 4.7599999999999998 114.654 -168.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.1 m -71.99 -28.21 63.26 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 114.964 1.468 . . . . 3.71 114.964 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.4 t -76.22 -27.52 56.85 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 120.316 -1.49 . . . . 2.52 111.004 170.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 74.8 mt -74.11 -22.94 18.39 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 O-C-N 121.327 -0.858 . . . . 2.9900000000000002 111.039 169.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.27 -51.28 54.87 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.91 1.284 . . . . 3.73 110.488 168.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.41 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 3.4 t70 -69.15 -39.74 78.62 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.269 0.47 . . . . 2.3199999999999998 112.269 178.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 57.4 tp -63.78 -50.9 67.19 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 116.524 -1.703 . . . . 3.1800000000000002 110.757 173.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.1 ttt -53.81 -48.53 69.78 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-N 121.305 1.866 . . . . 2.2200000000000002 110.31 174.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.41 ' HE2' ' HA ' ' A' ' 54' ' ' ASP . 2.4 tmmm? -56.37 -29.47 61.47 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.191 0.996 . . . . 4.0999999999999996 113.502 174.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 24.4 t -77.24 -33.2 56.1 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 120.215 -1.553 . . . . 2.9399999999999999 112.912 174.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 18.9 mt -80.56 -47.57 14.0 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.793 0.724 . . . . 3.1600000000000001 111.821 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -79.14 79.07 5.58 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 127.964 2.505 . . . . 2.1800000000000002 111.918 -163.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -68.32 -18.35 64.48 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 116.516 2.043 . . . . 4.4699999999999998 116.516 -177.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.84 -26.99 49.77 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 120.641 1.564 . . . . 3.04 111.669 161.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.3 m 58.77 76.21 0.36 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.79 2.036 . . . . 4.4299999999999997 111.413 177.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -146.27 -109.0 0.1 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.305 -0.861 . . . . 3.2000000000000002 110.082 -151.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -139.49 -20.7 0.93 Allowed 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 115.522 1.675 . . . . 6.3300000000000001 115.522 168.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -130.82 153.08 49.46 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 122.95 1.357 . . . . 3.8500000000000001 113.651 174.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 27.3 mt -90.2 113.9 27.02 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 C-N-CA 126.863 2.065 . . . . 3.3799999999999999 110.55 173.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -64.77 156.99 28.77 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.579 1.151 . . . . 3.6299999999999999 110.662 163.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -57.15 -28.98 63.22 Favored 'General case' 0 CA--C 1.549 0.937 0 O-C-N 120.897 -1.127 . . . . 4.4299999999999997 110.859 165.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.81 -25.88 63.98 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 120.097 -1.627 . . . . 7.2000000000000002 113.746 174.2 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -80.97 -53.21 6.64 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.672 1.189 . . . . 2.4199999999999999 109.288 170.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -48.67 -23.93 1.19 Allowed 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 127.273 2.229 . . . . 3.79 114.573 176.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 47.0 m -52.9 -36.22 59.11 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.647 1.579 . . . . 2.9199999999999999 112.537 171.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 p -79.65 -30.24 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 121.621 -0.674 . . . . 3.2000000000000002 111.696 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -60.23 -56.91 15.76 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.749 0.82 . . . . 2.9300000000000002 110.611 173.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.1 mt -58.84 -34.62 71.76 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.678 0.791 . . . . 2.5800000000000001 112.625 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 84.1 m -62.71 -54.27 41.84 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.459 1.104 . . . . 1.9399999999999999 111.173 173.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 46.6 mtp -54.58 -47.02 73.83 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.243 0.928 . . . . 2.8799999999999999 111.364 177.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.74 -50.21 71.96 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.401 1.08 . . . . 2.3799999999999999 112.392 178.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 93.1 m -63.82 -33.95 76.83 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.192 0.906 . . . . 3.23 113.429 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 92.5 mtp -64.16 -43.89 93.79 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.221 0.918 . . . . 2.75 111.129 175.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.53 -39.73 92.13 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.07 0.548 . . . . 1.6200000000000001 112.272 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -62.44 -31.64 72.38 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.387 0.884 . . . . 3.5600000000000001 113.387 174.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 15.2 t30 -73.29 -37.18 66.31 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.631 1.105 . . . . 2.3999999999999999 112.134 178.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.88 -37.99 89.48 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.195 0.998 . . . . 3.0600000000000001 112.123 167.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.05 -43.38 91.7 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.865 0.866 . . . . 3.0 111.267 174.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -63.35 -32.2 73.56 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.367 1.467 . . . . 3.71 112.007 176.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 35.0 mt -74.94 -17.97 60.47 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.189 -0.944 . . . . 2.1400000000000001 113.025 175.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -94.61 4.24 54.09 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.969 1.707 . . . . 2.6299999999999999 113.779 169.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -94.03 -49.35 5.82 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.889 1.276 . . . . 4.04 110.975 164.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -76.13 20.25 0.21 Allowed 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 126.083 1.753 . . . . 3.2999999999999998 114.251 -178.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.025 0 N-CA-C 118.151 2.648 . . . . 4.5700000000000003 118.151 -163.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.452 ' HA ' ' OE1' ' B' ' 2' ' ' GLU . 24.0 ptt? . . . . . 0 N--CA 1.475 0.784 0 N-CA-C 108.785 -0.82 . . . . 8.9100000000000001 108.785 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.452 ' OE1' ' HA ' ' B' ' 1' ' ' MET . 18.2 mp0 -110.34 -109.41 0.34 Allowed 'General case' 0 CA--C 1.539 0.522 0 O-C-N 125.342 1.651 . . . . 5.2400000000000002 108.689 -151.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 2.6 p -123.03 169.31 10.18 Favored Pre-proline 0 N--CA 1.476 0.871 0 C-N-CA 125.259 1.424 . . . . 3.6499999999999999 111.175 -174.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -73.93 -10.65 23.2 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.393 2.062 . . . . 2.1699999999999999 112.744 169.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -67.9 -54.58 17.69 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.693 1.197 . . . . 3.7200000000000002 111.662 -177.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -57.37 -30.85 65.21 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 118.996 0.816 . . . . 4.0899999999999999 111.979 175.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -74.89 -33.92 62.12 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 120.522 -1.361 . . . . 6.2300000000000004 111.848 176.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.22 -46.19 65.01 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.472 1.509 . . . . 1.5900000000000001 111.304 173.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.3 mp -66.65 -36.73 83.26 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.14 0.882 . . . . 3.7999999999999998 111.381 176.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 54.5 m -56.21 -48.36 76.58 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 121.592 -0.692 . . . . 2.4399999999999999 111.07 166.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 90.4 m -62.46 -35.46 79.38 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.629 1.172 . . . . 1.8899999999999999 111.766 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -54.84 -59.9 4.1 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 118.439 -0.791 . . . . 4.5800000000000001 110.607 166.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 17.8 m -67.83 -17.89 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 CA-C-N 120.332 1.424 . . . . 3.2599999999999998 113.588 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 62.3 m -71.83 -48.87 43.19 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.752 1.621 . . . . 1.7 111.171 171.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 64.5 p -58.07 -33.35 68.95 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 118.202 -0.904 . . . . 2.5499999999999998 110.101 166.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -72.76 -49.54 30.23 Favored 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 119.713 1.142 . . . . 3.7000000000000002 111.834 -175.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -72.63 -17.45 61.67 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 120.171 -1.58 . . . . 3.02 114.459 178.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -82.72 -66.46 0.89 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.392 0.677 . . . . 5.5700000000000003 111.77 166.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -69.69 -29.98 67.54 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.591 1.087 . . . . 3.1899999999999999 113.633 -175.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 19.9 p -70.91 -19.31 62.61 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 122.445 2.384 . . . . 2.4900000000000002 111.986 172.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -94.04 17.69 58.28 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 126.886 2.184 . . . . 2.2000000000000002 113.477 168.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 51.2 tpt85 -72.9 -28.89 62.74 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.207 1.004 . . . . 4.1399999999999997 111.193 169.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -157.63 153.81 27.38 Favored 'General case' 0 C--O 1.251 1.149 0 C-N-CA 125.866 1.667 . . . . 3.4900000000000002 111.952 170.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.66 -136.35 36.89 Favored Glycine 0 C--N 1.335 0.528 0 C-N-CA 125.559 1.552 . . . . 2.8599999999999999 112.014 168.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 11.4 m -58.02 128.42 37.0 Favored 'General case' 0 C--O 1.246 0.915 0 O-C-N 122.292 -0.534 . . . . 3.5699999999999998 111.181 174.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -76.46 111.79 12.3 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 126.134 1.773 . . . . 8.2599999999999998 107.315 148.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 35.4 tp 141.72 -41.69 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 130.038 3.335 . . . . 4.6900000000000004 106.925 -161.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 71.0 p -121.6 141.71 50.83 Favored 'General case' 0 C--O 1.255 1.36 0 CA-C-O 123.22 1.486 . . . . 2.7599999999999998 112.903 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 22.0 mt -93.72 95.98 9.51 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 111.83 -2.441 . . . . 2.9100000000000001 107.267 157.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 6.6 m -65.58 155.97 34.15 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 120.721 -1.237 . . . . 2.8399999999999999 110.441 169.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 25.2 ttt180 -41.54 -29.1 0.15 Allowed 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 117.43 2.381 . . . . 4.9699999999999998 117.43 -174.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -85.88 -38.04 18.49 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 115.229 1.566 . . . . 5.2599999999999998 115.229 172.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -56.78 -48.53 77.7 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.049 0.94 . . . . 1.77 108.918 167.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 14.4 tp -63.52 -43.9 95.83 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.055 0.942 . . . . 3.0600000000000001 111.899 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 23.4 ttmt -56.5 -47.17 79.88 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 119.268 -0.396 . . . . 3.8700000000000001 111.738 179.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -59.61 -44.2 93.49 Favored 'General case' 0 CA--C 1.553 1.08 0 N-CA-C 113.452 0.908 . . . . 3.3500000000000001 113.452 174.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 31.3 tp -61.18 -55.67 29.61 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.812 1.245 . . . . 3.1099999999999999 111.186 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 19.7 mt -59.07 -52.57 59.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 108.889 -0.782 . . . . 2.0499999999999998 108.889 -178.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.3 -27.15 67.07 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 113.937 1.088 . . . . 6.7400000000000002 113.937 -173.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -85.49 -53.81 4.96 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 120.093 1.315 . . . . 4.6200000000000001 114.516 170.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -72.73 -31.21 64.8 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 118.245 0.475 . . . . 4.79 110.937 -171.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -110.27 72.56 0.8 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.078 1.351 . . . . 2.77 108.911 161.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.7 t -71.39 61.81 0.34 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.971 1.308 . . . . 3.5899999999999999 112.306 174.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.25 166.84 11.21 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 127.337 2.255 . . . . 5.46 112.402 -173.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -85.9 -72.64 1.29 Allowed Glycine 0 C--N 1.338 0.649 0 C-N-CA 125.291 1.424 . . . . 4.0800000000000001 109.676 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.565 ' H ' ' CD ' ' B' ' 46' ' ' GLU . 1.2 pm0 -40.27 -30.61 0.11 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 128.831 2.852 . . . . 6.0499999999999998 115.258 164.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -72.99 53.37 0.35 Allowed 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.792 -1.193 . . . . 3.04 111.431 163.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.451 ' HA ' ' HE2' ' B' ' 48' ' ' LYS . 2.7 mmpt? -59.09 159.81 6.91 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 123.157 1.456 . . . . 5.9500000000000002 111.443 172.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -76.87 -8.52 57.5 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.381 -0.825 . . . . 6.1299999999999999 113.103 -156.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 12.3 t -102.6 -14.76 16.62 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.022 1.729 . . . . 3.5099999999999998 113.872 162.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 4.5 m -62.44 -28.48 69.84 Favored 'General case' 0 N--CA 1.482 1.157 0 CA-C-N 121.259 1.845 . . . . 3.2200000000000002 110.493 166.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 14.0 mm -52.36 -37.24 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 126.461 1.904 . . . . 2.4100000000000001 113.253 165.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -82.92 -27.22 30.75 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.164 0.985 . . . . 3.7200000000000002 112.592 -173.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.76 -46.94 67.49 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 118.428 -0.796 . . . . 2.5 110.461 161.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -54.56 -49.04 71.3 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.407 1.083 . . . . 3.5499999999999998 110.558 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.42 -48.89 79.2 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.982 0.913 . . . . 2.6400000000000001 111.765 174.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -18.58 62.13 Favored 'General case' 0 CA--C 1.555 1.144 0 N-CA-C 114.634 1.346 . . . . 4.1900000000000004 114.634 172.123 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.9 m -94.13 -29.79 14.97 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.41 1.884 . . . . 3.1800000000000002 112.483 -179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 96.2 mt -74.91 -49.14 21.3 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.475 1.11 . . . . 3.2599999999999998 111.082 165.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -82.84 63.92 7.19 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 125.998 1.719 . . . . 2.3100000000000001 111.643 -172.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 27.7 mttm -56.09 -20.47 17.35 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.084 1.754 . . . . 4.9000000000000004 112.194 175.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -72.42 -32.58 66.46 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.511 1.924 . . . . 2.75 113.877 174.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 21.2 t 62.93 29.38 16.51 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.675 1.19 . . . . 3.77 113.227 -161.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 10.0 p30 -86.44 -14.53 43.0 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.4 1.48 . . . . 2.1699999999999999 112.462 -177.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 69.46 2.06 3.58 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 128.979 2.911 . . . . 5.0800000000000001 116.923 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -100.53 147.34 26.03 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 127.783 2.433 . . . . 2.8300000000000001 110.923 167.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 43.3 mm -106.4 103.52 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 108.128 -1.064 . . . . 2.1499999999999999 108.128 160.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.26 165.51 23.51 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.578 1.551 . . . . 2.5 110.738 165.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -52.59 -26.21 12.78 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 115.222 1.564 . . . . 3.5699999999999998 115.222 -175.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.3 -43.84 16.99 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 120.649 -1.282 . . . . 4.1299999999999999 111.647 177.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -55.92 -35.53 66.71 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.29 1.036 . . . . 2.3100000000000001 110.133 169.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -76.87 -38.55 53.45 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.365 1.866 . . . . 4.4000000000000004 113.498 176.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 51.9 p -73.05 -34.61 66.39 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 119.767 -1.833 . . . . 2.71 111.72 176.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.8 p -69.28 -29.81 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.143 0.883 . . . . 3.9100000000000001 112.352 172.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -59.06 -57.79 11.5 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.179 -0.951 . . . . 2.6200000000000001 111.382 166.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 96.6 mt -62.03 -29.47 70.3 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.462 0.705 . . . . 3.0 112.321 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 45.5 m -63.37 -53.34 53.99 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.856 1.262 . . . . 2.2599999999999998 111.622 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 74.1 mtm -59.41 -39.74 84.44 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 119.173 0.897 . . . . 2.73 111.471 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.83 -56.43 19.54 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.12 0.568 . . . . 3.0699999999999998 111.608 173.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 5.1 t -60.3 -32.45 71.22 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.218 0.917 . . . . 2.8300000000000001 112.592 -177.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 76.9 mtp -71.63 -33.15 68.7 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.841 1.052 . . . . 3.3999999999999999 113.841 170.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.19 -35.51 81.03 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 120.535 1.516 . . . . 2.04 112.391 172.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -64.25 -19.6 65.49 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.215 -0.928 . . . . 4.2000000000000002 112.947 171.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.72 -45.21 79.45 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.771 1.169 . . . . 2.8599999999999999 112.063 170.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.88 -46.3 78.87 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.565 1.146 . . . . 3.8500000000000001 110.244 177.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -53.08 -47.38 68.56 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.942 1.697 . . . . 3.77 112.19 175.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -61.15 -27.74 68.61 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.476 1.51 . . . . 3.48 113.163 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 43.8 mt -79.38 -13.57 59.53 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.208 1.003 . . . . 2.77 112.949 178.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -108.21 8.53 27.95 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.161 1.785 . . . . 3.6499999999999999 113.081 168.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -107.03 -54.77 2.42 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.849 1.259 . . . . 3.6800000000000002 112.145 174.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.28 31.75 0.51 Allowed 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 124.904 1.282 . . . . 3.3100000000000001 112.678 176.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 2.1 ptmm? . . . . . 0 C--O 1.257 1.469 0 N-CA-C 117.314 2.338 . . . . 5.25 117.314 -157.642 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.5 mtt . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 121.244 0.545 . . . . 12.279999999999999 111.029 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -104.32 -51.14 3.17 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 124.715 1.206 . . . . 5.4900000000000002 113.267 -158.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 44.2 p -111.62 160.02 31.08 Favored Pre-proline 0 N--CA 1.468 0.474 0 CA-C-N 116.002 -0.545 . . . . 2.3700000000000001 111.845 -156.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -59.37 -21.22 59.94 Favored 'Trans proline' 0 CA--C 1.536 0.588 0 C-N-CA 121.771 1.648 . . . . 1.3700000000000001 111.63 166.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.79 -49.9 14.78 Favored 'General case' 0 C--N 1.344 0.361 0 CA-C-O 118.333 -0.842 . . . . 3.3999999999999999 110.525 174.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -62.93 -33.02 74.47 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 120.792 1.633 . . . . 3.4700000000000002 111.875 176.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -67.92 -25.12 65.32 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.665 -1.272 . . . . 5.1799999999999997 113.04 172.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.49 -44.53 34.99 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.827 0.851 . . . . 1.8600000000000001 111.936 172.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.7 mt -64.13 -40.53 96.37 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 121.107 -0.996 . . . . 2.4700000000000002 111.962 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.6 p -61.97 -45.16 94.87 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 117.511 -1.233 . . . . 3.79 111.162 171.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 54.3 m -53.91 -38.22 64.6 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 119.16 0.891 . . . . 2.1299999999999999 111.54 173.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.1 tpp -56.3 -48.46 76.62 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 118.766 -0.635 . . . . 4.4299999999999997 111.89 175.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.7 m -72.27 -29.53 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 119.462 1.028 . . . . 3.4199999999999999 112.67 175.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.8 m -57.43 -57.87 10.77 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.827 1.194 . . . . 1.8500000000000001 111.472 175.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.92 -24.51 58.52 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.62 0.768 . . . . 3.21 110.311 -178.238 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -65.33 -59.23 4.26 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-O 117.982 -1.008 . . . . 3.0899999999999999 111.535 170.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 63.2 m-70 -58.78 -42.23 88.51 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 120.782 1.628 . . . . 4.3499999999999996 112.656 -175.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.5 tttt -39.55 -53.71 2.06 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.246 2.218 . . . . 6.6399999999999997 113.937 168.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -95.95 -29.47 14.14 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.31 1.226 . . . . 3.8100000000000001 114.31 -178.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.8 t -73.43 -34.12 65.28 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 127.073 2.149 . . . . 2.5899999999999999 113.181 -177.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -73.57 -22.04 78.86 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 124.319 0.961 . . . . 2.04 112.338 170.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -86.21 68.74 10.36 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.188 1.395 . . . . 6.1600000000000001 110.206 -177.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.505 ' HG2' ' H ' ' A' ' 24' ' ' GLY . 8.8 tt0 102.78 -176.76 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 129.638 3.175 . . . . 3.9900000000000002 111.588 173.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.505 ' H ' ' HG2' ' A' ' 23' ' ' GLU . . . 57.93 -145.12 40.87 Favored Glycine 0 N--CA 1.47 0.926 0 C-N-CA 124.895 1.236 . . . . 2.75 110.7 -170.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -79.51 169.49 17.96 Favored 'General case' 0 CA--C 1.553 1.066 0 O-C-N 121.504 -0.998 . . . . 3.1200000000000001 111.054 153.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.5 ptpp? -94.66 -5.65 45.11 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.66 1.584 . . . . 6.4400000000000004 115.161 -173.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 25.8 tp -100.96 4.54 42.6 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.609 1.564 . . . . 4.3799999999999999 111.012 169.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.526 ' HG1' ' CD ' ' A' ' 66' ' ' GLU . 55.0 p -142.6 144.94 33.06 Favored 'General case' 0 C--O 1.246 0.911 0 C-N-CA 125.991 1.717 . . . . 1.95 112.397 -165.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 26.1 tp -113.72 88.12 2.77 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.787 1.635 . . . . 4.0 108.891 -172.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -59.93 160.98 7.07 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.531 1.533 . . . . 2.3799999999999999 114.922 -176.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.59 -20.32 1.16 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 128.374 2.669 . . . . 4.2199999999999998 114.744 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.81 -26.09 13.89 Favored 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 119.98 1.264 . . . . 4.5300000000000002 113.629 167.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -66.16 -53.7 34.41 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.499 1.045 . . . . 1.6799999999999999 109.348 175.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 35.6 tp -50.82 -44.54 59.22 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.712 2.005 . . . . 3.2000000000000002 113.363 -176.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.405 ' HZ1' ' CD ' ' A' ' 36' ' ' GLU . 1.8 tmpt? -56.17 -34.99 66.72 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.137 1.375 . . . . 6.5700000000000003 113.012 -177.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.405 ' CD ' ' HZ1' ' A' ' 35' ' ' LYS . 1.4 tp10 -99.77 13.53 33.38 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.951 1.3 . . . . 4.3200000000000003 114.32 177.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.9 tp -96.69 -56.04 2.71 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.096 0.862 . . . . 3.8799999999999999 110.296 152.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 23.5 mt -60.46 -61.97 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 119.194 0.906 . . . . 2.02 110.161 -168.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -68.31 -11.05 58.86 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.354 1.062 . . . . 5.3499999999999996 111.982 -177.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.64 -42.12 29.58 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.741 1.616 . . . . 6.2000000000000002 111.303 173.305 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -103.28 -72.53 0.69 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.956 0.902 . . . . 6.9500000000000002 109.283 -178.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.1 mt -72.91 22.61 0.06 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 128.637 2.775 . . . . 4.71 114.84 -171.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 26.6 p -51.8 -35.7 45.03 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.637 1.975 . . . . 4.3499999999999996 115.151 -175.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -62.03 -19.59 63.04 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.301 1.84 . . . . 5.0899999999999999 114.941 -173.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -78.58 25.25 2.47 Favored Glycine 0 CA--C 1.532 1.12 0 CA-C-O 118.869 -0.962 . . . . 5.96 113.308 172.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 56.93 20.33 5.24 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 126.54 1.936 . . . . 5.46 113.004 -170.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.4 ttm -82.21 37.88 0.52 Allowed 'General case' 0 N--CA 1.471 0.609 0 O-C-N 120.521 -1.362 . . . . 2.52 113.151 -174.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.9 pttt -73.27 162.88 28.86 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.147 1.379 . . . . 5.6500000000000004 111.714 170.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -25.44 -60.8 0.07 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 128.677 2.791 . . . . 5.1500000000000004 116.39 -162.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.2 t -70.86 -10.11 58.95 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 115.029 1.492 . . . . 3.7599999999999998 115.029 -173.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.3 t -84.13 -13.83 51.91 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.593 1.157 . . . . 2.9399999999999999 112.594 168.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 12.3 mm -79.64 -32.59 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 O-C-N 120.212 -1.555 . . . . 2.6499999999999999 112.794 -173.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.18 -44.03 85.15 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.854 0.862 . . . . 3.0600000000000001 111.736 -175.421 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -72.12 -38.44 69.27 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 122.77 0.428 . . . . 2.3900000000000001 111.387 176.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.98 -49.18 78.68 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 118.679 -0.677 . . . . 3.6800000000000002 110.134 174.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.42 -44.44 89.07 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.396 1.478 . . . . 2.4900000000000002 111.753 177.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -55.93 -30.82 62.25 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.033 0.933 . . . . 4.96 112.751 172.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.65 -23.57 42.46 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.52 1.128 . . . . 2.2599999999999998 113.181 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.416 ' C ' ' HZ1' ' A' ' 61' ' ' LYS . 45.5 mt -89.19 -34.14 16.78 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 114.866 1.432 . . . . 2.96 114.866 -173.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -82.07 154.65 25.49 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 120.787 1.631 . . . . 1.74 112.582 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.416 ' HZ1' ' C ' ' A' ' 59' ' ' LEU . 0.7 OUTLIER -127.84 10.65 6.55 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.067 1.747 . . . . 4.2199999999999998 113.137 175.7 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -121.69 -33.28 3.63 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.699 1.2 . . . . 2.9100000000000001 114.151 -165.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.5 t 76.66 23.07 1.1 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.938 2.495 . . . . 4.6299999999999999 112.602 -167.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.9 p30 -76.91 -24.57 52.48 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.833 1.653 . . . . 2.3799999999999999 111.59 177.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 67.39 19.82 10.04 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 128.652 2.781 . . . . 4.75 113.784 -166.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.526 ' CD ' ' HG1' ' A' ' 28' ' ' THR 0.432 25.9 pt-20 -132.61 132.36 42.41 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 126.207 2.908 . . . . 3.3500000000000001 115.978 167.398 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 20.1 mm -74.59 107.31 5.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-N 112.072 -2.331 . . . . 2.0499999999999998 106.868 177.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -62.15 152.57 32.68 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.478 -1.237 . . . . 4.5099999999999998 108.899 172.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -58.38 -25.88 62.56 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 120.652 -1.28 . . . . 3.52 113.371 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -69.69 -34.65 74.22 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.1 0.96 . . . . 4.6900000000000004 113.403 171.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -79.22 -36.91 39.33 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.318 1.447 . . . . 1.8799999999999999 110.229 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -53.69 -35.71 61.4 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.012 1.325 . . . . 3.2000000000000002 112.201 174.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.9 m -56.03 -30.09 61.36 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 120.799 -1.188 . . . . 2.7200000000000002 113.458 170.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.5 t -71.37 -35.92 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.924 0.889 . . . . 3.3100000000000001 110.565 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -59.95 -50.29 74.32 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.75 0.82 . . . . 2.9399999999999999 111.925 176.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.03 -49.98 74.14 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.28 0.632 . . . . 3.8199999999999998 110.544 175.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.9 m -52.9 -52.65 56.88 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.302 1.441 . . . . 1.98 112.091 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 40.4 mtp -55.41 -48.27 74.65 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.388 1.075 . . . . 2.3599999999999999 112.284 178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.3 mt -66.6 -43.28 85.24 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.461 0.704 . . . . 2.5699999999999998 111.721 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 68.6 m -60.73 -33.72 73.34 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 118.293 -0.86 . . . . 2.1200000000000001 113.013 173.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 89.9 mtp -68.11 -34.97 77.38 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.627 1.103 . . . . 2.9500000000000002 112.481 172.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.47 -43.85 84.34 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 119.645 1.111 . . . . 2.1899999999999999 111.818 170.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -64.49 -24.03 67.48 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.555 0.946 . . . . 3.4300000000000002 113.555 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -67.41 -44.71 78.12 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.309 0.959 . . . . 3.0499999999999998 112.333 174.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -70.67 -46.01 63.99 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.584 1.554 . . . . 2.7799999999999998 111.393 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -51.55 -50.07 60.78 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.998 1.719 . . . . 3.1699999999999999 110.763 174.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -60.09 -29.02 68.31 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.197 1.399 . . . . 3.5600000000000001 112.906 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.8 mt -76.59 -15.47 59.84 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 118.207 -0.902 . . . . 2.23 113.12 178.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.469 ' CD ' ' HZ2' ' A' ' 92' ' ' LYS . 24.9 mm-40 -104.31 -20.32 13.8 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 114.849 1.425 . . . . 3.0099999999999998 114.849 172.154 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -94.13 -44.81 7.83 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 126.973 2.109 . . . . 3.6200000000000001 113.45 -171.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -88.34 11.8 15.78 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 124.07 0.948 . . . . 3.9300000000000002 113.198 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.469 ' HZ2' ' CD ' ' A' ' 89' ' ' GLU 0.25 4.0 ttpt . . . . . 0 C--O 1.25 1.112 0 C-N-CA 129.063 2.945 . . . . 3.98 113.1 -169.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.447 ' H3 ' ' CD ' ' B' ' 2' ' ' GLU . 35.1 ttp . . . . . 0 N--CA 1.482 1.138 0 N-CA-C 108.04 -1.096 . . . . 6.6799999999999997 108.04 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.447 ' CD ' ' H3 ' ' B' ' 1' ' ' MET . 1.5 pm0 -34.52 135.47 0.17 Allowed 'General case' 0 N--CA 1.442 -0.845 0 O-C-N 125.774 1.921 . . . . 6.8499999999999996 110.68 146.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.9 p -56.36 158.82 7.18 Favored Pre-proline 0 C--N 1.317 -0.806 0 CA-C-N 112.597 -2.092 . . . . 3.0 110.405 164.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -62.64 -20.85 72.05 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 121.784 1.656 . . . . 1.79 111.943 167.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -76.47 -50.89 12.9 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.262 0.937 . . . . 3.77 111.143 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -52.89 -45.81 67.69 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 122.327 1.06 . . . . 4.5099999999999998 110.398 169.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 13.8 ttpt -63.0 -25.12 68.24 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.594 0.961 . . . . 6.0 113.594 176.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.6 -49.8 43.9 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.938 1.245 . . . . 2.1499999999999999 110.953 177.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 6.4 mp -61.65 -39.16 90.35 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.81 0.844 . . . . 3.5499999999999998 111.263 174.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 58.9 m -59.18 -50.76 72.79 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.412 1.485 . . . . 2.3199999999999998 110.954 174.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 89.1 m -61.43 -36.31 80.01 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.218 1.407 . . . . 1.99 110.706 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 1.6 ttp -56.24 -59.22 5.26 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.608 1.163 . . . . 4.5199999999999996 111.82 167.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 78.2 t -60.89 -31.79 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 CA-C-N 120.828 1.649 . . . . 2.9300000000000002 112.684 178.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 87.4 m -72.0 -49.87 33.46 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.337 1.455 . . . . 1.8700000000000001 111.895 -176.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 7.4 p -62.8 -38.09 89.32 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 118.377 -0.82 . . . . 2.3500000000000001 109.302 169.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -58.3 -57.77 11.42 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 118.936 -0.554 . . . . 3.46 110.74 -176.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -63.2 -36.67 84.42 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.582 1.083 . . . . 2.6200000000000001 112.599 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -76.77 -24.08 52.91 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.506 1.299 . . . . 6.0700000000000003 114.506 -176.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -91.34 -37.88 12.97 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 120.024 1.284 . . . . 3.1800000000000002 112.167 166.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 34.3 t -65.09 -28.64 69.59 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.416 -1.428 . . . . 2.73 112.53 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.2 6.92 82.49 Favored Glycine 0 CA--C 1.534 1.252 0 C-N-CA 125.615 1.579 . . . . 1.3600000000000001 114.828 176.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 45.7 mmt-85 -57.57 -41.98 82.18 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 119.455 1.627 . . . . 6.6399999999999997 111.76 170.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.437 ' CD ' ' HZ3' ' B' ' 32' ' ' LYS . 31.7 tt0 -145.12 136.93 25.56 Favored 'General case' 0 C--O 1.256 1.418 0 C-N-CA 126.568 1.947 . . . . 4.2199999999999998 111.405 178.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.03 -118.45 6.56 Favored Glycine 0 C--N 1.34 0.802 0 C-N-CA 127.479 2.466 . . . . 3.4100000000000001 113.148 162.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.5 m -47.72 122.45 4.92 Favored 'General case' 0 C--O 1.246 0.878 0 C-N-CA 125.093 1.357 . . . . 4.1200000000000001 112.057 170.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 15.1 pttm -106.64 4.14 27.61 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.023 1.729 . . . . 8.2200000000000006 114.811 -178.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -102.19 -2.09 29.97 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.589 1.555 . . . . 5.1200000000000001 113.011 169.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 7.7 p -137.89 147.02 44.06 Favored 'General case' 0 C--O 1.244 0.812 0 C-N-CA 128.677 2.791 . . . . 2.2200000000000002 111.539 -173.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -96.64 107.94 20.47 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.505 0.722 . . . . 3.5699999999999998 109.936 166.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.75 145.01 55.14 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.144 -0.687 . . . . 3.21 109.144 167.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 5.9 ttt-85 -41.69 -40.54 2.0 Allowed 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.654 1.581 . . . . 4.6100000000000003 114.748 -173.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.437 ' HZ3' ' CD ' ' B' ' 23' ' ' GLU . 2.9 ptmt -61.07 -43.56 98.7 Favored 'General case' 0 CA--C 1.555 1.148 0 N-CA-C 115.247 1.573 . . . . 5.7800000000000002 115.247 173.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -65.13 -49.6 69.3 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 127.58 2.352 . . . . 1.6299999999999999 107.697 176.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -55.04 -49.37 71.76 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.103 1.361 . . . . 3.6600000000000001 111.214 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -13.91 61.95 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 114.904 1.446 . . . . 5.8499999999999996 114.904 -175.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -84.21 -40.84 17.6 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 112.475 0.546 . . . . 3.1800000000000002 112.475 169.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 tt -50.9 -57.93 7.26 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.04 1.336 . . . . 2.9199999999999999 110.498 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 24.2 mt -59.1 -48.16 87.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 123.994 0.918 . . . . 2.4100000000000001 110.038 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.43 ' HZ3' ' CD ' ' B' ' 46' ' ' GLU . 16.4 tppt? -57.67 -21.51 40.56 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.966 1.306 . . . . 4.5499999999999998 112.986 -175.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 mttm -98.74 -42.62 7.13 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 114.32 1.23 . . . . 4.2300000000000004 114.32 165.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -50.83 -48.75 59.82 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 126.348 1.859 . . . . 5.0999999999999996 112.191 -177.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 73.1 mt -125.17 120.22 30.73 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.291 1.437 . . . . 3.6699999999999999 109.213 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 44.2 t -84.21 -76.0 0.32 Allowed 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 107.733 -1.21 . . . . 4.4800000000000004 107.733 160.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 76.6 mt 52.68 -105.14 0.22 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.468 1.107 . . . . 4.1699999999999999 111.531 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -102.05 7.22 54.6 Favored Glycine 0 N--CA 1.484 1.851 0 C-N-CA 125.537 1.541 . . . . 4.1100000000000003 114.828 172.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.43 ' CD ' ' HZ3' ' B' ' 39' ' ' LYS . 0.7 OUTLIER 70.34 110.95 0.06 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 130.965 3.706 . . . . 8.5899999999999999 109.736 -170.942 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 84.6 mmm -58.73 -38.87 79.3 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.497 1.295 . . . . 2.8300000000000001 114.497 -174.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? 71.16 141.27 0.05 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.481 1.912 . . . . 4.6100000000000003 114.428 157.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -58.57 -31.47 68.03 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 119.922 -1.736 . . . . 3.73 112.043 -172.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 22.7 t -70.18 1.46 4.74 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 115.409 1.633 . . . . 4.0099999999999998 115.409 173.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 2.7 p -124.71 -41.62 2.12 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.259 0.936 . . . . 3.0699999999999998 111.959 157.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 84.6 mt -54.22 -41.91 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 124.434 1.094 . . . . 2.4199999999999999 112.696 -176.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -63.53 -34.54 78.01 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 119.429 1.013 . . . . 3.2000000000000002 111.733 -173.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -93.82 -35.13 12.88 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.878 1.671 . . . . 4.6900000000000004 113.585 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 7.1 tt -53.37 -42.4 66.83 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.702 1.201 . . . . 3.7599999999999998 110.146 169.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.7 -48.42 72.48 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.639 1.576 . . . . 2.9199999999999999 111.44 171.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 13.4 mttm -59.73 -37.32 78.63 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 119.527 1.058 . . . . 7.8799999999999999 111.641 173.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 5.0 t -65.66 -22.62 66.66 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.018 0.927 . . . . 2.3700000000000001 113.154 175.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 29.0 mt -77.64 -42.96 32.98 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.981 0.913 . . . . 3.3399999999999999 110.845 168.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -76.2 78.57 3.0 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.886 2.474 . . . . 1.8100000000000001 114.527 -162.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 65.6 mmtt -61.15 -13.1 15.21 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 115.505 1.669 . . . . 4.4699999999999998 115.505 -170.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -120.05 2.62 10.96 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.862 1.43 . . . . 2.9700000000000002 114.862 176.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 23.0 t 62.96 18.94 11.28 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.702 1.371 . . . . 3.4300000000000002 114.702 172.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 47.5 p-10 -79.7 -11.29 59.86 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.924 1.689 . . . . 2.1400000000000001 112.337 -177.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 67.43 16.98 10.09 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 130.565 3.546 . . . . 5.3099999999999996 113.613 -175.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -111.51 141.5 45.0 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.653 1.981 . . . . 2.27 107.846 165.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 50.4 mm -108.33 102.59 14.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 O-C-N 120.152 -1.592 . . . . 2.23 107.791 172.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . 0.474 ' HB3' ' H ' ' B' ' 70' ' ' LYS . 88.9 m-20 -47.38 153.78 0.48 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.074 0.549 . . . . 3.3300000000000001 110.661 168.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -47.47 -25.8 1.19 Allowed 'General case' 0 CA--C 1.555 1.138 0 CA-C-O 121.839 0.828 . . . . 3.6699999999999999 112.75 158.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.474 ' H ' ' HB3' ' B' ' 68' ' ' ASP . 6.7 ttpm? -86.85 -25.31 24.58 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 129.108 2.963 . . . . 4.9199999999999999 114.952 176.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -80.81 -43.71 19.64 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 119.935 1.243 . . . . 1.8200000000000001 108.57 169.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -50.65 -31.32 15.87 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 129.812 3.245 . . . . 3.02 115.659 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 30.9 t -53.23 -38.38 62.9 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.98 -1.075 . . . . 2.3700000000000001 112.124 171.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 57.4 t -67.24 -34.13 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 O-C-N 121.378 -0.826 . . . . 2.3599999999999999 111.294 -177.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -59.76 -62.74 1.65 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 118.35 0.523 . . . . 2.7999999999999998 110.892 175.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 52.4 mt -62.31 -30.53 71.21 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.202 0.601 . . . . 2.8199999999999998 112.327 -176.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 91.1 m -58.32 -47.8 82.57 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.741 0.816 . . . . 1.72 111.029 172.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 79.6 mtm -62.99 -38.21 90.26 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.017 0.826 . . . . 2.2200000000000002 112.803 177.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 62.9 mt -61.28 -46.09 91.77 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.422 0.555 . . . . 2.5299999999999998 110.503 173.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 97.1 m -60.84 -38.47 85.63 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.692 0.797 . . . . 3.2400000000000002 112.858 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 28.1 mmt -60.22 -41.41 93.02 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 118.854 0.752 . . . . 4.3399999999999999 111.941 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.91 -38.37 79.55 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.409 0.55 . . . . 1.8700000000000001 112.054 177.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -71.84 -24.28 61.67 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.025 1.12 . . . . 4.6200000000000001 114.025 177.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -65.05 -46.13 82.51 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.509 0.724 . . . . 3.8300000000000001 112.015 170.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.33 -44.49 91.38 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.58 1.552 . . . . 3.29 112.149 177.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -50.39 -48.96 55.71 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.025 1.73 . . . . 3.3599999999999999 111.734 177.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -64.83 -21.04 66.71 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.336 1.454 . . . . 3.8799999999999999 113.653 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 44.3 mt -84.24 -20.57 32.02 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.199 1.0 . . . . 2.2599999999999998 112.057 173.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -97.41 -10.15 26.02 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 115.074 1.509 . . . . 3.7599999999999998 115.074 174.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -88.36 -33.44 17.95 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.34 1.456 . . . . 2.8900000000000001 113.652 -177.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -80.05 -6.59 57.89 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 115.086 1.513 . . . . 6.3799999999999999 115.086 -174.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 114.902 -2.475 . . . . 5.0499999999999998 117.469 -158.189 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 108.075 -1.083 . . . . 6.2300000000000004 108.075 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -109.32 143.15 39.22 Favored 'General case' 0 N--CA 1.432 -1.334 0 N-CA-C 106.982 -1.488 . . . . 4.0999999999999996 106.982 -159.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 70.6 p -49.03 149.38 3.37 Favored Pre-proline 0 N--CA 1.47 0.537 0 C-N-CA 125.989 1.716 . . . . 2.23 111.467 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -64.68 -23.13 63.73 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.25 1.966 . . . . 1.45 111.939 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.29 -44.25 46.69 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.858 1.263 . . . . 3.3799999999999999 111.865 174.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -53.24 -53.05 56.37 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.998 1.272 . . . . 4.7000000000000002 110.083 174.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 33.9 mtmt -61.98 -21.11 64.56 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 113.186 0.81 . . . . 5.2999999999999998 113.186 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.54 -45.24 31.51 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.82 0.848 . . . . 1.95 111.369 170.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.6 mt -58.23 -47.28 84.02 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.474 1.033 . . . . 2.5899999999999999 110.832 173.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -66.81 -37.49 84.62 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 116.348 -1.787 . . . . 3.5600000000000001 112.462 175.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 42.1 m -55.65 -42.97 75.79 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 121.415 1.916 . . . . 2.0899999999999999 110.875 170.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 57.5 mtp -63.88 -47.03 82.27 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.996 1.319 . . . . 4.0599999999999996 112.033 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.3 t -65.69 -31.65 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 O-C-N 121.075 -1.016 . . . . 3.1899999999999999 111.531 175.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 93.3 m -67.42 -56.58 9.07 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.565 1.146 . . . . 2.0499999999999998 110.617 -179.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.0 p -57.97 -42.54 85.26 Favored 'General case' 0 CA--C 1.512 -0.512 0 O-C-N 123.737 0.648 . . . . 2.7999999999999998 109.461 178.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -67.74 -55.29 13.67 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.779 0.674 . . . . 4.04 111.412 -176.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -65.48 -29.7 70.39 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.382 -0.824 . . . . 2.6899999999999999 112.353 -177.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp -70.76 -57.08 5.02 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.33 0.968 . . . . 6.5499999999999998 112.493 171.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 -67.71 -23.25 65.25 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.623 1.101 . . . . 3.4399999999999999 113.135 -178.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.3 t -62.99 -19.77 64.65 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.402 1.26 . . . . 2.7400000000000002 114.402 172.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.04 33.55 6.35 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 126.709 2.099 . . . . 1.45 113.428 171.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -114.05 28.92 8.39 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.821 1.648 . . . . 6.9500000000000002 112.57 173.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.472 ' HG2' ' H ' ' A' ' 24' ' ' GLY . 4.1 tt0 126.8 -159.83 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.091 1 C-N-CA 132.666 4.387 . . . . 4.3399999999999999 110.26 171.968 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.472 ' H ' ' HG2' ' A' ' 23' ' ' GLU . . . 51.26 -141.24 21.84 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 124.876 1.227 . . . . 2.8199999999999998 111.622 -170.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.8 t -86.86 179.7 6.68 Favored 'General case' 0 C--O 1.249 1.04 0 CA-C-O 122.203 1.001 . . . . 2.9500000000000002 111.786 158.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -104.44 140.88 37.31 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.434 2.294 . . . . 5.54 108.705 166.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 9.7 tp 90.72 -18.26 0.17 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 131.063 3.745 . . . . 4.5499999999999998 110.98 -159.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.6 p -112.45 152.94 28.12 Favored 'General case' 0 C--O 1.246 0.898 0 C-N-CA 125.745 1.618 . . . . 2.2799999999999998 114.957 177.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.9 mt -107.58 105.83 15.91 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.177 1.391 . . . . 2.5099999999999998 111.687 163.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.9 t -62.0 160.98 11.42 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.78 1.232 . . . . 2.5899999999999999 111.227 163.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.4 ttm-85 -46.56 -21.88 0.23 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 126.465 1.906 . . . . 4.2199999999999998 114.906 -178.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.419 ' HZ2' ' CD ' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -95.88 -38.65 10.18 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.126 1.37 . . . . 4.7800000000000002 112.854 -178.835 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -61.11 -46.46 90.51 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.693 1.197 . . . . 1.4399999999999999 109.559 172.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.7 tp -66.38 -49.43 66.9 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.53 0.732 . . . . 2.98 111.398 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.1 ttmt -61.66 -37.17 83.06 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 113.15 0.796 . . . . 4.25 113.15 -177.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.461 ' CD ' ' HZ1' ' A' ' 40' ' ' LYS . 5.1 tp10 -57.63 -58.53 7.94 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.764 0.825 . . . . 3.75 112.317 164.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.4 tp -53.29 -54.67 33.01 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.744 1.217 . . . . 3.3199999999999998 112.909 -174.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.3 mt -60.17 -33.65 54.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 118.332 0.515 . . . . 2.3100000000000001 110.896 -174.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.484 ' HZ2' ' CD ' ' A' ' 46' ' ' GLU . 23.9 mmmt -67.52 -12.27 59.94 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 121.096 -1.002 . . . . 4.0599999999999996 113.138 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.461 ' HZ1' ' CD ' ' A' ' 36' ' ' GLU . 59.3 mmtt -92.66 -19.65 21.64 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.12 1.368 . . . . 3.3599999999999999 111.757 173.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -91.69 -93.12 0.14 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.632 1.973 . . . . 4.3600000000000003 106.589 178.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -75.52 24.99 0.11 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 128.901 2.88 . . . . 3.0800000000000001 114.544 -161.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 18.4 t -54.81 -25.68 29.83 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.64 -1.287 . . . . 3.6000000000000001 113.237 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.11 -21.43 66.35 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.83 1.652 . . . . 5.04 115.332 178.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -108.51 -28.28 4.64 Favored Glycine 0 N--CA 1.476 1.305 0 C-N-CA 124.752 1.168 . . . . 4.71 112.236 163.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.484 ' CD ' ' HZ2' ' A' ' 39' ' ' LYS . 0.2 OUTLIER 83.72 139.59 0.06 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 129.411 3.085 . . . . 7.9299999999999997 111.644 170.001 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.6 mmt -109.07 105.51 15.03 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.51 1.524 . . . . 3.3599999999999999 111.151 -173.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -89.91 164.18 14.68 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.146 1.378 . . . . 5.6100000000000003 110.891 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.412 ' CD ' ' H ' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -50.25 -50.06 51.22 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 120.997 -1.064 . . . . 5.9100000000000001 111.41 167.416 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.1 t -72.23 41.13 0.08 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.438 1.495 . . . . 4.04 113.136 168.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.0 m -160.29 -41.42 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.884 1.674 . . . . 2.96 112.66 177.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 33.8 mt -72.3 -38.73 62.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 119.367 0.985 . . . . 3.2599999999999998 112.086 -174.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -80.56 -23.1 40.18 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.757 0.823 . . . . 3.8100000000000001 112.016 -175.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -78.62 -38.99 38.51 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.283 0.633 . . . . 2.7000000000000002 111.673 165.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.79 -44.97 86.65 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.601 -0.714 . . . . 3.77 109.509 169.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.2 ttt -58.94 -41.97 88.65 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.306 0.957 . . . . 2.3500000000000001 112.039 173.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.98 -24.63 67.79 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 119.363 0.983 . . . . 5.1200000000000001 112.77 172.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 t -74.06 -33.18 63.61 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 120.48 -1.388 . . . . 3.0699999999999998 112.37 170.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.7 mp -80.75 -51.75 8.3 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 125.111 1.365 . . . . 3.8199999999999998 112.816 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -72.69 135.55 45.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.753 0.787 . . . . 1.72 111.886 -178.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.51 -40.45 5.11 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.568 1.547 . . . . 4.4800000000000004 111.939 178.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 43.4 p-10 -92.93 -11.16 34.06 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 116.389 1.996 . . . . 3.1299999999999999 116.389 -169.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.7 t 76.02 29.96 0.75 Allowed 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.881 1.672 . . . . 3.7999999999999998 113.556 174.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.9 p-10 -90.31 -14.28 33.51 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 126.578 1.951 . . . . 2.3500000000000001 112.691 -176.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 76.27 13.08 2.61 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 128.71 2.804 . . . . 4.4900000000000002 115.674 -174.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -133.91 132.08 39.84 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.557 2.343 . . . . 2.8199999999999998 109.355 -176.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 18.1 mm -98.99 107.84 21.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 120.572 -1.33 . . . . 2.0099999999999998 109.979 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -63.59 161.53 14.55 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.97 0.805 . . . . 3.8100000000000001 112.782 170.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -48.78 -37.39 18.98 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 122.519 1.152 . . . . 3.9399999999999999 112.21 169.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.17 -22.84 48.06 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 116.181 1.919 . . . . 7.5800000000000001 116.181 174.344 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -78.91 -51.12 10.11 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.398 1.454 . . . . 1.8799999999999999 109.07 170.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -50.25 -22.58 1.81 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 128.055 2.542 . . . . 3.0600000000000001 113.418 175.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.3 m -53.59 -32.51 51.34 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.58 -1.325 . . . . 2.9399999999999999 113.309 170.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 p -75.46 -25.79 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 122.967 0.507 . . . . 3.0699999999999998 111.856 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -63.36 -60.65 3.1 Favored 'General case' 0 C--N 1.343 0.299 0 CA-C-O 118.426 -0.797 . . . . 3.0299999999999998 109.968 172.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -51.93 -46.65 64.76 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.999 0.92 . . . . 4.1500000000000004 111.328 -178.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 56.3 m -55.06 -58.81 6.12 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.906 1.282 . . . . 2.1400000000000001 112.239 176.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 61.0 ttp -59.07 -43.82 91.81 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.633 0.773 . . . . 3.5 111.217 -178.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.22 -46.59 80.01 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.535 1.134 . . . . 3.8100000000000001 111.647 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 67.8 m -63.92 -40.92 97.58 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.157 0.583 . . . . 3.46 112.307 176.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 59.5 mtp -62.88 -39.33 94.12 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.631 0.65 . . . . 2.7599999999999998 112.029 172.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.01 -37.04 86.31 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.373 0.669 . . . . 2.4900000000000002 112.554 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -64.03 -28.03 69.52 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.847 1.054 . . . . 3.7200000000000002 113.847 173.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -65.86 -40.5 91.73 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 120.167 1.349 . . . . 2.8999999999999999 111.971 172.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -72.7 -39.52 66.92 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.687 0.795 . . . . 3.2999999999999998 111.697 178.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -52.78 -46.16 67.46 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.037 1.335 . . . . 5.3799999999999999 111.298 172.081 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -62.97 -27.25 69.27 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.488 1.515 . . . . 4.1200000000000001 113.228 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 37.5 mt -80.96 -21.43 40.38 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.543 1.137 . . . . 3.4100000000000001 112.452 176.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.499 ' CD ' ' HZ2' ' A' ' 92' ' ' LYS . 67.3 mm-40 -91.12 -10.24 42.66 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 115.142 1.534 . . . . 3.77 115.142 172.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -83.3 -44.18 15.2 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.737 1.615 . . . . 3.7799999999999998 112.719 169.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -81.72 54.53 2.43 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 126.916 2.086 . . . . 4.5700000000000003 112.348 -167.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.499 ' HZ2' ' CD ' ' A' ' 89' ' ' GLU . 45.9 mmtt . . . . . 0 C--O 1.253 1.272 0 C-N-CA 128.297 2.639 . . . . 6.3399999999999999 115.024 175.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.488 ' HA ' ' OE1' ' B' ' 2' ' ' GLU . 65.3 mtt . . . . . 0 N--CA 1.476 0.826 0 N-CA-C 108.703 -0.851 . . . . 9.1500000000000004 108.703 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.488 ' OE1' ' HA ' ' B' ' 1' ' ' MET . 12.1 mp0 -107.11 -125.59 0.24 Allowed 'General case' 0 CA--C 1.538 0.499 0 O-C-N 125.219 1.574 . . . . 4.8200000000000003 109.432 -151.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 6.4 p -85.2 170.1 14.29 Favored Pre-proline 0 C--N 1.322 -0.593 0 C-N-CA 130.188 3.395 . . . . 3.5600000000000001 110.26 -169.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -69.83 -33.14 16.93 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 121.215 1.277 . . . . 2.1699999999999999 112.907 -172.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.01 -39.88 68.88 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.085 0.857 . . . . 3.6299999999999999 112.222 -172.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.93 -33.78 67.34 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.595 1.089 . . . . 4.1100000000000003 112.279 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -68.51 -32.28 72.13 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 120.678 -1.264 . . . . 5.5300000000000002 112.522 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -69.04 -51.58 37.55 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.421 1.088 . . . . 1.79 110.201 175.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 57.5 mt -54.28 -46.19 72.66 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.584 1.154 . . . . 3.0299999999999998 111.769 174.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 64.4 m -56.65 -52.39 65.08 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.04 0.936 . . . . 2.1200000000000001 111.181 172.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 51.7 m -55.49 -44.23 76.33 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.659 1.184 . . . . 2.1000000000000001 111.471 -175.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 9.7 mtt -57.68 -51.77 68.18 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.062 0.945 . . . . 4.2000000000000002 111.731 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 76.3 t -64.29 -43.59 97.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 124.204 1.001 . . . . 3.0499999999999998 112.067 178.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 31.3 m -55.6 -58.04 9.44 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.787 1.635 . . . . 2.52 110.248 178.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.48 -37.85 74.29 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 117.406 -1.283 . . . . 3.3399999999999999 109.571 -174.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -57.34 -48.0 80.11 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 118.945 0.793 . . . . 3.6000000000000001 111.003 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.12 -31.97 71.92 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 118.684 0.674 . . . . 2.8300000000000001 111.337 178.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 39.0 tttm -69.74 -32.67 71.34 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.304 1.224 . . . . 5.5300000000000002 114.304 173.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.405 ' HH ' ' CB ' ' B' ' 40' ' ' LYS . 69.5 m-85 -71.52 -31.55 67.19 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.763 1.225 . . . . 4.8499999999999996 111.569 166.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 40.3 t -70.82 -35.16 72.37 Favored 'General case' 0 C--O 1.244 0.785 0 C-N-CA 125.793 1.637 . . . . 2.2599999999999998 114.86 -176.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.17 7.41 67.47 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 125.375 1.464 . . . . 2.2000000000000002 113.774 167.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.43 -14.9 59.6 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.224 1.512 . . . . 4.5899999999999999 113.496 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.507 ' HG2' ' H ' ' B' ' 24' ' ' GLY 0.281 3.5 tm-20 164.0 -167.46 0.01 OUTLIER 'General case' 0 CA--C 1.564 1.502 0 C-N-CA 130.666 3.586 . . . . 3.6600000000000001 109.712 -176.868 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . 0.507 ' H ' ' HG2' ' B' ' 23' ' ' GLU . . . 58.47 -149.07 36.8 Favored Glycine 0 N--CA 1.467 0.751 0 C-N-CA 126.17 1.843 . . . . 3.8900000000000001 112.316 -174.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 41.4 t -66.92 154.73 40.32 Favored 'General case' 0 C--O 1.249 1.071 0 O-C-N 121.27 -1.135 . . . . 3.5600000000000001 110.274 153.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.0 1.09 37.19 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.415 1.486 . . . . 7.0499999999999998 112.67 177.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 57.8 tp -92.61 -30.11 15.78 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.365 1.466 . . . . 4.5800000000000001 112.239 174.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' THR . . . . . 0.423 ' HG1' ' CD ' ' B' ' 66' ' ' GLU . 16.6 p -128.32 167.38 17.02 Favored 'General case' 0 C--O 1.252 1.202 0 C-N-CA 128.703 2.801 . . . . 2.0499999999999998 113.679 -163.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 10.5 mt -101.35 114.03 27.64 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.07 1.748 . . . . 2.5 110.972 167.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 2.0 p -69.58 165.58 20.79 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.138 -0.976 . . . . 3.6899999999999999 112.935 166.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -41.8 -30.4 0.25 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.905 1.282 . . . . 4.5800000000000001 114.271 169.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.1 -42.96 10.8 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 119.92 -1.738 . . . . 7.2400000000000002 113.082 178.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -52.65 -44.17 65.96 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.621 0.769 . . . . 1.8899999999999999 110.663 167.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.93 -42.99 97.22 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.427 1.891 . . . . 3.6000000000000001 112.404 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -56.45 -40.94 75.64 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 120.274 -1.516 . . . . 3.5499999999999998 112.457 170.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -68.28 -43.53 77.53 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 117.974 -1.012 . . . . 3.1400000000000001 112.127 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.0 tp -51.41 -61.22 2.38 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 125.294 1.438 . . . . 3.1099999999999999 108.665 173.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 24.5 mt -54.3 -45.23 67.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 CA-C-N 118.739 0.7 . . . . 2.1699999999999999 109.85 -173.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -72.65 -31.72 65.32 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.223 0.609 . . . . 5.8499999999999996 111.751 -172.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . 0.405 ' CB ' ' HH ' ' B' ' 19' ' ' TYR . 36.6 mttp -89.25 -28.16 20.11 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 120.624 -1.298 . . . . 4.21 113.696 178.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -65.83 -61.42 2.07 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.768 1.627 . . . . 5.7199999999999998 110.654 166.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.49 101.46 5.63 Favored 'General case' 0 C--N 1.342 0.253 0 C-N-CA 124.601 1.16 . . . . 3.1299999999999999 108.454 -178.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 5.2 t -70.4 30.82 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 114.557 1.318 . . . . 4.7199999999999998 114.557 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 70.1 mt -118.25 -15.53 9.76 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.158 1.783 . . . . 4.2000000000000002 112.959 -163.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 104.24 -118.84 6.08 Favored Glycine 0 C--N 1.34 0.761 0 C-N-CA 124.454 1.026 . . . . 5.3899999999999997 112.62 177.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -92.5 111.3 22.84 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 113.328 0.862 . . . . 8.4299999999999997 113.328 -164.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 84.0 mmm -65.5 -28.52 69.25 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.823 0.82 . . . . 4.1900000000000004 112.07 155.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 tptt 72.3 144.09 0.07 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.875 2.87 . . . . 7.1900000000000004 111.303 -174.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 20.4 tp10 -49.61 -43.84 46.8 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.268 1.027 . . . . 4.5 113.55 -168.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 24.8 t -66.95 -7.95 25.98 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.316 1.598 . . . . 3.7400000000000002 115.316 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 12.3 t -105.5 -6.49 19.37 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 120.072 1.306 . . . . 2.8500000000000001 113.228 167.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 45.0 mm -73.55 -44.4 53.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 CA-C-N 120.172 1.351 . . . . 2.8900000000000001 110.718 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -71.13 -29.88 65.79 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.812 0.845 . . . . 2.98 112.632 -178.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.428 ' CG ' ' HZ1' ' B' ' 57' ' ' LYS . 11.3 t70 -71.81 -44.58 63.69 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.847 1.203 . . . . 3.6899999999999999 111.396 167.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.78 -49.61 70.5 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.832 0.742 . . . . 3.29 109.266 176.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 14.8 tpt -54.01 -51.32 64.35 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.794 1.638 . . . . 2.6299999999999999 112.806 173.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . 0.428 ' HZ1' ' CG ' ' B' ' 54' ' ' ASP . 0.9 OUTLIER -55.8 -39.33 71.17 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.571 1.548 . . . . 5.9800000000000004 112.195 173.931 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 30.5 m -74.48 -22.72 58.94 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.466 1.506 . . . . 2.5 110.664 -177.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 9.1 mt -83.17 -56.68 3.64 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.317 0.962 . . . . 2.75 113.212 169.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -70.82 139.57 50.96 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.877 0.695 . . . . 1.6599999999999999 112.877 -165.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 37.6 mmtm -135.02 -9.72 2.3 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.623 1.569 . . . . 4.8899999999999997 114.35 -175.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.23 -20.83 50.97 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.913 0.779 . . . . 3.04 110.884 164.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 22.7 t 72.48 41.13 0.6 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.563 1.945 . . . . 3.1800000000000002 110.82 -178.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -114.43 -125.52 0.28 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.421 1.488 . . . . 3.2400000000000002 108.54 -167.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -144.04 -2.52 0.91 Allowed 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 116.753 2.131 . . . . 4.4699999999999998 116.753 165.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . 0.423 ' CD ' ' HG1' ' B' ' 28' ' ' THR . 25.4 mt-10 -113.66 141.82 46.76 Favored 'General case' 0 C--O 1.244 0.812 0 C-N-CA 125.853 1.661 . . . . 2.8500000000000001 111.291 177.027 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 45.1 mm -89.9 111.17 22.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 127.948 2.499 . . . . 2.2999999999999998 109.846 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.94 159.27 33.01 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 128.092 2.557 . . . . 2.54 111.278 162.061 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -54.08 -35.39 62.03 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.256 1.206 . . . . 3.3599999999999999 114.256 -176.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -71.85 -36.38 70.12 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.71 -1.244 . . . . 4.2699999999999996 111.42 177.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -64.11 -51.78 62.32 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 124.344 1.058 . . . . 1.6799999999999999 109.259 171.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -52.05 -43.4 63.78 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.531 1.532 . . . . 3.3500000000000001 113.309 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 35.8 m -62.91 -21.08 65.77 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.354 -0.841 . . . . 3.5299999999999998 113.098 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 21.2 t -64.24 -40.11 87.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 CA-C-N 119.496 1.044 . . . . 2.6499999999999999 110.661 170.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -59.19 -55.43 35.02 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 118.753 0.706 . . . . 2.9100000000000001 110.665 177.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 66.9 mt -57.77 -38.28 75.16 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.581 1.152 . . . . 2.2999999999999998 110.781 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 99.8 m -61.91 -50.06 73.71 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.179 0.992 . . . . 1.8300000000000001 112.303 173.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.9 mtm -64.57 -37.39 87.4 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 119.559 1.072 . . . . 2.46 112.18 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -60.93 -52.63 64.23 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.63 0.772 . . . . 3.8199999999999998 111.953 172.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 93.8 m -63.86 -35.89 82.14 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.389 0.514 . . . . 3.1200000000000001 112.389 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 49.2 mmm -60.73 -42.92 98.27 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.721 0.808 . . . . 3.27 112.834 170.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.6 -33.64 71.26 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.518 1.053 . . . . 1.9099999999999999 112.003 176.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -69.82 -23.67 63.35 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.022 1.119 . . . . 3.4500000000000002 114.022 175.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -55.29 -49.6 71.71 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 120.561 1.528 . . . . 3.1800000000000002 111.056 166.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.16 -36.44 58.72 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.103 1.761 . . . . 3.04 112.196 -174.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -54.82 -47.14 74.44 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.217 1.407 . . . . 3.3900000000000001 111.281 166.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -67.18 -25.82 66.33 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.474 1.11 . . . . 3.1800000000000002 112.941 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 71.6 mt -78.2 -26.83 47.71 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 118.112 -0.947 . . . . 2.2799999999999998 112.824 174.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -97.39 10.94 38.34 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.561 1.544 . . . . 3.71 114.263 174.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -93.56 -54.36 3.69 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.739 1.215 . . . . 3.1200000000000001 112.047 162.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -82.66 37.73 0.54 Allowed 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 125.866 1.666 . . . . 3.1400000000000001 112.721 -176.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.26 1.607 0 N-CA-C 118.896 2.924 . . . . 5.5700000000000003 118.896 -145.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.2 mtt . . . . . 0 N--CA 1.478 0.933 0 N-CA-C 107.918 -1.141 . . . . 8.3499999999999996 107.918 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -139.02 139.3 37.8 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 105.787 -1.931 . . . . 4.0 105.787 -165.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 79.4 p -60.93 162.7 11.68 Favored Pre-proline 0 C--N 1.325 -0.483 0 C-N-CA 126.077 1.751 . . . . 2.3799999999999999 113.869 -170.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -61.8 -18.52 61.19 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.421 2.081 . . . . 1.5 112.504 164.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.12 -45.37 34.05 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.508 1.049 . . . . 3.1800000000000002 110.562 175.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -61.32 -37.9 84.93 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.905 -1.122 . . . . 4.5599999999999996 111.148 172.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -69.79 -31.54 69.52 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.019 -1.05 . . . . 4.0899999999999999 112.971 172.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.67 -48.52 66.41 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.743 1.217 . . . . 1.8700000000000001 111.603 173.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 74.6 mt -57.85 -47.38 82.86 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.89 1.276 . . . . 2.48 110.66 172.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 89.2 m -54.13 -48.48 70.76 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.113 1.365 . . . . 2.7200000000000002 111.8 172.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 92.1 m -66.55 -35.82 81.16 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.968 1.307 . . . . 2.0499999999999998 111.553 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -45.69 66.94 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.717 0.807 . . . . 5.1500000000000004 111.699 176.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.2 p -65.31 -29.72 48.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 119.355 0.98 . . . . 3.21 112.234 171.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 55.3 m -63.83 -54.77 29.88 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 117.654 -1.165 . . . . 1.9199999999999999 111.074 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.6 p -60.01 -36.64 77.66 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 119.525 1.057 . . . . 2.5699999999999998 110.481 174.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -68.06 -54.55 17.47 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 119.379 -0.928 . . . . 3.21 110.928 -175.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.43 ' CD2' ' HZ3' ' A' ' 26' ' ' LYS . 4.9 t60 -64.67 -29.44 70.44 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.921 0.888 . . . . 2.7400000000000002 113.276 -179.139 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 58.4 tttt -62.95 -70.84 0.18 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 127.537 2.335 . . . . 5.7599999999999998 112.579 166.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -65.68 -24.85 67.11 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.136 -0.978 . . . . 3.3700000000000001 112.099 -172.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.449 ' HG ' ' C ' ' A' ' 27' ' ' LEU . 46.7 t -60.21 -26.68 66.58 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 114.9 1.444 . . . . 2.4199999999999999 114.9 170.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -95.37 5.86 67.99 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 125.802 1.668 . . . . 1.3600000000000001 114.083 175.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.43 -44.74 92.83 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.96 1.38 . . . . 4.5300000000000002 111.462 172.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -146.69 161.05 41.4 Favored 'General case' 0 C--O 1.253 1.28 0 CA-C-O 123.49 1.614 . . . . 4.6799999999999997 113.24 176.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.18 -128.57 47.73 Favored Glycine 0 C--N 1.34 0.77 0 C-N-CA 126.944 2.211 . . . . 2.3199999999999998 111.733 164.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.0 m -52.72 125.27 16.17 Favored 'General case' 0 C--O 1.245 0.822 0 C-N-CA 123.189 0.595 . . . . 3.1600000000000001 110.33 166.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.43 ' HZ3' ' CD2' ' A' ' 17' ' ' HIS . 3.6 tmtm? -83.33 -2.88 56.79 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.223 1.009 . . . . 5.9800000000000004 113.328 176.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.449 ' C ' ' HG ' ' A' ' 20' ' ' SER . 9.8 mp -89.88 -34.13 16.2 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.878 2.071 . . . . 5.0800000000000001 111.691 174.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.413 ' HG1' ' CD ' ' A' ' 66' ' ' GLU . 0.9 OUTLIER -126.98 163.52 23.51 Favored 'General case' 0 C--O 1.254 1.313 0 C-N-CA 127.661 2.384 . . . . 2.3500000000000001 114.874 -167.042 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -109.35 105.63 15.1 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 127.582 2.353 . . . . 3.9199999999999999 112.097 -171.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.7 t -84.42 164.45 18.87 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.789 2.036 . . . . 2.4500000000000002 112.057 175.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.1 tmm_? -60.96 -22.15 64.16 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 116.509 2.04 . . . . 6.0499999999999998 116.509 -161.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.62 -41.27 16.54 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 120.635 -1.291 . . . . 6.71 111.901 166.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -54.46 -49.97 68.81 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 120.302 1.41 . . . . 1.4299999999999999 110.532 175.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -65.64 -45.84 81.5 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.956 1.703 . . . . 3.9399999999999999 112.452 -177.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.255 1.1 ptmt -73.0 -32.69 65.31 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 118.111 -1.436 . . . . 4.3499999999999996 112.67 176.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -61.9 -44.34 96.99 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.434 1.47 . . . . 3.5299999999999998 112.97 171.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.9 tp -51.64 -64.96 0.65 Allowed 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 126.292 1.837 . . . . 3.1400000000000001 110.161 170.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 84.6 mt -55.44 -45.56 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-O 118.349 -0.834 . . . . 2.1000000000000001 111.641 -176.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.418 ' HZ1' ' CD ' ' A' ' 49' ' ' GLU . 24.2 mmmt -55.32 -28.74 55.68 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 118.69 0.677 . . . . 4.3600000000000003 112.69 -174.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -97.52 -34.42 11.0 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.472 1.909 . . . . 4.1900000000000004 113.286 -173.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -85.28 -50.43 7.36 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.357 0.663 . . . . 5.3399999999999999 111.616 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.9 mp -92.76 54.89 2.31 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.678 1.591 . . . . 4.4299999999999997 109.518 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.5 t -79.67 35.92 0.31 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.506 1.122 . . . . 3.7400000000000002 113.586 -166.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -91.9 -8.59 45.93 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 116.76 2.133 . . . . 4.8300000000000001 116.76 -161.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 97.86 1.71 58.55 Favored Glycine 0 N--CA 1.474 1.202 0 CA-C-N 119.179 0.899 . . . . 3.5299999999999998 114.437 -176.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.7 -152.4 0.29 Allowed 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 107.941 -1.133 . . . . 6.6500000000000004 107.941 143.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.88 39.48 20.35 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 124.165 1.936 . . . . 2.7000000000000002 110.736 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -74.52 141.71 44.83 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 112.396 -2.184 . . . . 5.3300000000000001 109.586 174.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.418 ' CD ' ' HZ1' ' A' ' 39' ' ' LYS . 2.0 mm-40 -52.1 -39.92 60.51 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.799 1.778 . . . . 4.46 115.799 -148.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.1 p -78.4 -28.87 46.95 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 115.337 1.606 . . . . 3.54 115.337 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.3 t -56.25 -30.77 62.85 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.999 1.32 . . . . 2.3599999999999999 110.99 172.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 3.1 mt -74.68 -25.56 19.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 C-N-CA 124.141 0.976 . . . . 2.8599999999999999 112.497 -176.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -86.81 -30.33 21.59 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.627 0.649 . . . . 3.6099999999999999 111.642 178.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -71.82 -34.51 69.38 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.193 0.906 . . . . 2.8199999999999998 111.621 167.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 53.8 tp -61.28 -52.59 64.1 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 117.34 -1.314 . . . . 2.8700000000000001 110.15 165.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.2 ttt -53.33 -48.87 68.1 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 121.421 1.919 . . . . 2.3599999999999999 112.112 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.69 -29.83 8.14 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.779 1.632 . . . . 4.2699999999999996 113.361 174.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 50.2 m -93.49 -29.01 15.76 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.278 1.831 . . . . 3.3799999999999999 112.486 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.4 mt -78.66 -30.45 46.25 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.253 1.021 . . . . 3.1699999999999999 112.596 175.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -73.02 70.63 1.05 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.394 1.477 . . . . 1.3799999999999999 110.769 175.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.3 ttmp? -50.97 -29.61 12.74 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 115.602 1.705 . . . . 5.0599999999999996 115.602 -162.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -95.15 -18.98 20.47 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 115.495 1.665 . . . . 3.4900000000000002 115.495 175.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 59.96 108.94 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.363 1.465 . . . . 3.8500000000000001 112.221 -153.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.4 p30 -140.0 -78.73 0.31 Allowed 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.962 -1.086 . . . . 2.8399999999999999 110.405 173.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -166.81 -28.79 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 130.615 3.566 . . . . 6.5099999999999998 112.218 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.413 ' CD ' ' HG1' ' A' ' 28' ' ' THR . 15.5 pt-20 -154.4 166.79 32.13 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.564 1.145 . . . . 3.21 112.81 -173.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 6.9 mm -98.07 108.78 22.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 125.275 1.43 . . . . 2.2200000000000002 112.376 -170.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -74.67 159.13 32.47 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.814 1.646 . . . . 2.7000000000000002 111.665 165.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -46.38 -45.99 18.17 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.124 -1.61 . . . . 3.9900000000000002 113.281 170.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.4 pttm -72.53 -6.59 45.01 Favored 'General case' 0 CA--C 1.55 0.964 0 O-C-N 121.329 -0.857 . . . . 3.7999999999999998 113.282 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -91.42 -61.26 1.69 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.359 1.464 . . . . 1.5900000000000001 109.34 163.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -54.84 -22.96 16.23 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 128.019 2.528 . . . . 4.3099999999999996 115.497 -175.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.45 -30.68 20.51 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 124.986 1.315 . . . . 2.8199999999999998 112.484 167.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.2 p -69.16 -36.26 72.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 119.083 0.856 . . . . 3.4199999999999999 112.184 176.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -60.98 -48.14 83.2 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 118.966 0.803 . . . . 3.5899999999999999 111.317 174.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 73.0 mt -63.21 -36.13 82.61 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.78 0.832 . . . . 3.0099999999999998 111.573 177.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 57.8 m -66.2 -47.12 74.93 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.573 1.149 . . . . 1.71 111.228 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.9 mtp -57.41 -43.35 83.7 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.826 1.25 . . . . 2.8799999999999999 111.705 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 72.8 mt -67.8 -45.02 75.95 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.595 0.758 . . . . 2.5800000000000001 111.725 178.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 5.4 m -59.84 -34.79 73.56 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.547 1.067 . . . . 2.1699999999999999 113.749 174.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 56.3 mtp -72.44 -34.19 67.62 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.438 0.563 . . . . 3.4100000000000001 112.026 174.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.34 -47.07 68.47 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.591 -0.693 . . . . 1.8899999999999999 112.499 175.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -68.83 -26.63 65.26 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.361 -0.837 . . . . 3.75 113.147 176.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -63.86 -49.75 71.54 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.679 0.791 . . . . 2.9100000000000001 111.902 168.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -60.84 -46.4 90.72 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.319 1.048 . . . . 3.29 111.878 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -50.26 -50.87 48.81 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.559 1.544 . . . . 3.25 111.494 175.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -64.28 -26.58 68.56 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.197 1.399 . . . . 3.2599999999999998 113.201 -177.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 32.5 mt -78.01 -18.91 55.35 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.812 0.845 . . . . 2.23 111.926 175.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.493 ' CD ' ' HZ1' ' A' ' 92' ' ' LYS . 71.0 mm-40 -91.9 -36.76 13.29 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.165 1.386 . . . . 3.4100000000000001 113.811 173.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -61.52 -28.51 69.36 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.399 1.88 . . . . 3.46 113.607 177.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -91.48 14.95 13.38 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 114.798 1.407 . . . . 2.7000000000000002 114.798 -169.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.493 ' HZ1' ' CD ' ' A' ' 89' ' ' GLU . 58.2 mttp . . . . . 0 C--O 1.251 1.147 0 CA-C-O 115.034 -2.412 . . . . 4.29 116.01 -177.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.431 ' H2 ' ' CD ' ' B' ' 2' ' ' GLU . 79.9 mmm . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 120.668 0.27 . . . . 8.9800000000000004 111.313 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.431 ' CD ' ' H2 ' ' B' ' 1' ' ' MET . 4.0 mp0 -86.0 128.35 34.84 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 123.803 0.841 . . . . 6.5 110.083 -157.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.5 p -78.06 175.15 4.9 Favored Pre-proline 0 N--CA 1.472 0.656 0 C-N-CA 126.293 1.837 . . . . 2.5499999999999998 113.733 -165.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -52.0 -23.14 16.09 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 124.529 3.486 . . . . 1.8200000000000001 114.954 163.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 56.1 tp -70.41 -48.64 55.13 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 120.092 1.314 . . . . 3.6600000000000001 110.29 174.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.09 -30.65 70.48 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.308 0.504 . . . . 4.8399999999999999 111.203 172.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 21.9 mmtt -66.27 -25.57 66.93 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 119.717 -1.864 . . . . 5.2599999999999998 113.126 169.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.28 -45.32 73.42 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 119.9 1.227 . . . . 1.79 111.613 172.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -60.56 -43.2 97.51 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.711 1.204 . . . . 3.98 111.655 170.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 25.9 m -57.32 -47.15 82.29 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.192 1.397 . . . . 2.0600000000000001 111.496 173.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 87.0 m -58.68 -44.29 90.18 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.223 1.009 . . . . 2.0299999999999998 109.867 175.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 3.0 tpp -53.83 -51.47 63.44 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.292 1.037 . . . . 4.6500000000000004 112.61 177.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 10.6 m -67.6 -27.65 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 CA-C-N 118.801 0.728 . . . . 3.4500000000000002 112.511 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 66.2 m -68.34 -47.13 68.31 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.538 1.135 . . . . 1.8700000000000001 110.93 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.91 -40.63 89.5 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.159 0.584 . . . . 2.29 110.007 166.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -63.66 -55.75 21.06 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 120.276 -0.57 . . . . 3.1800000000000002 111.355 -169.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 18.7 m170 -62.35 -35.39 78.97 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.454 0.701 . . . . 4.0499999999999998 112.344 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -74.59 -29.85 61.48 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.489 0.922 . . . . 5.1100000000000003 113.489 -175.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -94.95 -37.55 11.1 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.994 1.318 . . . . 3.48 112.426 175.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 84.1 p -57.65 -33.27 68.11 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.777 1.171 . . . . 2.2599999999999998 112.666 176.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.88 -3.4 73.75 Favored Glycine 0 CA--C 1.528 0.901 0 CA-C-O 116.378 -2.345 . . . . 1.3400000000000001 116.282 -170.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -65.29 -39.65 92.83 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.779 2.29 . . . . 5.6299999999999999 112.338 178.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -122.0 126.87 49.5 Favored 'General case' 0 C--O 1.254 1.298 0 C-N-CA 129.074 2.949 . . . . 3.3599999999999999 110.46 176.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.98 -128.55 42.6 Favored Glycine 0 C--N 1.337 0.61 0 C-N-CA 126.059 1.79 . . . . 2.4399999999999999 113.646 166.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -52.04 148.11 6.52 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.373 2.669 . . . . 4.0099999999999998 114.194 172.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -106.82 -6.32 17.79 Favored 'General case' 0 CA--C 1.553 1.059 0 N-CA-C 114.45 1.278 . . . . 7.25 114.45 -175.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 97.0 mt -99.49 3.56 45.66 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.926 1.29 . . . . 4.29 113.005 175.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 2.0 p -145.64 137.95 25.6 Favored 'General case' 0 C--O 1.246 0.871 0 C-N-CA 125.667 1.587 . . . . 2.3500000000000001 111.938 -166.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 48.4 mt -84.45 126.97 33.74 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 114.605 -1.18 . . . . 2.8300000000000001 109.926 173.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 3.1 m -105.92 150.34 25.75 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 127.037 2.135 . . . . 3.6099999999999999 110.291 -168.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 5.6 mmm-85 -37.61 -46.69 0.88 Allowed 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 117.095 2.258 . . . . 5.2999999999999998 117.095 -165.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.71 -34.23 22.97 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 119.604 1.093 . . . . 4.9000000000000004 112.635 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -50.02 -36.54 29.07 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.386 0.994 . . . . 1.8300000000000001 111.087 165.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.34 -37.98 74.77 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 112.606 0.595 . . . . 3.6699999999999999 112.606 -174.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 26.7 mmtm -63.91 -44.08 94.02 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.646 1.178 . . . . 6.4699999999999998 111.777 171.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 36.2 tp10 -74.5 -15.24 60.88 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 125.56 1.544 . . . . 3.0600000000000001 112.812 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 44.7 tp -96.85 -52.17 3.99 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 120.964 1.711 . . . . 3.3799999999999999 111.831 175.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 36.6 mt -52.03 -52.04 26.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 CA-C-N 121.306 1.866 . . . . 2.0499999999999998 109.995 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 tttp -71.8 10.96 0.58 Allowed 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 125.394 1.478 . . . . 5.54 113.528 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -128.43 -39.7 1.66 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.43 2.292 . . . . 4.3300000000000001 113.941 175.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -70.98 -13.7 62.1 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 119.505 1.048 . . . . 5.1100000000000003 112.514 169.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -134.45 114.46 12.91 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.925 1.69 . . . . 3.0699999999999998 108.292 175.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 12.3 p -85.66 -11.37 53.98 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.548 1.684 . . . . 5.1100000000000003 115.548 -166.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -58.49 -11.99 3.5 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 117.659 2.466 . . . . 5.1100000000000003 117.659 -163.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.36 -49.56 2.67 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 125.188 1.375 . . . . 4.4299999999999997 113.617 177.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -71.13 66.64 0.42 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.7 2.4 . . . . 5.3300000000000001 110.24 174.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.58 -26.3 8.72 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.866 1.666 . . . . 4.0800000000000001 111.558 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 20.0 mtpp 72.54 84.5 0.12 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.869 2.068 . . . . 5.6200000000000001 113.287 159.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -27.76 -52.2 0.08 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 128.856 2.862 . . . . 5.0199999999999996 116.445 -178.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 3.0 m -57.83 -28.8 64.42 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.857 1.208 . . . . 3.52 114.215 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 15.0 t -77.75 -8.2 57.64 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.368 1.067 . . . . 3.75 113.765 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 49.3 mt -85.2 -40.06 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 120.322 1.419 . . . . 2.9399999999999999 113.804 -165.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.24 -23.41 61.22 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 118.981 0.81 . . . . 3.1899999999999999 111.221 172.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -76.15 -44.52 37.92 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.451 0.7 . . . . 2.73 111.504 169.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 51.4 tp -55.01 -45.65 75.13 Favored 'General case' 0 C--N 1.344 0.355 0 O-C-N 121.039 -1.038 . . . . 3.3500000000000001 110.045 168.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 4.6 ttt -58.26 -51.12 71.12 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.951 0.796 . . . . 2.8599999999999999 111.463 175.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -54.97 -28.39 51.2 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.649 1.179 . . . . 4.96 113.311 173.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.0 t -81.2 -30.3 34.34 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.31 1.044 . . . . 2.3399999999999999 112.933 177.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 96.1 mt -86.25 -35.89 19.71 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.0 1.32 . . . . 3.52 112.798 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -75.94 70.99 2.72 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.489 1.915 . . . . 1.6599999999999999 111.129 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.91 -8.91 2.49 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.475 1.51 . . . . 3.98 114.996 -173.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -110.07 -0.63 17.93 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 120.05 1.295 . . . . 3.1400000000000001 113.71 172.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 73.8 m 55.81 33.93 22.46 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.176 1.39 . . . . 3.7799999999999998 113.628 -178.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -102.37 3.8 38.27 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 129.799 3.24 . . . . 2.46 112.033 -168.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 67.26 -10.3 0.35 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 131.117 3.767 . . . . 4.0599999999999996 115.454 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -109.74 144.88 37.52 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 126.163 1.785 . . . . 2.6499999999999999 110.391 175.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 19.8 mt -114.22 106.7 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 O-C-N 121.161 -0.962 . . . . 2.3500000000000001 111.241 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -68.91 159.99 31.59 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.989 2.116 . . . . 2.8799999999999999 110.923 172.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.6 -35.48 54.42 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 120.145 -1.597 . . . . 3.8199999999999998 112.829 170.284 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -63.53 -25.05 68.07 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.623 0.769 . . . . 4.5899999999999999 113.059 173.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -89.47 -54.77 3.94 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 125.835 1.654 . . . . 1.8300000000000001 110.17 174.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -58.42 -32.19 68.42 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 127.0 2.12 . . . . 2.8100000000000001 113.908 -176.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 9.1 p -53.88 -28.01 33.69 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.199 -1.563 . . . . 2.8999999999999999 113.587 168.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 59.7 t -72.31 -31.23 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 120.265 1.393 . . . . 2.5800000000000001 111.25 177.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -63.43 -54.51 35.47 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.556 -0.715 . . . . 4.0 110.192 173.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 72.1 mt -54.33 -40.1 67.68 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.552 1.141 . . . . 2.2400000000000002 111.366 174.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.4 m -59.94 -53.97 51.58 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.047 0.939 . . . . 1.9199999999999999 111.544 176.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.9 mtm -60.55 -40.04 90.15 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.373 0.533 . . . . 2.29 112.222 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 98.1 mt -59.27 -52.43 65.68 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.356 0.662 . . . . 2.5800000000000001 110.685 174.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 93.2 m -59.28 -33.55 71.19 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.537 1.31 . . . . 2.52 114.537 177.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 81.6 mtp -70.19 -33.72 72.07 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.71 0.804 . . . . 2.8700000000000001 112.74 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.73 -34.76 58.09 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.42 1.009 . . . . 1.8 112.079 171.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -62.03 -27.53 68.95 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.133 0.973 . . . . 3.54 112.926 175.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -60.9 -51.72 68.08 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.738 0.815 . . . . 2.98 111.154 170.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.7 -30.64 64.39 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 126.142 1.777 . . . . 3.2200000000000002 111.913 -176.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.68 -51.19 70.43 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.492 1.517 . . . . 3.1400000000000001 110.793 166.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -61.29 -28.32 69.11 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.786 0.834 . . . . 3.4199999999999999 112.336 178.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 63.8 mt -70.64 -39.72 73.5 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.5 -0.75 . . . . 2.8399999999999999 112.083 171.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -75.55 -19.13 59.51 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 115.087 1.514 . . . . 3.3500000000000001 115.087 177.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -78.43 -32.61 48.66 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.143 1.377 . . . . 4.1200000000000001 112.547 171.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -83.6 -8.55 59.29 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.696 0.999 . . . . 3.75 113.696 -173.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.892 0 CA-C-O 116.335 -1.793 . . . . 5.96 115.462 -167.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 107.565 -1.272 . . . . 6.7199999999999998 107.565 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -115.76 -104.17 0.41 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 125.527 1.767 . . . . 4.0 106.856 -157.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 81.2 p -113.12 155.09 44.85 Favored Pre-proline 0 N--CA 1.466 0.343 0 C-N-CA 124.661 1.184 . . . . 2.8100000000000001 110.316 165.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -67.7 -16.23 46.05 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 121.95 1.766 . . . . 2.6200000000000001 111.339 165.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.37 -50.44 65.55 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 123.871 0.868 . . . . 3.3999999999999999 111.02 -178.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -58.95 -43.58 91.3 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 118.778 0.717 . . . . 3.6299999999999999 111.777 173.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.37 -24.16 65.67 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.246 -0.909 . . . . 6.7199999999999998 111.428 -175.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.52 -49.94 23.97 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.789 0.836 . . . . 2.8199999999999998 111.094 166.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.5 mt -53.64 -32.11 50.05 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.48 1.036 . . . . 3.2999999999999998 112.176 175.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.27 -40.8 62.21 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 117.571 -1.204 . . . . 3.8399999999999999 112.137 173.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.5 t -61.81 -26.09 67.89 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 120.288 1.403 . . . . 4.4299999999999997 112.187 -177.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 13.4 mtm -65.23 -37.43 87.23 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.798 0.839 . . . . 4.0999999999999996 111.026 174.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 67.1 t -76.81 -32.7 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.076 1.351 . . . . 3.0600000000000001 111.357 173.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 51.6 m -64.04 -49.41 72.48 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.295 1.038 . . . . 2.46 110.65 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.4 p -64.72 -33.31 75.66 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.691 0.678 . . . . 2.8199999999999998 110.108 173.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.41 -56.5 19.61 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 118.411 0.55 . . . . 3.7400000000000002 109.627 178.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -45.67 84.37 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 120.48 -1.387 . . . . 2.8999999999999999 111.68 -178.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -68.23 -49.1 62.94 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.151 -0.968 . . . . 7.0999999999999996 113.373 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -76.97 -28.17 55.04 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.875 1.216 . . . . 3.5 112.427 178.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.8 p -68.97 -25.57 64.6 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-N 120.955 1.707 . . . . 2.9900000000000002 112.274 170.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -82.91 3.7 82.85 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 125.96 1.743 . . . . 1.9299999999999999 114.298 167.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.6 ttt-85 -64.21 -31.7 73.0 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.865 1.832 . . . . 6.9199999999999999 111.25 171.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -157.41 147.39 20.61 Favored 'General case' 0 C--O 1.249 1.075 0 C-N-CA 124.226 1.01 . . . . 3.8900000000000001 112.878 178.571 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.49 -123.63 30.78 Favored Glycine 0 C--N 1.338 0.694 0 C-N-CA 126.129 1.823 . . . . 3.4399999999999999 112.636 160.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.0 m -47.13 112.5 0.53 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.83 1.252 . . . . 3.5699999999999998 110.752 169.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.16 24.85 2.36 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.582 1.553 . . . . 5.3300000000000001 114.372 -169.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.5 tp -143.44 -43.23 0.28 Allowed 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 124.971 1.308 . . . . 5.0999999999999996 110.559 -177.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 16.9 p -79.83 144.52 33.42 Favored 'General case' 0 C--O 1.248 0.996 0 CA-C-O 122.859 1.314 . . . . 1.8300000000000001 110.849 172.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 28.0 mt -88.26 92.17 9.06 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 105.916 -1.883 . . . . 2.7999999999999998 105.916 165.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.1 t -60.5 149.77 33.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 119.009 -0.52 . . . . 2.7200000000000002 109.994 169.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -37.61 -49.7 1.11 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.507 1.923 . . . . 4.79 113.26 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.439 ' H ' ' HD3' ' A' ' 32' ' ' LYS . 0.8 OUTLIER -70.06 -28.58 65.56 Favored 'General case' 0 CA--C 1.554 1.121 0 O-C-N 119.51 -1.994 . . . . 6.5800000000000001 115.032 -179.837 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -74.91 -38.37 61.84 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.42 1.488 . . . . 1.5800000000000001 109.921 174.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.7 tp -63.4 -39.63 95.02 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.878 0.871 . . . . 2.7400000000000002 111.462 173.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.2 ttmt -55.25 -40.41 70.88 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 119.094 0.861 . . . . 4.5099999999999998 112.005 175.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -60.6 -59.03 6.04 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.963 0.905 . . . . 3.5099999999999998 111.647 170.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.7 tp -56.34 -48.77 76.09 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.412 1.485 . . . . 3.3199999999999998 113.641 -172.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.2 mt -53.57 -61.32 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 CA-C-N 118.64 0.655 . . . . 2.0 110.246 -174.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.87 1.04 28.59 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 113.608 0.966 . . . . 6.0300000000000002 113.608 -172.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 43.6 mmtt -91.77 -33.58 14.94 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.012 1.325 . . . . 3.75 112.859 174.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -89.24 -51.66 5.46 Favored 'General case' 0 CA--C 1.532 0.25 0 O-C-N 124.265 0.978 . . . . 5.2400000000000002 110.303 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 46.7 mt -78.96 67.27 4.62 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.714 1.206 . . . . 3.8300000000000001 111.33 -176.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 98.9 m -63.78 -12.95 39.82 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.349 1.611 . . . . 4.7999999999999998 115.349 -163.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -99.69 0.59 42.21 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 126.789 2.036 . . . . 4.1500000000000004 114.733 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -82.51 121.77 5.54 Favored Glycine 0 CA--C 1.531 1.088 0 O-C-N 121.595 -0.691 . . . . 4.8300000000000001 114.109 -168.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -72.78 60.17 0.5 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.008 1.723 . . . . 6.2599999999999998 111.347 165.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.3 mmt -78.19 68.99 4.33 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 124.054 1.883 . . . . 3.4199999999999999 110.793 173.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -58.84 113.87 2.27 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 113.083 -1.871 . . . . 6.1799999999999997 108.301 174.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -52.35 -35.98 52.48 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 117.097 2.258 . . . . 4.7199999999999998 117.097 -136.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.9 t -57.62 -25.56 60.29 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 120.541 1.519 . . . . 3.79 113.597 177.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.1 t -69.34 -17.92 63.75 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.991 -1.068 . . . . 3.73 113.611 174.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 17.8 mm -61.08 -41.74 90.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 119.897 1.226 . . . . 2.6600000000000001 109.679 168.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.416 ' C ' ' HZ2' ' A' ' 57' ' ' LYS . 2.1 t70 -77.59 -39.05 46.9 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.61 1.164 . . . . 3.4300000000000002 111.89 -169.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.455 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 1.2 m-20 -79.33 -26.93 42.1 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.589 1.156 . . . . 3.9700000000000002 112.888 175.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 43.9 tp -59.88 -52.99 63.07 Favored 'General case' 0 C--N 1.344 0.326 0 CA-C-N 118.858 0.754 . . . . 3.1800000000000002 109.116 159.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -55.99 -48.62 75.52 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.295 1.038 . . . . 2.8500000000000001 111.544 -176.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.455 ' HE2' ' HA ' ' A' ' 54' ' ' ASP . 16.3 mtmm -51.92 -36.98 50.89 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.838 1.255 . . . . 5.9900000000000002 114.304 171.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 50.8 m -84.27 -18.82 35.17 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.177 1.391 . . . . 3.2200000000000002 113.882 -178.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 97.8 mt -83.93 -54.54 4.8 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 124.412 1.085 . . . . 3.1600000000000001 109.973 170.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -78.72 90.22 4.61 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.438 1.095 . . . . 1.6799999999999999 112.482 175.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -78.91 -2.39 39.72 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.95 0.722 . . . . 4.0300000000000002 112.95 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -83.03 -30.46 28.06 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 114.299 1.222 . . . . 2.8599999999999999 114.299 173.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 28.6 t 64.63 23.93 12.9 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.998 0.919 . . . . 3.75 113.131 -159.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 55.3 p-10 -81.8 -10.41 59.34 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.039 1.336 . . . . 2.3999999999999999 111.813 176.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 63.57 4.61 1.85 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 129.545 3.138 . . . . 4.25 114.247 -171.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -106.52 131.03 54.17 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 128.508 2.723 . . . . 2.5099999999999998 110.002 175.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 35.0 mm -87.9 113.97 25.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 O-C-N 120.62 -1.3 . . . . 2.9300000000000002 108.936 168.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -76.87 162.37 27.67 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.462 1.505 . . . . 2.6499999999999999 109.485 167.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.37 -43.3 79.06 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 119.91 -1.744 . . . . 4.6500000000000004 112.944 -176.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.1 pttm -70.19 -14.51 62.66 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.023 1.329 . . . . 3.7000000000000002 114.435 174.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -85.41 -41.76 15.14 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.506 1.123 . . . . 1.9399999999999999 110.666 168.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -57.48 -29.85 64.59 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.637 -1.289 . . . . 3.75 112.637 174.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.0 m -51.49 -32.42 27.37 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.678 1.191 . . . . 2.23 113.738 166.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 32.7 t -70.06 -39.91 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-N 119.652 1.115 . . . . 2.8999999999999999 109.597 179.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -64.76 -54.13 36.21 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 123.458 0.703 . . . . 3.5600000000000001 109.368 177.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.1 mt -58.58 -35.43 72.4 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.232 1.013 . . . . 3.04 112.075 178.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 86.3 m -63.99 -55.65 20.82 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.378 0.99 . . . . 1.8700000000000001 110.509 175.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 77.2 mtm -59.75 -43.88 94.09 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 118.921 0.782 . . . . 2.21 112.193 -175.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.01 -51.97 64.76 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.928 0.891 . . . . 3.7999999999999998 112.215 174.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 8.9 t -63.06 -32.3 73.64 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.38 0.511 . . . . 2.5 112.38 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 80.6 mtp -69.55 -32.67 71.61 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.11 0.782 . . . . 2.3100000000000001 113.11 171.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.64 -43.09 94.78 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.81 1.186 . . . . 1.9199999999999999 111.776 172.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -63.68 -28.17 69.72 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.077 1.14 . . . . 3.4700000000000002 114.077 176.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -61.12 -47.56 85.68 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.805 0.73 . . . . 2.4100000000000001 111.673 171.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -66.85 -43.94 82.36 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.322 0.649 . . . . 3.1899999999999999 111.414 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -51.08 61.71 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.73 1.612 . . . . 3.1299999999999999 111.609 175.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -66.55 -35.03 79.22 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.192 -0.942 . . . . 4.8700000000000001 111.789 -178.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.1 mt -68.55 -33.05 73.43 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.299 0.64 . . . . 3.1200000000000001 112.092 175.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.57 ' CD ' ' HZ3' ' A' ' 92' ' ' LYS . 52.4 mm-40 -75.87 -35.62 59.83 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 114.054 1.131 . . . . 2.8199999999999998 114.054 177.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -71.9 -26.57 62.38 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.17 1.788 . . . . 3.6299999999999999 112.678 178.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -87.79 14.27 9.01 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.553 1.316 . . . . 3.0299999999999998 114.553 -177.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.57 ' HZ3' ' CD ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.954 0 C-N-CA 126.479 1.912 . . . . 4.3600000000000003 113.507 178.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.0 ttp . . . . . 0 N--CA 1.475 0.789 0 N-CA-C 104.493 -2.41 . . . . 6.0899999999999999 104.493 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.78 -170.16 2.85 Favored 'General case' 0 CA--C 1.557 1.231 0 O-C-N 124.083 0.864 . . . . 4.5899999999999999 109.104 129.061 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 72.3 p -121.43 177.6 1.46 Allowed Pre-proline 0 N--CA 1.482 1.168 0 C-N-CA 125.057 1.343 . . . . 2.6299999999999999 113.677 -161.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -59.07 -31.02 94.81 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.47 2.113 . . . . 1.71 113.404 167.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.99 -48.41 71.31 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 119.642 1.11 . . . . 3.8399999999999999 111.409 178.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -64.77 -39.65 93.96 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 118.773 0.715 . . . . 3.7200000000000002 111.891 174.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -58.09 -31.14 66.83 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.354 -1.466 . . . . 5.54 112.632 172.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.35 -31.36 72.1 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.977 0.808 . . . . 1.8899999999999999 112.631 175.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 58.0 mt -65.82 -52.32 51.56 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.334 1.054 . . . . 3.1600000000000001 110.033 175.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 90.4 m -52.46 -43.64 65.06 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.998 1.319 . . . . 2.75 111.51 172.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 59.7 m -64.58 -40.67 95.95 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.764 1.226 . . . . 2.2599999999999998 112.534 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 1.5 tmm? -74.48 -43.81 54.32 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 118.624 0.647 . . . . 4.5700000000000003 112.598 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 16.4 m -61.76 -20.48 23.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 O-C-N 120.636 -1.29 . . . . 3.6200000000000001 112.065 174.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 98.4 m -63.59 -55.5 23.27 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 117.388 -1.291 . . . . 2.8900000000000001 111.782 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 17.0 p -66.79 -33.46 75.67 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 120.048 1.295 . . . . 2.6499999999999999 110.188 175.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -65.0 -46.52 81.06 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 120.803 -0.359 . . . . 3.3300000000000001 111.917 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 23.8 m-70 -64.21 -49.56 71.48 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.096 0.958 . . . . 5.0599999999999996 111.343 171.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -56.15 -43.5 78.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.664 0.785 . . . . 5.3399999999999999 112.763 -175.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -91.66 -31.42 15.85 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.611 1.164 . . . . 3.9100000000000001 113.174 -177.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 72.9 m -65.81 -42.07 91.09 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 121.271 1.85 . . . . 2.29 111.469 172.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.74 -3.39 90.35 Favored Glycine 0 CA--C 1.531 1.073 0 C-N-CA 126.632 2.063 . . . . 1.7 114.555 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -26.18 67.42 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.871 1.668 . . . . 4.0899999999999999 112.053 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.49 ' HG2' ' HE3' ' B' ' 32' ' ' LYS . 0.0 OUTLIER -149.91 167.53 26.38 Favored 'General case' 0 C--O 1.245 0.846 0 C-N-CA 125.676 1.59 . . . . 5.3200000000000003 113.107 159.673 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.11 -105.14 0.42 Allowed Glycine 0 N--CA 1.473 1.161 0 O-C-N 126.227 2.204 . . . . 3.8700000000000001 115.698 128.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -61.4 89.92 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 107.056 -1.461 . . . . 5.4900000000000002 107.056 163.198 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 37.7 mttm -93.09 -26.53 17.42 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 120.315 -1.491 . . . . 7.7199999999999998 114.695 -158.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -80.62 -26.2 37.9 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.904 0.882 . . . . 5.3399999999999999 112.242 172.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.1 p -103.76 151.23 23.28 Favored 'General case' 0 C--O 1.246 0.903 0 C-N-CA 126.932 2.093 . . . . 2.0800000000000001 113.18 -177.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 20.7 mt -76.65 101.54 5.79 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 106.189 -1.782 . . . . 2.5699999999999998 106.189 154.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 17.9 t -62.61 147.41 49.36 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.777 -0.823 . . . . 2.6699999999999999 108.777 165.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -41.75 -41.68 2.39 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.801 1.64 . . . . 4.7800000000000002 113.674 -174.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.49 ' HE3' ' HG2' ' B' ' 23' ' ' GLU . 0.2 OUTLIER -60.37 -49.26 78.3 Favored 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 117.167 2.284 . . . . 7.2000000000000002 117.167 168.439 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -64.69 -35.67 81.8 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.801 1.637 . . . . 2.3599999999999999 110.86 173.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 40.3 tp -62.6 -51.09 68.67 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.179 0.592 . . . . 3.04 110.531 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -52.32 -39.77 61.02 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.782 1.233 . . . . 4.8799999999999999 113.183 177.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -68.29 -57.64 5.64 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.147 1.379 . . . . 3.73 111.855 172.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 24.4 tp -52.6 -58.93 5.21 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.457 1.903 . . . . 3.8100000000000001 111.585 -174.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 54.0 mt -53.98 -42.82 55.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 CA-C-O 121.626 0.727 . . . . 2.4199999999999999 110.46 -177.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 65.2 tttt -64.15 -18.26 64.27 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 113.145 0.794 . . . . 5.4100000000000001 113.145 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 19.6 mmtp -97.44 -45.57 6.39 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.178 1.391 . . . . 5.1399999999999997 112.294 167.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -61.76 -35.97 79.67 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.605 1.962 . . . . 4.0899999999999999 112.038 -170.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -110.96 -70.52 0.81 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.72 1.208 . . . . 2.7599999999999998 109.766 167.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 2.2 t 67.24 -64.91 0.24 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.18 1.792 . . . . 6.3099999999999996 113.118 -169.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 4.2 mm? 30.36 -135.06 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 127.942 2.497 . . . . 4.0599999999999996 112.33 -171.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -89.0 -35.79 8.02 Favored Glycine 0 CA--C 1.528 0.874 0 O-C-N 120.303 -1.498 . . . . 3.9199999999999999 111.057 165.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -89.72 -27.77 19.85 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.369 1.868 . . . . 6.79 114.632 -159.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.77 68.69 7.11 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 123.951 1.834 . . . . 2.73 111.92 -175.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp -134.3 161.22 35.56 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 129.12 2.968 . . . . 8.3399999999999999 108.487 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -40.57 -64.29 0.54 Allowed 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 116.619 2.081 . . . . 3.3999999999999999 116.619 -131.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 13.5 m -65.83 -25.62 67.29 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.272 1.212 . . . . 3.0699999999999998 114.272 -173.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 5.3 m -62.41 -5.25 2.34 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.611 1.165 . . . . 3.2799999999999998 112.898 170.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 62.9 mt -110.33 -22.69 4.86 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 125.606 1.562 . . . . 2.5600000000000001 112.042 175.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -80.06 -48.76 12.77 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.262 0.937 . . . . 3.3100000000000001 112.313 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -68.67 -33.05 73.31 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 118.917 0.781 . . . . 2.7999999999999998 110.252 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 8.3 tt -62.12 -44.3 96.94 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 117.269 -1.348 . . . . 3.4199999999999999 111.073 172.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ttt -58.44 -48.91 79.17 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 121.943 2.156 . . . . 3.3700000000000001 112.133 169.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.23 -20.96 20.6 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 120.09 1.313 . . . . 6.1399999999999997 113.47 174.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 31.0 t -89.25 -38.1 14.47 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.967 1.707 . . . . 2.7000000000000002 112.738 176.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 7.3 mp -71.72 -59.7 2.62 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 126.504 1.921 . . . . 3.46 111.809 174.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -78.66 95.15 5.2 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 127.869 2.468 . . . . 1.4199999999999999 110.748 -170.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.2 -39.89 84.02 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 114.418 1.266 . . . . 3.3799999999999999 114.418 -169.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 53.2 p-10 -99.91 -6.21 27.07 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.045 1.498 . . . . 2.5 115.045 -173.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 17.9 t 64.02 26.41 14.06 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.776 1.23 . . . . 3.1299999999999999 113.742 -177.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 50.8 p30 -68.16 -15.98 63.81 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.406 1.482 . . . . 2.1000000000000001 111.493 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 64.58 22.32 12.62 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 129.273 3.029 . . . . 4.6200000000000001 113.563 -175.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -131.74 123.76 28.35 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 127.775 2.43 . . . . 2.98 107.562 175.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 18.8 mm -90.81 110.72 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 O-C-N 120.993 -1.067 . . . . 2.6000000000000001 111.662 -173.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -76.13 150.54 37.18 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.881 1.273 . . . . 2.6600000000000001 110.167 161.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.04 -33.11 72.77 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 119.96 -1.713 . . . . 4.1799999999999997 112.333 -174.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 19.1 pttm -74.32 -9.12 58.29 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.326 1.232 . . . . 4.0999999999999996 114.326 173.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -81.82 -53.19 6.39 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 108.011 -1.107 . . . . 1.78 108.011 157.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -61.37 -25.56 67.25 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 116.518 2.044 . . . . 5.3399999999999999 116.518 -172.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 94.4 p -65.53 -19.69 66.03 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.207 -1.558 . . . . 2.0299999999999998 111.886 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 1.2 p -69.36 -27.78 35.83 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 N-CA-C 113.0 0.741 . . . . 3.5800000000000001 113.0 170.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 45.8 t80 -61.03 -51.25 69.99 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 120.822 -1.174 . . . . 4.0 110.454 170.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 33.5 mt -59.71 -38.4 81.51 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.419 1.088 . . . . 2.2999999999999998 110.658 177.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.4 m -59.86 -54.21 48.82 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.725 1.21 . . . . 1.9399999999999999 111.417 174.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -55.31 -42.81 74.2 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.708 1.14 . . . . 2.9500000000000002 112.942 177.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 93.7 mt -63.83 -48.64 75.99 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.604 0.762 . . . . 2.8500000000000001 111.52 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 75.1 m -67.58 -32.93 74.03 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 113.038 0.755 . . . . 2.8199999999999998 113.038 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 88.6 mtp -68.71 -36.04 77.95 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.643 0.656 . . . . 2.98 112.082 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.91 -42.98 72.63 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 119.068 0.849 . . . . 2.0 112.049 172.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -63.0 -25.76 68.54 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 119.686 1.13 . . . . 4.4000000000000004 113.77 176.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -62.54 -51.51 67.11 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 120.0 1.273 . . . . 2.7599999999999998 111.854 168.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -71.65 -29.34 64.52 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.578 1.151 . . . . 3.4100000000000001 112.456 -174.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -58.86 -56.5 21.41 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.584 1.554 . . . . 4.8499999999999996 110.678 164.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -60.17 -27.18 66.91 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.684 1.194 . . . . 3.29 113.152 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 68.7 mt -66.37 -40.9 90.01 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 117.507 -1.235 . . . . 2.4399999999999999 112.021 171.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -86.89 -1.73 58.04 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.782 1.401 . . . . 4.0899999999999999 114.782 176.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -76.43 -33.58 58.78 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 120.79 -1.194 . . . . 3.3199999999999998 111.605 159.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -102.86 7.96 39.31 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.506 1.523 . . . . 2.8799999999999999 113.918 -170.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 N-CA-C 118.844 2.905 . . . . 5.7199999999999998 118.844 -161.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 108.096 -1.076 . . . . 6.5999999999999996 108.096 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 17.6 mp0 -115.87 -119.43 0.31 Allowed 'General case' 0 N--CA 1.445 -0.725 0 O-C-N 125.91 2.007 . . . . 3.4100000000000001 106.887 -159.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.9 p -151.03 162.73 25.98 Favored Pre-proline 0 N--CA 1.472 0.628 0 N-CA-C 113.828 1.048 . . . . 2.48 113.828 -138.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -63.65 -39.17 36.46 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.312 2.675 . . . . 3.25 113.131 179.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.2 tp -71.29 -49.98 37.27 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.136 1.335 . . . . 5.0999999999999996 111.423 -177.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -63.55 -37.57 87.83 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.546 0.738 . . . . 5.3899999999999997 109.868 -177.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -67.53 -35.71 79.6 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 120.878 -1.139 . . . . 5.7599999999999998 112.55 171.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.16 -41.7 85.57 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.832 1.196 . . . . 2.3100000000000001 112.428 173.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.4 mt -62.74 -44.6 95.77 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.154 1.382 . . . . 2.6400000000000001 110.211 172.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 68.4 m -53.45 -50.98 64.13 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.444 1.097 . . . . 2.8199999999999998 110.649 172.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 99.2 m -56.08 -48.96 75.11 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.727 0.811 . . . . 2.1000000000000001 110.866 175.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 40.3 ttm -60.85 -45.85 92.9 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.99 1.316 . . . . 3.9700000000000002 112.432 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.3 t -62.65 -41.15 91.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 126.157 1.783 . . . . 3.2200000000000002 110.021 175.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 88.2 m -64.37 -50.7 66.67 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 124.24 1.016 . . . . 2.0699999999999998 111.138 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.3 p -63.66 -36.67 84.62 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.153 0.888 . . . . 2.8100000000000001 110.603 174.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -66.05 -53.18 41.6 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.328 -0.549 . . . . 3.8500000000000001 111.094 -177.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -69.81 -37.24 76.19 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.073 -1.017 . . . . 5.29 112.887 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -70.74 -48.48 54.25 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 119.637 1.108 . . . . 4.9299999999999997 112.355 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -69.56 -23.54 63.57 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.17 0.896 . . . . 3.73 111.601 172.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.0 t -64.5 -21.37 66.66 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 120.126 1.33 . . . . 2.6299999999999999 112.973 169.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.9 -3.76 79.62 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.128 1.347 . . . . 1.71 114.946 174.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -67.11 -33.4 75.39 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.723 1.762 . . . . 5.8899999999999997 111.871 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -146.89 141.01 26.11 Favored 'General case' 0 C--O 1.249 1.03 0 C-N-CA 125.039 1.336 . . . . 3.9199999999999999 111.096 -178.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 45.53 -124.3 6.69 Favored Glycine 0 C--N 1.338 0.689 0 C-N-CA 126.232 1.873 . . . . 3.7200000000000002 112.131 165.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.4 m -41.77 114.33 0.52 Allowed 'General case' 0 C--O 1.245 0.857 0 C-N-CA 125.643 1.577 . . . . 3.04 111.949 173.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 44.7 mtpt -86.75 109.94 19.58 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.518 1.527 . . . . 5.3899999999999997 107.648 151.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.8 mt 152.03 -61.12 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 130.971 3.709 . . . . 4.8300000000000001 107.431 -164.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.3 p -111.64 160.07 17.58 Favored 'General case' 0 C--O 1.246 0.918 0 C-N-CA 127.022 2.129 . . . . 1.9199999999999999 112.685 -171.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.2 mt -92.15 108.31 19.85 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 114.285 -1.325 . . . . 2.6499999999999999 108.382 160.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.85 162.48 24.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.25 0.547 . . . . 2.75 111.908 167.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.1 tpt85 -45.87 -27.69 0.93 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 127.682 2.393 . . . . 4.1200000000000001 114.829 -169.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.1 -28.89 12.07 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.552 1.141 . . . . 5.8499999999999996 113.244 177.412 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -58.0 -50.06 74.69 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.455 0.702 . . . . 2.6099999999999999 109.288 171.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.3 tp -62.42 -51.31 68.03 Favored 'General case' 0 C--N 1.344 0.369 0 C-N-CA 123.709 0.804 . . . . 3.1200000000000001 111.223 175.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.3 ttmm -55.77 -38.84 70.42 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 118.547 0.612 . . . . 4.2300000000000004 112.261 -176.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -70.79 -41.8 71.18 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 117.724 -1.132 . . . . 3.7599999999999998 113.228 176.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.02 -54.09 50.07 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.709 1.604 . . . . 3.6200000000000001 111.065 177.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.7 mt -53.25 -47.39 56.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 CA-C-O 122.167 0.984 . . . . 1.9299999999999999 109.221 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -67.59 -8.49 34.76 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 125.246 1.418 . . . . 6.7400000000000002 113.522 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -94.22 -50.33 5.32 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 119.848 -1.782 . . . . 4.4000000000000004 110.646 160.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 73.5 tt0 -52.25 -65.79 0.5 Allowed 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 128.999 2.92 . . . . 4.6200000000000001 111.862 -171.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -77.81 115.61 17.69 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 125.777 1.631 . . . . 3.2999999999999998 108.397 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 21.6 p -83.24 1.1 42.52 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.988 1.107 . . . . 6.2000000000000002 113.988 171.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -150.54 -172.56 4.22 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.07 0.948 . . . . 4.0800000000000001 112.7 -155.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.71 9.1 50.8 Favored Glycine 0 N--CA 1.472 1.099 0 C-N-CA 124.207 0.908 . . . . 6.25 114.996 170.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.4 ' C ' ' H ' ' A' ' 48' ' ' LYS . 51.7 mm-40 54.32 32.61 16.65 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.431 1.492 . . . . 6.1100000000000003 112.703 -169.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.87 23.85 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.034 1.734 . . . . 2.8100000000000001 114.899 -177.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.4 ' H ' ' C ' ' A' ' 46' ' ' GLU . 15.0 mtpt -78.94 -168.09 1.34 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 127.895 2.478 . . . . 5.9699999999999998 112.133 -175.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -44.5 -62.32 1.23 Allowed 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 116.649 2.092 . . . . 4.8600000000000003 116.649 -161.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.6 t -71.77 -25.44 62.03 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.592 1.087 . . . . 3.0499999999999998 112.788 -175.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.3 m -68.41 -21.53 64.67 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.025 1.33 . . . . 3.48 112.045 174.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 81.8 mt -80.9 -31.75 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 123.857 0.863 . . . . 2.4900000000000002 111.939 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -73.56 -33.03 64.48 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.762 1.165 . . . . 3.5899999999999999 113.67 -174.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -70.77 -40.86 72.38 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 118.708 0.685 . . . . 2.3700000000000001 111.185 163.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.12 -47.82 82.12 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 118.474 -0.774 . . . . 2.96 110.296 178.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.5 mtp -53.42 -50.27 65.56 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 120.114 1.325 . . . . 3.0899999999999999 111.332 177.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.65 -35.11 67.99 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.245 1.418 . . . . 4.2000000000000002 113.064 174.56 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.7 m -84.58 -32.71 23.64 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.949 1.3 . . . . 3.8500000000000001 112.656 -175.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 88.8 mt -76.34 -46.93 25.29 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 125.848 1.659 . . . . 3.6800000000000002 112.271 175.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -70.31 141.18 52.37 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.842 1.657 . . . . 1.6100000000000001 112.984 -172.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -112.44 -26.29 8.78 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 126.295 1.838 . . . . 4.7400000000000002 113.468 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.28 -23.02 57.35 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 120.349 1.431 . . . . 2.9700000000000002 111.652 175.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.8 t 70.53 41.64 0.94 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.701 2.4 . . . . 2.8799999999999999 111.862 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -116.09 -117.24 0.32 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.94 1.296 . . . . 3.0600000000000001 109.249 -160.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -146.63 -10.35 0.47 Allowed 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 116.269 1.951 . . . . 4.6600000000000001 116.269 163.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -105.99 140.01 39.66 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 127.682 2.393 . . . . 3.1000000000000001 110.937 177.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.2 mm -94.24 112.93 27.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 113.018 -1.901 . . . . 2.5299999999999998 109.938 177.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -61.21 157.08 16.98 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.674 1.19 . . . . 3.5099999999999998 111.01 163.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.76 -27.74 60.04 Favored 'General case' 0 CA--C 1.553 1.063 0 O-C-N 120.518 -1.364 . . . . 3.1899999999999999 111.697 164.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -69.93 -38.81 76.32 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.32 1.848 . . . . 4.2999999999999998 111.983 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 64.4 mt-10 -73.16 -51.86 16.31 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.761 1.624 . . . . 1.6699999999999999 109.246 173.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -49.98 -32.36 14.86 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.647 1.579 . . . . 3.5 113.289 174.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.1 m -62.3 -30.81 71.41 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.466 -1.396 . . . . 2.4500000000000002 113.743 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.6 m -79.71 -25.05 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 CA-C-N 120.897 1.68 . . . . 3.3900000000000001 112.282 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -65.72 -64.07 0.95 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.329 0.651 . . . . 2.98 111.279 172.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -53.82 -44.83 70.55 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 125.319 1.447 . . . . 3.73 111.139 -178.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 48.6 m -59.2 -41.41 88.46 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 118.233 -0.889 . . . . 2.5600000000000001 113.082 176.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 67.1 mtm -64.24 -36.04 82.8 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.12 1.327 . . . . 2.5699999999999998 112.204 175.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 78.3 mt -64.77 -43.65 92.58 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 118.866 0.757 . . . . 2.1499999999999999 111.752 173.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 79.8 m -58.57 -42.43 87.96 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 112.903 0.705 . . . . 2.2799999999999998 112.903 171.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 80.2 mtp -64.42 -32.97 74.81 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.687 0.676 . . . . 3.0800000000000001 112.559 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.09 -43.51 57.42 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.769 1.168 . . . . 1.8500000000000001 112.514 173.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -61.47 -31.82 71.8 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.298 0.954 . . . . 3.71 113.152 175.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -57.41 -49.68 75.42 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.572 0.749 . . . . 2.6499999999999999 112.866 169.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.93 -32.68 65.46 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.149 0.58 . . . . 3.3999999999999999 111.697 -174.015 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.81 -48.65 79.11 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.388 1.475 . . . . 3.9199999999999999 111.152 166.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -63.65 -36.59 84.32 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.551 1.54 . . . . 4.0999999999999996 111.959 176.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 19.8 mt -72.33 -13.05 61.39 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.635 1.174 . . . . 2.6099999999999999 114.029 -178.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -93.87 -1.75 54.37 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 114.782 1.401 . . . . 3.6699999999999999 114.782 168.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -105.09 -66.68 0.96 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.11 0.964 . . . . 4.4100000000000001 110.568 165.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -79.8 41.41 0.49 Allowed 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 127.423 2.289 . . . . 4.9199999999999999 112.303 177.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.6 ptpm? . . . . . 0 C--O 1.251 1.159 0 C-N-CA 127.563 2.345 . . . . 7.9699999999999998 114.924 -178.901 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.474 0.761 0 N-CA-C 108.508 -0.923 . . . . 5.6500000000000004 108.508 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -170.72 -172.63 1.22 Allowed 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 128.549 2.74 . . . . 4.4500000000000002 106.107 -153.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 64.3 p -81.47 154.69 71.57 Favored Pre-proline 0 N--CA 1.469 0.518 0 O-C-N 121.895 -0.503 . . . . 2.6200000000000001 111.797 172.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -66.39 -9.16 22.94 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.507 2.138 . . . . 1.8 112.576 165.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tt -75.45 -58.64 3.16 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.186 -1.388 . . . . 3.7999999999999998 109.586 169.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -48.1 -52.39 20.6 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.864 1.211 . . . . 4.3499999999999996 110.613 170.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 2.2 tptm -64.7 -31.69 73.02 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 113.645 0.98 . . . . 5.0099999999999998 113.645 -175.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.34 -31.29 72.4 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.775 0.83 . . . . 2.23 112.418 170.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 22.3 mt -75.15 -34.62 61.64 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.818 0.735 . . . . 3.1299999999999999 111.255 173.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.4 m -59.52 -46.67 88.18 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.326 0.65 . . . . 2.1699999999999999 110.959 166.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 30.1 m -60.56 -42.0 95.72 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.921 1.289 . . . . 2.1800000000000002 111.463 174.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 41.6 ttm -57.66 -49.98 74.67 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.372 0.669 . . . . 3.8700000000000001 111.331 172.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 10.5 t -59.52 -35.9 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 124.675 1.19 . . . . 2.8100000000000001 112.389 174.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 89.0 m -65.68 -47.75 74.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.72 1.608 . . . . 1.9099999999999999 111.819 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.55 -50.21 73.85 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.769 0.713 . . . . 2.29 109.579 167.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -62.19 -46.01 90.83 Favored 'General case' 0 N--CA 1.463 0.218 0 O-C-N 124.192 0.933 . . . . 3.8100000000000001 111.489 -164.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -74.23 -34.77 63.76 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.131 0.789 . . . . 2.6000000000000001 113.131 176.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 16.6 ttmm -69.8 -23.96 63.41 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.021 -1.049 . . . . 5.1900000000000004 113.218 177.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 49.4 m-85 -77.73 -39.61 43.88 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.59 1.156 . . . . 3.2000000000000002 112.235 160.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 17.5 t -59.78 -19.23 49.23 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 116.032 1.864 . . . . 2.3399999999999999 116.032 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.85 -13.3 83.56 Favored Glycine 0 CA--C 1.54 1.649 0 CA-C-O 118.759 -1.023 . . . . 1.55 114.803 170.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -86.67 73.81 9.96 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.067 1.934 . . . . 6.1900000000000004 110.83 176.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 88.72 -178.16 0.02 OUTLIER 'General case' 0 C--O 1.247 0.946 0 C-N-CA 127.378 2.271 . . . . 3.0099999999999998 111.624 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.51 -150.54 21.08 Favored Glycine 0 C--N 1.339 0.718 0 C-N-CA 124.994 1.283 . . . . 2.8599999999999999 111.538 -177.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 2.3 m -80.3 170.15 16.79 Favored 'General case' 0 C--O 1.251 1.155 0 O-C-N 121.967 -0.725 . . . . 3.75 111.412 166.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 61.5 mttt -63.9 162.48 13.68 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 125.082 1.353 . . . . 7.8300000000000001 109.5 144.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 9.3 tp 66.61 -24.77 0.11 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.702 2.001 . . . . 4.5700000000000003 114.486 -174.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' THR . . . . . 0.517 ' HG1' ' CD ' ' B' ' 66' ' ' GLU . 57.7 p -110.01 152.85 25.4 Favored 'General case' 0 C--O 1.245 0.845 0 C-N-CA 124.445 1.098 . . . . 1.78 113.673 178.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 51.9 mt -107.48 99.22 8.75 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.868 -1.06 . . . . 2.6400000000000001 110.717 163.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 35.0 t -55.67 160.16 2.66 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.578 1.151 . . . . 2.48 113.381 161.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -45.59 -24.77 0.37 Allowed 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 117.302 2.334 . . . . 4.71 117.302 -175.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.29 -50.53 5.77 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-N 120.392 1.451 . . . . 4.5 114.096 174.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -54.64 -37.18 65.35 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.314 0.646 . . . . 2.5699999999999998 110.68 179.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 49.9 tp -76.05 -47.19 25.65 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.322 0.86 . . . . 3.3399999999999999 113.322 172.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 17.4 ttmt -52.54 -47.55 66.66 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 120.693 1.588 . . . . 3.7799999999999998 110.986 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.6 tp10 -67.5 -36.0 80.24 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 116.871 -1.538 . . . . 3.7200000000000002 114.253 -178.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 tt -57.82 -54.81 42.69 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 125.672 1.589 . . . . 3.1899999999999999 111.86 173.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 mt -56.67 -39.92 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 N-CA-C 108.849 -0.797 . . . . 2.0600000000000001 108.849 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 52.8 tttt -70.97 3.13 3.57 Favored 'General case' 0 CA--C 1.559 1.316 0 N-CA-C 114.7 1.37 . . . . 5.04 114.7 177.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 17.5 mmtm -112.24 -57.98 2.2 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 126.097 1.759 . . . . 4.6600000000000001 110.487 166.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -53.5 -49.96 66.4 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.211 1.805 . . . . 4.5099999999999998 111.894 179.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -84.22 53.48 2.64 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 120.255 -1.528 . . . . 3.3300000000000001 111.182 176.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 13.1 t -58.81 -13.34 5.91 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.837 1.255 . . . . 3.5 113.531 171.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -48.12 -36.78 13.94 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 127.747 2.419 . . . . 3.8100000000000001 112.57 164.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.77 9.27 81.38 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.127 0.87 . . . . 3.8599999999999999 115.058 166.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -63.59 -49.12 74.63 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.218 1.009 . . . . 7.3899999999999997 110.696 170.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.92 110.64 1.61 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.74 0.816 . . . . 2.4700000000000002 112.097 172.224 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -128.57 146.7 50.77 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.444 1.498 . . . . 4.6200000000000001 109.616 172.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -6.0 -87.96 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 128.243 2.617 . . . . 3.8900000000000001 116.762 -158.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.9 m -57.59 -23.05 48.74 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.297 1.592 . . . . 3.5499999999999998 115.297 -173.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 29.2 t -66.94 -18.62 65.47 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.121 -0.987 . . . . 2.5800000000000001 113.133 173.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 13.8 mm -72.78 -37.3 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 123.923 0.889 . . . . 2.3700000000000001 110.534 171.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -80.13 -37.87 32.65 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.215 1.006 . . . . 3.9399999999999999 111.859 -170.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.459 ' CG ' ' HZ2' ' B' ' 57' ' ' LYS . 9.2 t70 -67.16 -35.45 79.72 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.492 0.553 . . . . 2.2999999999999998 112.492 167.183 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 9.6 tt -63.64 -44.78 92.85 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 118.01 -0.995 . . . . 3.5 111.035 171.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 26.9 mtp -56.94 -45.59 82.67 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 120.127 1.33 . . . . 3.2999999999999998 110.936 175.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . 0.459 ' HZ2' ' CG ' ' B' ' 54' ' ' ASP . 8.3 tttm -52.06 -38.02 55.69 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.425 1.09 . . . . 4.6399999999999997 113.001 168.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.8 t -67.36 -33.61 75.58 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 120.818 -1.176 . . . . 2.6000000000000001 112.731 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 20.6 mt -83.03 -45.52 13.94 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 120.943 -1.098 . . . . 2.8799999999999999 113.486 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -79.39 87.8 5.02 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.51 1.924 . . . . 1.8100000000000001 111.33 -156.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.88 -30.33 70.08 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 115.05 1.5 . . . . 4.0199999999999996 115.05 178.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . 0.286 0.0 OUTLIER -78.41 -22.86 47.13 Favored 'General case' 0 CA--C 1.558 1.274 0 CA-C-N 119.273 0.942 . . . . 2.8300000000000001 111.959 167.183 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 8.1 m 53.21 62.71 2.53 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 126.82 2.048 . . . . 4.3499999999999996 113.146 175.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -141.05 -60.53 0.49 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 118.512 -0.756 . . . . 2.6200000000000001 112.171 -140.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 161.73 -35.81 0.0 OUTLIER 'General case' 0 C--N 1.345 0.374 0 C-N-CA 131.511 3.924 . . . . 6.3300000000000001 115.004 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . 0.517 ' CD ' ' HG1' ' B' ' 28' ' ' THR . 4.0 mm-40 -106.87 135.85 47.7 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 126.358 1.863 . . . . 2.29 108.888 -178.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . 0.41 ' HA ' ' OE1' ' B' ' 71' ' ' GLU 0.257 14.6 mt -99.7 109.85 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.599 0.76 . . . . 2.3100000000000001 111.47 169.98 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -54.23 153.44 5.25 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.491 1.916 . . . . 3.6099999999999999 111.049 166.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.33 -35.13 62.37 Favored 'General case' 0 CA--C 1.552 1.03 0 O-C-N 120.533 -1.354 . . . . 3.4500000000000002 110.942 165.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.434 ' HE3' ' HA ' ' B' ' 70' ' ' LYS . 0.1 OUTLIER -70.19 -35.81 74.19 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 120.548 -1.345 . . . . 8.2200000000000006 113.122 176.965 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . 0.41 ' OE1' ' HA ' ' B' ' 67' ' ' ILE . 57.1 mt-10 -65.03 -51.23 62.71 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 119.143 0.883 . . . . 1.71 108.734 168.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -56.8 -32.78 66.02 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 120.396 -1.44 . . . . 2.9100000000000001 113.898 -177.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 63.9 p -57.45 -21.95 40.31 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 119.748 -1.845 . . . . 3.0600000000000001 114.466 171.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 59.6 t -64.94 -36.88 78.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 119.71 1.141 . . . . 2.46 111.547 171.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -61.83 -47.26 85.87 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.809 0.843 . . . . 2.5800000000000001 109.86 173.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 47.1 mt -58.54 -50.53 73.46 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 117.406 -1.283 . . . . 2.8900000000000001 110.698 178.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 98.6 m -58.66 -46.92 86.13 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.983 1.265 . . . . 2.2200000000000002 111.333 176.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 59.1 ttp -58.01 -47.74 82.14 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.547 0.739 . . . . 3.7599999999999998 112.321 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 94.4 mt -69.84 -46.75 64.92 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.869 0.692 . . . . 2.3100000000000001 112.869 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.76 -33.79 76.45 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.503 1.047 . . . . 2.6800000000000002 111.646 -178.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 61.5 mtp -75.11 -30.39 60.84 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 118.054 -0.974 . . . . 3.1200000000000001 113.1 172.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.0 -39.46 94.16 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 120.7 1.591 . . . . 1.8 111.863 171.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -67.98 -13.08 61.9 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.491 1.293 . . . . 3.54 114.491 173.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -69.43 -45.53 68.92 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.268 0.94 . . . . 3.02 111.912 170.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.0 -44.13 93.57 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.108 1.763 . . . . 3.71 111.643 174.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -54.26 -45.27 72.35 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.646 1.578 . . . . 3.0699999999999998 112.242 175.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -66.23 -27.33 67.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.756 1.223 . . . . 4.5999999999999996 112.804 176.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 49.0 mt -74.32 -21.62 59.63 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 120.893 -1.129 . . . . 2.9199999999999999 112.235 175.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -88.8 3.21 51.85 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.488 1.515 . . . . 3.4100000000000001 114.411 168.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -92.89 -46.2 7.62 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.74 1.216 . . . . 4.5099999999999998 111.027 162.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.35 20.73 0.52 Allowed 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 125.29 1.436 . . . . 4.3099999999999996 114.234 -178.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.256 1.444 0 C-N-CA 128.06 2.544 . . . . 4.7599999999999998 117.736 -166.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.462 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 0.5 OUTLIER . . . . . 0 CA--C 1.503 -0.828 0 N-CA-C 108.471 -0.936 . . . . 9.2400000000000002 108.471 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.462 ' OE1' ' HA ' ' A' ' 1' ' ' MET . 13.8 mp0 -112.38 -138.08 0.37 Allowed 'General case' 0 CA--C 1.542 0.646 0 O-C-N 125.871 1.982 . . . . 4.0499999999999998 109.26 -155.213 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.2 p -99.12 175.54 2.4 Favored Pre-proline 0 C--N 1.316 -0.864 1 C-N-CA 132.644 4.378 . . . . 2.8700000000000001 111.011 -151.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -77.07 -29.91 4.78 Favored 'Trans proline' 0 C--N 1.351 0.668 0 CA-C-N 121.076 1.42 . . . . 1.8200000000000001 112.886 -168.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 18.0 tp -85.71 -39.2 17.46 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 117.007 -1.473 . . . . 3.5600000000000001 112.519 -174.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -58.28 -37.93 75.98 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 120.487 1.494 . . . . 4.6799999999999997 109.915 172.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 ttmp? -65.41 -39.1 91.76 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.532 1.133 . . . . 4.2999999999999998 112.663 171.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.71 -40.66 69.32 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.043 0.937 . . . . 1.99 113.106 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.3 mt -62.34 -42.78 99.67 Favored 'General case' 0 C--O 1.238 0.486 0 O-C-N 121.286 -0.884 . . . . 2.8100000000000001 109.969 170.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 92.5 m -56.05 -44.35 78.77 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 117.042 -1.456 . . . . 2.48 110.748 170.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.0 m -56.54 -52.13 65.96 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 121.481 1.946 . . . . 1.99 112.329 178.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.08 -29.08 69.93 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 113.994 1.109 . . . . 4.0099999999999998 113.994 178.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 80.2 t -76.19 -32.22 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 123.954 0.901 . . . . 3.7000000000000002 112.741 171.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 56.8 m -61.34 -55.37 32.44 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.423 1.489 . . . . 1.97 110.176 175.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.33 -25.26 64.12 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.862 1.265 . . . . 3.25 111.504 -177.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -59.77 -37.65 79.64 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.256 -0.902 . . . . 2.73 111.675 167.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -76.99 -27.9 54.89 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 120.196 -1.565 . . . . 2.6499999999999999 112.954 175.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -56.44 -59.62 4.71 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.725 1.148 . . . . 6.1200000000000001 110.715 164.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -86.51 -45.71 10.85 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 114.298 1.222 . . . . 3.4700000000000002 114.298 -167.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.3 m -67.02 -31.03 71.3 Favored 'General case' 0 C--O 1.249 1.056 0 CA-C-N 120.605 1.548 . . . . 3.3700000000000001 111.362 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.39 2.07 88.21 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 126.873 2.178 . . . . 1.6799999999999999 114.582 173.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.4 ttt85 -74.69 -46.08 40.18 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.749 1.775 . . . . 5.8300000000000001 111.264 175.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -133.0 147.98 52.27 Favored 'General case' 0 C--O 1.252 1.224 0 CA-C-O 122.663 1.22 . . . . 5.5199999999999996 112.845 -174.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.49 -122.96 14.07 Favored Glycine 0 C--N 1.343 0.936 0 C-N-CA 128.308 2.861 . . . . 3.0499999999999998 112.395 168.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.7 m -44.27 109.18 0.14 Allowed 'General case' 0 C--O 1.246 0.877 0 C-N-CA 125.065 1.346 . . . . 4.3700000000000001 110.995 161.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 40.4 tptt -72.71 -27.57 62.15 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.606 1.562 . . . . 6.7300000000000004 112.949 -172.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -90.29 -17.3 27.65 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.503 1.521 . . . . 5.9500000000000002 114.253 178.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.8 p -106.26 152.6 23.31 Favored 'General case' 0 C--O 1.254 1.326 0 C-N-CA 123.921 0.888 . . . . 2.5800000000000001 111.293 178.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 12.2 mt -82.98 107.28 15.47 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 113.306 -1.77 . . . . 3.1000000000000001 106.912 148.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.2 t -66.56 162.69 20.34 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.552 -0.717 . . . . 2.5499999999999998 109.969 162.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -46.74 -36.62 7.42 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.89 1.223 . . . . 4.1200000000000001 113.226 -177.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -79.74 -30.79 40.95 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 120.728 -1.233 . . . . 6.6500000000000004 113.858 177.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -69.36 -33.95 73.84 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.867 1.212 . . . . 1.5700000000000001 110.887 170.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -64.75 -53.47 46.64 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.606 1.162 . . . . 4.21 109.597 174.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.1 mttm -50.87 -47.15 60.52 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.406 -0.809 . . . . 5.1100000000000003 112.49 170.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -53.91 -66.72 0.34 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.575 1.55 . . . . 3.2599999999999998 112.257 173.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.4 tp -49.09 -51.38 31.97 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.571 1.948 . . . . 3.25 111.466 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 84.2 mt -61.21 -57.83 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 N-CA-C 109.321 -0.622 . . . . 2.1600000000000001 109.321 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -60.53 -30.99 70.1 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 121.491 -0.755 . . . . 5.1600000000000001 112.399 -174.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.2 mmtm -76.11 -57.95 3.57 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.25 1.82 . . . . 4.4500000000000002 112.761 176.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -108.66 6.6 25.95 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 113.519 0.933 . . . . 6.25 113.519 -163.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.8 mt -142.91 50.21 1.44 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 127.557 2.343 . . . . 4.71 108.171 168.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 24.7 t -73.19 51.34 0.31 Allowed 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 127.394 2.278 . . . . 3.75 115.9 -166.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -86.74 151.62 23.23 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.579 -1.325 . . . . 4.4699999999999998 111.67 178.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.11 -23.51 73.03 Favored Glycine 0 N--CA 1.48 1.625 0 N-CA-C 116.219 1.248 . . . . 3.9500000000000002 116.219 -167.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.459 ' CD ' ' HZ2' ' A' ' 48' ' ' LYS . 1.5 tp10 -98.26 0.69 46.16 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.558 1.143 . . . . 6.3300000000000001 112.37 174.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.9 tpt -82.65 78.38 9.28 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.679 1.591 . . . . 2.5899999999999999 107.808 171.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.459 ' HZ2' ' CD ' ' A' ' 46' ' ' GLU . 23.8 ttpt -143.87 167.9 21.21 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.849 1.66 . . . . 4.8300000000000001 110.577 -151.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -60.67 -42.37 96.92 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 119.44 -2.037 . . . . 3.6699999999999999 114.504 -161.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.9 m -72.37 -3.78 26.07 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.268 1.581 . . . . 3.77 115.268 176.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.8 p -109.3 -34.81 6.45 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.688 1.131 . . . . 2.8700000000000001 112.106 166.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.1 mt -76.29 -38.98 34.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.409 1.484 . . . . 2.7400000000000002 113.498 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -71.02 -34.46 71.34 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 120.114 1.324 . . . . 2.5899999999999999 112.898 -173.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.466 ' CG ' ' HZ2' ' A' ' 57' ' ' LYS . 4.9 m-20 -87.42 -26.34 23.34 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.815 1.646 . . . . 4.7800000000000002 113.068 175.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 62.3 tp -59.24 -44.57 92.35 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 118.312 -0.852 . . . . 3.3500000000000001 109.846 158.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -48.18 81.35 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 119.795 1.18 . . . . 2.6899999999999999 110.06 179.229 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.466 ' HZ2' ' CG ' ' A' ' 54' ' ' ASP . 32.2 mttp -58.11 -33.26 68.92 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.123 0.969 . . . . 6.6699999999999999 113.172 172.392 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.8 t -79.17 -27.02 42.65 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 114.368 1.247 . . . . 2.8100000000000001 114.368 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.5 mt -81.56 -25.87 35.49 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.734 2.014 . . . . 3.2599999999999998 111.373 174.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.511 ' C ' ' HE2' ' A' ' 61' ' ' LYS . 36.8 t0 -69.12 120.65 15.3 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.478 1.111 . . . . 1.8600000000000001 109.748 166.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.511 ' HE2' ' C ' ' A' ' 60' ' ' ASP . 0.8 OUTLIER -84.38 6.3 23.74 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 119.909 -1.745 . . . . 4.2300000000000004 114.29 -172.635 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.421 ' CG ' ' H ' ' A' ' 63' ' ' SER . 14.2 p-10 -153.03 -86.06 0.07 Allowed 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 124.83 1.252 . . . . 3.75 110.516 -170.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.421 ' H ' ' CG ' ' A' ' 62' ' ' ASN . 12.0 m 156.82 92.73 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 130.191 3.396 . . . . 3.1400000000000001 108.004 -174.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.3 p30 -152.23 -6.45 0.22 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.976 1.31 . . . . 2.21 113.399 -177.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 63.91 1.71 1.2 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 128.238 2.615 . . . . 4.5 114.288 -170.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -106.19 138.3 42.62 Favored 'General case' 0 C--O 1.246 0.872 0 C-N-CA 127.319 2.248 . . . . 3.3599999999999999 110.435 178.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 41.2 mm -103.85 98.37 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 113.709 -1.587 . . . . 2.1600000000000001 107.894 159.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.99 157.33 25.36 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.612 1.165 . . . . 2.73 111.64 163.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -55.95 -25.26 42.73 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 115.159 1.54 . . . . 3.8999999999999999 115.159 -178.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 mtmp? -87.35 -35.17 18.53 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 117.267 -1.349 . . . . 4.4699999999999998 111.893 170.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -54.2 -49.84 68.44 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 120.382 1.446 . . . . 1.98 108.979 166.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -49.93 -32.3 14.48 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 128.09 2.556 . . . . 4.1500000000000004 114.953 -178.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 72.5 p -57.93 -27.4 63.34 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.041 -1.037 . . . . 3.25 112.809 174.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 p -73.99 -30.0 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.217 -0.927 . . . . 3.4399999999999999 112.015 179.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -64.98 -49.96 68.24 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.944 -0.762 . . . . 3.1099999999999999 108.944 169.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.0 mt -61.04 -36.6 79.99 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.177 0.591 . . . . 3.1699999999999999 111.695 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.2 m -59.99 -53.16 61.12 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.714 1.206 . . . . 2.1899999999999999 111.402 174.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.9 mtm -66.94 -37.64 84.69 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 119.121 -0.466 . . . . 2.75 112.192 -177.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 92.9 mt -60.53 -47.52 85.82 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 119.095 -0.479 . . . . 3.1600000000000001 111.331 171.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 19.6 m -55.47 -39.79 70.84 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.691 0.796 . . . . 3.9199999999999999 112.795 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 36.1 mtp -70.12 -33.54 71.95 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 119.003 -0.523 . . . . 2.8799999999999999 112.235 176.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.53 -46.76 68.69 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 119.211 0.914 . . . . 1.99 113.176 -178.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -68.34 -24.25 64.79 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.333 -0.854 . . . . 4.4199999999999999 112.613 175.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -71.8 -33.37 68.5 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 114.036 1.124 . . . . 2.4900000000000002 114.036 174.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.0 -32.27 51.08 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.131 0.572 . . . . 3.1000000000000001 111.324 179.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -54.73 29.33 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.804 0.842 . . . . 3.3999999999999999 110.782 161.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -59.22 -14.96 12.58 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.277 1.431 . . . . 3.4399999999999999 113.89 177.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 41.0 mt -90.42 -12.54 37.15 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 117.273 -1.346 . . . . 2.71 114.624 172.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -102.41 -38.28 7.66 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.738 1.215 . . . . 2.8399999999999999 113.931 167.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -56.68 -33.83 66.79 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.274 1.829 . . . . 4.1200000000000001 113.287 -177.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -83.13 -8.24 59.53 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 116.744 2.127 . . . . 6.9100000000000001 116.744 -172.634 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.96 0 CA-C-O 116.054 -1.927 . . . . 4.7699999999999996 115.927 -169.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 18.1 mtt . . . . . 0 N--CA 1.476 0.848 0 N-CA-C 107.098 -1.445 . . . . 6.8300000000000001 107.098 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.407 ' O ' ' HE2' ' B' ' 7' ' ' LYS . 8.6 mp0 -130.1 137.48 50.2 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 125.561 1.788 . . . . 5.54 107.507 -161.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.26 162.13 27.06 Favored Pre-proline 0 N--CA 1.48 1.051 0 C-N-CA 123.942 0.897 . . . . 3.6099999999999999 111.792 -177.526 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -63.54 -26.62 69.73 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 121.643 1.562 . . . . 2.6499999999999999 112.94 178.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.91 -37.71 39.23 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.174 0.897 . . . . 3.7000000000000002 111.08 174.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -58.76 -42.04 87.98 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.314 0.961 . . . . 3.9300000000000002 111.369 170.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . 0.407 ' HE2' ' O ' ' B' ' 2' ' ' GLU . 68.3 mttm -62.56 -36.69 83.44 Favored 'General case' 0 N--CA 1.463 0.188 0 O-C-N 121.433 -0.792 . . . . 4.7800000000000002 111.714 176.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.29 -47.12 71.56 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 118.937 0.789 . . . . 1.8899999999999999 112.554 172.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -55.84 -50.0 71.75 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.769 1.628 . . . . 4.0199999999999996 113.346 173.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 22.0 p -66.95 -35.91 81.04 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 117.461 -1.257 . . . . 3.3900000000000001 110.821 178.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 95.9 m -59.59 -43.41 93.68 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 119.688 1.131 . . . . 2.23 110.641 170.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -60.58 -55.08 37.63 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.073 0.549 . . . . 4.9800000000000004 111.248 175.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 51.7 t -58.33 -31.79 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 CA-C-N 118.698 0.681 . . . . 3.1499999999999999 111.879 178.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 92.5 m -65.73 -57.6 7.64 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 117.614 -1.184 . . . . 2.02 110.876 175.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.7 p -57.04 -37.55 71.93 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 119.744 1.157 . . . . 2.2599999999999998 111.611 175.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -66.8 -57.9 6.13 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 123.661 0.601 . . . . 3.23 109.969 -176.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.23 -33.62 67.69 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.65 -0.656 . . . . 2.2999999999999998 112.67 -175.213 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -64.55 -34.38 78.11 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.585 1.084 . . . . 6.1500000000000004 112.198 174.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -85.85 -30.11 23.2 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.077 0.853 . . . . 3.5299999999999998 111.833 176.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' SER . . . . . 0.462 ' HG ' ' C ' ' B' ' 27' ' ' LEU . 35.3 t -69.45 -25.6 64.18 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 114.206 1.187 . . . . 2.0600000000000001 114.206 174.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.66 12.19 67.87 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.853 1.692 . . . . 2.0600000000000001 114.702 172.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -75.66 -36.73 60.05 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 118.757 1.278 . . . . 5.7999999999999998 111.935 172.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -157.34 156.87 33.07 Favored 'General case' 0 C--O 1.248 0.985 0 CA-C-O 121.637 0.732 . . . . 2.9900000000000002 111.519 -163.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.94 -128.13 46.46 Favored Glycine 0 C--N 1.338 0.689 0 N-CA-C 109.185 -1.566 . . . . 2.4300000000000002 109.185 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 38.7 m -79.02 153.51 30.21 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-O 122.345 1.069 . . . . 3.96 111.975 164.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -57.3 174.18 0.21 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 115.174 -0.921 . . . . 8.2699999999999996 110.669 142.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.462 ' C ' ' HG ' ' B' ' 20' ' ' SER . 23.6 mt 73.34 -56.99 0.64 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.603 1.561 . . . . 4.0800000000000001 109.405 -169.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 40.6 p -103.38 146.65 28.16 Favored 'General case' 0 C--O 1.255 1.367 0 N-CA-C 115.863 1.801 . . . . 1.96 115.863 -170.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 64.9 mt -102.44 103.46 13.85 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 128.484 2.714 . . . . 2.8100000000000001 111.601 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.5 p -65.77 170.76 4.92 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 115.111 1.522 . . . . 3.6600000000000001 115.111 178.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -47.6 -11.41 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 128.147 2.579 . . . . 6.1799999999999997 115.659 167.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.43 -47.91 3.14 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.812 1.245 . . . . 4.9100000000000001 112.275 168.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -52.91 -38.45 61.83 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.743 0.817 . . . . 2.29 111.428 179.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.6 tp -71.9 -45.66 60.44 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.605 0.762 . . . . 3.21 112.539 178.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -71.58 -37.19 71.04 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 120.609 -1.307 . . . . 6.2199999999999998 111.145 -176.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -54.24 -52.15 62.27 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.157 1.383 . . . . 2.8799999999999999 111.982 164.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 42.9 tp -58.24 -53.17 61.32 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.988 1.267 . . . . 3.1200000000000001 112.376 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 27.4 mt -54.64 -55.07 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 N-CA-C 109.131 -0.692 . . . . 2.0099999999999998 109.131 176.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -68.2 -11.84 59.94 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.08 1.141 . . . . 4.8899999999999997 114.08 -173.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 12.8 mmtp -92.59 -29.64 16.05 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 125.057 1.343 . . . . 4.6299999999999999 114.034 178.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -100.28 -49.93 4.1 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.635 0.774 . . . . 5.7400000000000002 111.733 177.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -81.1 56.19 2.74 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.857 1.263 . . . . 3.6200000000000001 110.383 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 72.3 m -79.24 -7.31 58.17 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.382 1.473 . . . . 4.2300000000000004 113.432 176.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -83.94 137.56 33.58 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.847 1.259 . . . . 3.5899999999999999 112.015 -176.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.1 -108.14 2.44 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.414 -0.674 . . . . 4.5199999999999996 111.414 178.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -169.08 118.46 0.68 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.08 1.752 . . . . 6.0599999999999996 106.947 -174.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.66 -13.61 60.04 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 122.231 1.015 . . . . 3.8199999999999998 112.871 -173.026 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.4 mtpp 71.93 45.8 0.39 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 128.123 2.569 . . . . 6.1699999999999999 110.215 170.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . 0.268 7.3 pt-20 -63.4 2.96 0.34 Allowed 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 119.893 3.294 . . . . 4.5199999999999996 119.893 -138.537 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 29.4 t -53.47 -29.92 38.25 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 119.129 -2.232 . . . . 3.1299999999999999 111.488 149.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 8.6 t -68.63 -15.38 63.51 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.041 1.336 . . . . 3.3900000000000001 114.003 171.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 5.9 mm -68.96 -21.68 25.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 CA-C-N 120.512 1.506 . . . . 3.02 111.461 173.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -77.36 -44.79 28.15 Favored 'General case' 0 C--O 1.224 -0.247 0 N-CA-C 113.754 1.02 . . . . 3.4399999999999999 113.754 164.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.35 -30.86 66.68 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.422 1.465 . . . . 2.54 114.086 -178.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -51.81 -39.45 58.75 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 117.997 -1.001 . . . . 3.48 110.399 162.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 23.1 mtp -63.32 -55.74 22.17 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-O 116.912 -1.518 . . . . 2.79 112.383 173.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -61.13 -32.78 72.47 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 122.238 2.29 . . . . 5.3200000000000003 112.995 -175.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 21.2 m -72.49 -42.68 64.61 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.142 1.377 . . . . 2.8300000000000001 112.183 177.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 8.8 mp -74.41 -31.89 62.48 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 117.992 -1.004 . . . . 3.6400000000000001 112.858 173.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -108.4 56.06 0.63 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 128.568 2.747 . . . . 1.99 110.863 178.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . 0.597 ' H ' ' HE2' ' B' ' 61' ' ' LYS . 0.0 OUTLIER -58.17 -19.7 35.19 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 115.453 1.649 . . . . 4.29 115.453 -173.536 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -89.34 -6.61 56.54 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.121 1.526 . . . . 2.5800000000000001 115.121 173.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 57.8 m 63.06 22.96 13.72 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.903 1.681 . . . . 3.0699999999999998 114.635 174.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 37.0 p30 -89.8 -2.33 58.2 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.505 1.122 . . . . 2.8999999999999999 111.913 177.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 74.71 -31.41 0.21 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 129.935 3.294 . . . . 4.1900000000000004 114.559 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -73.41 135.55 44.21 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 122.629 1.204 . . . . 3.0099999999999998 110.188 176.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 77.9 mt -124.42 106.23 16.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 124.8 1.24 . . . . 2.75 108.551 -176.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -90.23 160.96 15.92 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 127.043 2.137 . . . . 3.71 109.919 165.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -39.18 -42.56 0.98 Allowed 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.985 1.714 . . . . 3.8900000000000001 113.892 170.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -80.16 -10.56 59.77 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.182 0.993 . . . . 5.1399999999999997 113.471 -171.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -91.08 -47.3 7.63 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.3 1.04 . . . . 1.8999999999999999 109.509 161.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -63.57 -28.06 69.67 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 129.083 2.953 . . . . 4.2000000000000002 115.546 -171.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 13.4 p -54.48 -24.04 18.73 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.674 -1.266 . . . . 2.5499999999999998 113.033 175.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . 0.412 HG13 ' HZ2' ' B' ' 61' ' ' LYS . 2.8 p -58.1 -34.82 50.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 N-CA-C 113.009 0.744 . . . . 4.1399999999999997 113.009 171.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -66.3 -51.27 58.98 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.015 1.326 . . . . 2.6499999999999999 109.972 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 28.9 mt -61.16 -43.2 99.25 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.764 0.825 . . . . 2.52 110.123 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 24.1 m -57.49 -51.45 69.4 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.41 1.084 . . . . 2.1400000000000001 111.469 176.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 3.8 mmm -56.97 -44.7 82.88 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.568 0.747 . . . . 3.6400000000000001 112.638 178.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 96.8 mt -68.23 -43.31 78.22 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.604 0.762 . . . . 2.4100000000000001 111.668 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 80.0 m -61.64 -33.0 73.18 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.274 -0.891 . . . . 2.46 112.554 175.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 41.1 mtp -69.14 -37.91 78.53 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.163 0.892 . . . . 3.9900000000000002 112.925 171.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.54 -46.34 88.84 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.207 0.912 . . . . 2.27 112.121 174.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -64.62 -27.72 69.13 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.094 1.146 . . . . 3.77 114.094 174.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.67 -39.6 73.47 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.281 0.946 . . . . 3.4700000000000002 111.338 174.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -68.29 -40.41 81.77 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.906 0.882 . . . . 4.1799999999999997 111.475 177.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -52.68 -50.87 62.43 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.566 1.546 . . . . 4.3799999999999999 111.481 172.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -59.23 -25.72 64.26 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.256 1.422 . . . . 3.7599999999999998 113.144 -178.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 60.1 mt -77.37 -22.25 52.02 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 117.842 -1.075 . . . . 3.25 112.787 177.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -99.53 0.8 43.1 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.043 1.337 . . . . 4.1500000000000004 113.567 169.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -84.2 -36.28 22.9 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.815 1.246 . . . . 3.71 111.78 164.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -100.49 28.3 5.15 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.46 1.504 . . . . 3.2200000000000002 113.409 -170.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 3.7 ptmm? . . . . . 0 C--O 1.246 0.901 0 N-CA-C 118.011 2.597 . . . . 6.1299999999999999 118.011 -156.338 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.86 0 N-CA-C 107.992 -1.114 . . . . 7.3899999999999997 107.992 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -147.64 146.7 29.44 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 126.743 2.017 . . . . 5.0800000000000001 106.594 -164.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.408 ' H ' ' HB2' ' B' ' 43' ' ' CYS . 75.6 p -53.17 162.78 1.02 Allowed Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 124.289 1.036 . . . . 2.6400000000000001 111.225 164.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.75 -19.49 36.1 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 121.952 1.768 . . . . 1.6399999999999999 111.965 168.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -79.06 -41.41 28.84 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.977 0.911 . . . . 5.2000000000000002 112.24 178.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -58.06 -46.21 85.8 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.347 1.059 . . . . 4.0300000000000002 110.094 176.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -60.53 -31.86 70.92 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 114.078 1.14 . . . . 4.46 114.078 172.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.14 -34.04 75.6 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.274 0.943 . . . . 2.1299999999999999 111.655 -175.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 71.4 mt -57.86 -51.81 68.06 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.055 0.942 . . . . 3.0699999999999998 110.476 170.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 m -58.77 -43.84 90.5 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.026 1.331 . . . . 2.7200000000000002 112.004 175.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 51.2 m -60.83 -38.78 86.63 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.668 1.587 . . . . 2.2999999999999998 110.853 178.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.86 -52.8 47.29 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.171 0.988 . . . . 4.9400000000000004 111.453 172.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t -54.73 -28.8 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 O-C-N 120.555 -1.341 . . . . 3.0299999999999998 112.503 174.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 94.4 m -68.56 -46.55 69.15 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.033 1.333 . . . . 2.52 113.372 -177.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.0 p -69.41 -42.96 74.36 Favored 'General case' 0 CA--C 1.504 -0.817 0 CA-C-N 119.724 1.147 . . . . 2.8700000000000001 108.85 172.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -60.92 -57.22 13.57 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 124.622 1.201 . . . . 3.1499999999999999 110.729 -171.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -64.76 -40.84 95.95 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 122.244 -0.285 . . . . 2.5699999999999998 110.554 -175.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -67.24 -41.74 85.16 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.359 -0.838 . . . . 4.5599999999999996 112.776 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -68.8 -37.04 78.99 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.421 1.01 . . . . 3.3700000000000001 112.297 173.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.5 m -62.71 -27.31 69.17 Favored 'General case' 0 C--O 1.25 1.114 0 N-CA-C 114.934 1.457 . . . . 2.96 114.934 172.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.29 -4.63 80.73 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 126.703 2.097 . . . . 1.4099999999999999 114.071 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -54.67 -37.37 65.66 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.395 1.598 . . . . 4.6500000000000004 112.608 178.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 173.12 -155.57 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 128.858 2.863 . . . . 7.04 109.539 176.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 72.92 -142.09 31.39 Favored Glycine 0 C--N 1.336 0.582 0 C-N-CA 127.131 2.3 . . . . 2.3599999999999999 110.181 176.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.9 t -64.43 142.3 58.47 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 122.882 1.325 . . . . 3.0099999999999998 110.153 149.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -97.49 137.64 36.13 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.885 1.674 . . . . 9.9600000000000009 107.609 174.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.6 mt 92.47 -31.16 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 129.219 3.008 . . . . 5.1399999999999997 111.416 -161.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 81.5 p -116.7 161.97 18.4 Favored 'General case' 0 C--O 1.251 1.142 0 N-CA-C 114.638 1.347 . . . . 2.8399999999999999 114.638 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -120.45 102.81 8.7 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.647 1.179 . . . . 3.6899999999999999 112.162 -179.336 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.4 p -77.75 173.64 11.86 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 120.776 -1.202 . . . . 3.3999999999999999 112.381 165.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -39.51 -42.86 1.19 Allowed 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 116.857 2.169 . . . . 4.2599999999999998 116.857 -163.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.57 -26.99 45.67 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 119.632 -1.917 . . . . 5.96 114.057 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -72.95 -51.19 19.4 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 107.339 -1.356 . . . . 2.1699999999999999 107.339 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.21 -32.45 74.13 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.737 0.643 . . . . 2.8999999999999999 112.737 175.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.415 ' HZ2' ' CG ' ' A' ' 53' ' ' ASP . 43.0 mttm -67.13 -38.81 86.22 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 120.11 -1.619 . . . . 5.6699999999999999 112.784 173.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -64.66 -29.29 70.29 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-O 117.794 -1.098 . . . . 4.4800000000000004 113.634 171.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.1 tt -73.27 -66.79 0.64 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.203 1.401 . . . . 3.1299999999999999 112.358 177.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.9 mt -56.26 -43.94 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 124.647 1.179 . . . . 1.97 110.525 -168.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.3 tttp -70.97 -3.85 21.64 Favored 'General case' 0 N--CA 1.439 -1.012 0 N-CA-C 113.994 1.109 . . . . 4.7599999999999998 113.994 -176.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -108.76 -21.63 12.59 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.196 1.798 . . . . 4.5700000000000003 113.387 168.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -76.84 -62.08 1.76 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.855 2.062 . . . . 4.6200000000000001 110.047 178.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 60.3 mt -92.57 101.05 13.47 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.514 -1.366 . . . . 3.5099999999999998 113.241 -163.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 77.8 m -88.03 48.81 1.69 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.626 2.371 . . . . 4.79 112.315 -169.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 38.8 mt -129.27 -1.21 5.09 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.55 1.94 . . . . 4.0 113.791 -163.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 140.81 33.69 0.13 Allowed Glycine 0 N--CA 1.472 1.07 0 C-N-CA 125.763 1.649 . . . . 3.3900000000000001 112.752 -170.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 26.78 65.08 0.08 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 130.209 3.404 . . . . 9.5299999999999994 113.355 172.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 52.1 mmm -20.82 117.27 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.797 2.439 . . . . 3.0 117.122 -158.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.3 tmtt? -48.41 122.84 5.79 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.604 1.962 . . . . 8.2699999999999996 110.297 178.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.31 -39.66 87.8 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.019 1.489 . . . . 5.0099999999999998 115.019 -157.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.2 t -76.35 -21.41 56.15 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.525 1.057 . . . . 3.54 113.507 174.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.0 m -73.66 -9.64 58.88 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.774 -1.204 . . . . 3.6899999999999999 112.527 173.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 20.1 mm -67.59 -25.96 34.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 123.608 0.763 . . . . 3.0499999999999998 112.076 165.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.415 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 59.7 m-20 -78.04 -46.45 20.88 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 114.223 1.194 . . . . 2.7000000000000002 114.223 -163.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.28 -33.22 73.96 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.005 0.821 . . . . 3.25 110.762 166.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 67.9 tp -61.48 -39.36 90.65 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 117.982 -1.009 . . . . 2.8300000000000001 113.33 177.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 18.0 ptm -74.94 -34.5 62.09 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 120.2 1.364 . . . . 2.8900000000000001 112.973 169.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -73.83 -23.35 59.63 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 120.781 -1.199 . . . . 7.4400000000000004 112.735 -178.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.1 t -58.43 -36.89 74.31 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.958 1.703 . . . . 2.8399999999999999 111.348 163.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.6 mt -74.17 -33.69 63.55 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.128 0.971 . . . . 3.3300000000000001 111.306 178.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -80.8 94.02 6.35 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.107 1.763 . . . . 2.52 114.131 -175.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.566 ' HZ3' ' CG2' ' A' ' 74' ' ' VAL . 12.0 mptt -63.02 -34.1 76.84 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.6 1.16 . . . . 4.4400000000000004 111.594 174.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.87 -34.86 51.45 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.706 1.202 . . . . 2.5299999999999998 111.491 175.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.0 m 55.66 61.68 2.73 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.024 2.13 . . . . 4.6799999999999997 111.509 -164.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -105.77 -55.35 2.34 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 117.399 -1.286 . . . . 2.7599999999999998 112.036 -167.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 152.29 -32.35 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.73 1 C-N-CA 133.368 4.667 . . . . 5.1600000000000001 116.091 175.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -90.87 143.5 26.66 Favored 'General case' 0 C--O 1.244 0.803 0 CA-C-O 123.079 1.419 . . . . 2.5299999999999998 108.314 169.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 35.6 mm -110.45 111.43 36.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 126.302 1.841 . . . . 2.52 107.051 173.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.71 175.32 8.04 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.315 1.046 . . . . 2.9100000000000001 112.991 169.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -46.92 -48.56 21.3 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.122 1.369 . . . . 3.6499999999999999 113.682 170.233 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -80.67 -31.81 36.2 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.862 1.265 . . . . 6.9699999999999998 112.226 -171.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -55.58 -65.88 0.51 Allowed 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 123.98 0.912 . . . . 1.8 110.217 159.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -59.42 -32.6 70.33 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.26 2.224 . . . . 3.6800000000000002 114.619 -172.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 69.5 m -62.85 -14.87 51.13 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 119.909 -1.744 . . . . 2.9300000000000002 113.06 -176.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.566 ' CG2' ' HZ3' ' A' ' 61' ' ' LYS . 46.0 t -70.53 -24.22 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 O-C-N 120.893 -1.129 . . . . 3.1499999999999999 112.418 171.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -67.16 -50.0 62.76 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.473 1.109 . . . . 3.1200000000000001 110.356 171.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -56.15 -44.54 79.37 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.226 1.01 . . . . 3.4700000000000002 111.411 172.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.4 m -53.43 -57.41 10.76 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 118.544 -0.741 . . . . 1.6399999999999999 111.578 174.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 14.3 ptp -66.58 -29.09 69.08 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 118.924 0.784 . . . . 3.2599999999999998 112.864 -177.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.1 mt -67.21 -50.86 59.25 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-N 119.011 0.823 . . . . 2.3300000000000001 111.44 171.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.2 m -62.18 -34.71 76.94 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 119.056 0.843 . . . . 2.3700000000000001 112.151 177.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 35.5 mtp -65.56 -37.79 87.73 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.03 0.832 . . . . 2.7000000000000002 112.732 172.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.38 -34.71 54.9 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 119.632 1.106 . . . . 1.72 113.152 175.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.21 -28.42 69.73 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.018 0.826 . . . . 4.1200000000000001 112.993 175.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -56.41 -52.08 65.97 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.275 0.63 . . . . 2.6699999999999999 111.004 167.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.47 -32.96 66.65 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.094 1.357 . . . . 3.4700000000000002 112.509 -176.085 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -57.22 -48.94 77.53 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.476 1.51 . . . . 3.8300000000000001 110.889 170.186 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -61.41 -38.67 87.94 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.919 1.288 . . . . 4.1600000000000001 112.716 174.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.1 -20.97 64.08 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.484 0.92 . . . . 3.8300000000000001 113.484 176.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -95.02 -4.49 46.41 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.513 1.301 . . . . 4.3700000000000001 114.513 172.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -96.65 -54.75 3.13 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.114 1.366 . . . . 3.9300000000000002 111.685 172.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.32 46.11 1.01 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.561 1.544 . . . . 4.5700000000000003 111.53 174.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.205 0 C-N-CA 129.165 2.986 . . . . 6.5999999999999996 115.736 -172.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 107.438 -1.319 . . . . 6.7599999999999998 107.438 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -95.99 172.79 7.78 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 124.92 1.387 . . . . 6.3499999999999996 110.705 176.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.16 176.26 3.47 Favored Pre-proline 0 CA--C 1.542 0.661 0 C-N-CA 129.034 2.934 . . . . 4.2300000000000004 111.99 179.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.04 -16.6 32.17 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 121.966 1.778 . . . . 2.3599999999999999 115.097 -173.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -73.01 -49.68 27.47 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 120.671 1.578 . . . . 3.3700000000000001 110.038 177.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . 0.509 ' H ' ' CD ' ' B' ' 6' ' ' GLU . 18.7 mp0 -67.45 -45.47 75.91 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.244 1.818 . . . . 5.8799999999999999 108.748 -178.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.55 -36.4 69.24 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.098 1.359 . . . . 7.04 112.699 171.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.19 -48.78 64.33 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 117.515 -1.231 . . . . 3.6000000000000001 111.197 170.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . 0.274 0.3 OUTLIER -63.15 -24.11 67.74 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.68 1.582 . . . . 4.4500000000000002 112.962 179.674 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.1 m -52.16 -34.5 45.16 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.942 0.897 . . . . 2.1099999999999999 111.992 165.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.88 -22.04 58.88 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 117.222 -1.371 . . . . 4.0300000000000002 113.169 -179.015 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 19.9 mtp -72.02 -44.67 63.03 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 119.685 1.13 . . . . 4.5999999999999996 111.475 175.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 2.9 m -66.05 -23.84 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 O-C-N 121.055 -1.028 . . . . 3.4700000000000002 111.273 175.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 58.7 m -75.74 -49.49 18.06 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.501 1.52 . . . . 2.1600000000000001 111.707 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.2 p -66.57 -40.24 88.87 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 119.129 0.877 . . . . 2.4100000000000001 109.605 170.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -63.02 -58.88 5.81 Favored 'General case' 0 C--O 1.224 -0.284 0 O-C-N 123.872 0.732 . . . . 3.3399999999999999 110.488 -174.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -57.81 -46.43 84.7 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 118.004 0.365 . . . . 2.6099999999999999 110.588 -175.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.74 -30.53 65.7 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.333 0.864 . . . . 6.0999999999999996 113.333 -174.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -82.19 -19.69 39.32 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.104 0.866 . . . . 3.6600000000000001 112.811 169.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 21.3 p -81.22 -27.96 35.05 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.008 1.484 . . . . 2.29 115.008 178.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.06 -9.58 86.01 Favored Glycine 0 CA--C 1.538 1.504 0 O-C-N 120.506 -1.371 . . . . 2.3300000000000001 112.736 168.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.7 -23.16 63.39 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.136 1.774 . . . . 4.7800000000000002 113.923 -168.075 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -150.41 157.95 43.61 Favored 'General case' 0 C--O 1.245 0.852 0 C-N-CA 126.863 2.065 . . . . 4.1600000000000001 108.454 172.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.69 -3.91 0.21 Allowed Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.383 1.468 . . . . 2.9500000000000002 114.011 -170.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 8.5 t 41.66 -137.74 0.19 Allowed 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 124.877 1.271 . . . . 6.4299999999999997 112.9 -144.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . 0.316 0.0 OUTLIER 53.2 -176.15 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.658 1 C-N-CA 132.703 4.401 . . . . 12.359999999999999 114.893 -173.301 . . . . . . . . 4 3 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 14.4 tp -85.86 39.35 0.8 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.822 1.649 . . . . 5.4199999999999999 111.001 170.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' THR . . . . . 0.406 ' HG1' ' CD ' ' B' ' 66' ' ' GLU . 22.5 p -134.31 141.32 46.89 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.827 2.051 . . . . 2.0 112.446 -167.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 53.8 mt -97.75 98.16 9.62 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.917 1.687 . . . . 2.8900000000000001 111.2 172.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 29.1 t -54.09 151.9 6.51 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.167 1.387 . . . . 2.7599999999999998 110.893 158.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 25.4 ttm-85 -42.81 -37.56 1.84 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.52 1.928 . . . . 5.4199999999999999 115.229 -172.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 17.1 tptt -87.39 -21.81 25.41 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 118.099 2.629 . . . . 9.8699999999999992 118.099 175.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -60.29 -49.62 76.9 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 108.178 -1.045 . . . . 2.3999999999999999 108.178 164.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -56.48 -50.4 71.87 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.967 1.707 . . . . 3.7999999999999998 111.386 -177.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . 0.405 ' HZ1' ' CD ' ' B' ' 46' ' ' GLU . 0.0 OUTLIER -54.38 -42.52 70.44 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.056 1.132 . . . . 4.8799999999999999 114.056 -177.051 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -82.66 -35.53 26.79 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 118.251 -0.88 . . . . 4.9900000000000002 111.709 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.36 -42.29 81.77 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 118.096 -0.955 . . . . 3.29 111.211 175.324 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 47.3 mt -44.9 -53.84 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 CA-C-N 120.178 1.354 . . . . 2.6000000000000001 110.27 171.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 4.5 ttpm? -78.19 -0.9 30.23 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 125.346 1.458 . . . . 4.5099999999999998 114.401 -174.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.85 -33.64 6.67 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 127.1 2.16 . . . . 5.1299999999999999 111.831 175.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.14 -68.51 0.38 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.889 1.675 . . . . 4.6299999999999999 107.185 170.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.13 141.25 52.7 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 121.33 -0.856 . . . . 3.2799999999999998 109.079 170.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . 0.408 ' HB2' ' H ' ' A' ' 3' ' ' THR . 5.1 t -84.3 9.29 13.44 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.422 0.897 . . . . 4.8600000000000003 113.422 171.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 9.3 mp -89.71 153.38 20.75 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.372 1.469 . . . . 4.7199999999999998 111.688 -169.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.71 146.71 48.62 Favored Glycine 0 CA--C 1.532 1.146 0 N-CA-C 110.803 -0.919 . . . . 4.75 110.803 169.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.482 ' HG2' ' H ' ' B' ' 48' ' ' LYS . 23.4 tt0 -57.26 145.38 32.06 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.845 1.054 . . . . 10.41 113.845 -164.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 76.3 mmm -40.49 -40.95 1.33 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.322 1.849 . . . . 4.6799999999999997 113.271 161.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.482 ' H ' ' HG2' ' B' ' 46' ' ' GLU . 0.8 OUTLIER 99.53 140.05 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.968 1 C-N-CA 134.613 5.165 . . . . 4.0899999999999999 108.117 -172.267 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -43.13 -47.76 6.21 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.973 1.709 . . . . 3.9199999999999999 113.579 -176.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -65.02 -15.29 62.16 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 115.39 1.626 . . . . 3.9100000000000001 115.39 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 40.5 t -92.71 -15.27 26.9 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 120.074 1.306 . . . . 3.3100000000000001 112.663 171.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 37.3 mm -65.02 -26.96 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 124.752 1.221 . . . . 3.3399999999999999 111.636 -177.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -63.72 -60.42 3.32 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 119.35 0.977 . . . . 5.96 112.417 178.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.484 ' CG ' ' HZ2' ' B' ' 57' ' ' LYS . 4.2 m-20 -72.35 -25.98 61.74 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.138 0.792 . . . . 3.4199999999999999 113.138 177.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -63.62 -58.21 7.64 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-O 118.766 -0.635 . . . . 3.6600000000000001 109.785 169.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ppp? -66.15 -36.28 82.69 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 118.935 0.789 . . . . 3.1299999999999999 110.873 -172.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . 0.484 ' HZ2' ' CG ' ' B' ' 54' ' ' ASP . 31.7 ttmt -60.1 -23.8 64.12 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 127.774 2.43 . . . . 4.6900000000000004 113.994 173.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 9.3 t -80.34 -21.82 42.07 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.939 -1.101 . . . . 3.1499999999999999 112.187 174.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.3 mt -90.67 -46.39 8.3 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.762 1.625 . . . . 3.2000000000000002 109.809 178.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -67.6 137.05 55.36 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.89 1.276 . . . . 2.4300000000000002 110.82 172.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.21 -43.08 7.52 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.545 -1.347 . . . . 3.6899999999999999 111.43 175.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -86.39 -15.1 41.44 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.294 0.85 . . . . 2.5800000000000001 113.294 -168.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 9.3 t 67.85 16.33 9.66 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.588 1.555 . . . . 2.6899999999999999 112.218 -169.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -73.47 -24.67 60.24 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 130.384 3.473 . . . . 2.1600000000000001 110.318 174.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 64.69 0.52 1.16 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 128.524 2.729 . . . . 6.54 115.573 169.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . 0.406 ' CD ' ' HG1' ' B' ' 28' ' ' THR . 1.5 mt-10 -77.14 130.67 37.64 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 108.088 -1.078 . . . . 2.1200000000000001 108.088 138.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 48.0 mt -100.54 112.97 34.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 124.999 1.32 . . . . 2.4700000000000002 108.516 173.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.94 164.31 25.9 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 122.444 0.298 . . . . 2.5800000000000001 111.466 172.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -43.83 -42.68 5.79 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.366 1.466 . . . . 3.75 113.537 179.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.425 ' HZ2' ' HB3' ' B' ' 70' ' ' LYS . 6.7 ttpm? -76.04 -25.47 55.67 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.406 2.282 . . . . 4.4199999999999999 113.842 -177.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -74.85 -50.4 17.18 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 107.77 -1.196 . . . . 1.6000000000000001 107.77 167.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -56.81 -36.04 69.46 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.618 1.967 . . . . 3.2400000000000002 115.14 -178.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 89.7 p -67.74 -15.28 63.56 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 118.684 -2.51 . . . . 2.6299999999999999 113.599 175.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 27.9 t -70.37 -30.42 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 O-C-N 120.668 -1.27 . . . . 3.1800000000000002 111.711 170.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -60.84 -53.44 57.37 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.528 -0.732 . . . . 3.8700000000000001 110.427 166.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 41.5 mt -57.23 -39.14 74.9 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.648 0.779 . . . . 2.2000000000000002 112.189 176.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 91.5 m -55.34 -56.19 22.94 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.793 1.637 . . . . 1.95 111.627 174.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 22.0 ptp -68.15 -35.83 78.7 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 112.917 0.71 . . . . 3.0899999999999999 112.917 -177.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 97.4 mt -61.84 -45.31 94.37 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 122.921 0.488 . . . . 2.8999999999999999 110.904 172.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 3.0 t -61.18 -32.19 71.93 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.173 0.897 . . . . 3.0499999999999998 112.817 177.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 68.3 mtp -71.57 -34.86 70.32 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.918 1.081 . . . . 2.8500000000000001 113.918 172.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.46 -44.2 83.4 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.763 1.165 . . . . 2.21 110.475 171.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -64.71 -22.02 66.88 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.009 0.744 . . . . 3.5800000000000001 113.009 -179.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -61.18 -62.12 2.07 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 119.245 0.929 . . . . 2.8199999999999998 112.59 162.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.97 -30.47 65.31 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 119.343 0.974 . . . . 3.6800000000000002 112.51 -172.05 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -58.44 -46.96 85.49 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.481 1.912 . . . . 4.7599999999999998 112.143 169.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -60.7 -29.7 69.49 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.443 -1.411 . . . . 4.5599999999999996 112.193 169.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 86.5 mt -83.99 -5.03 59.15 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 117.893 -1.051 . . . . 3.5 113.443 171.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.474 ' HG3' ' HZ1' ' B' ' 92' ' ' LYS . 51.4 mt-10 -89.83 -23.9 21.57 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.874 1.67 . . . . 6.4699999999999998 112.618 170.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.44 -44.63 64.45 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.803 1.241 . . . . 3.52 110.682 163.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -90.34 4.02 52.02 Favored 'General case' 0 CA--C 1.558 1.265 0 N-CA-C 114.944 1.461 . . . . 3.0600000000000001 114.944 -176.105 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . 0.474 ' HZ1' ' HG3' ' B' ' 89' ' ' GLU . 1.1 tttp . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 117.969 2.581 . . . . 6.2800000000000002 117.969 -166.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.8 mmt . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 108.868 -0.79 . . . . 6.6100000000000003 108.868 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -99.0 151.28 21.09 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 128.517 2.727 . . . . 4.8300000000000001 108.702 -176.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.05 153.95 42.22 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 126.485 1.914 . . . . 2.8900000000000001 112.278 -175.086 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -65.93 -26.83 51.26 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.699 2.266 . . . . 2.4100000000000001 113.482 -167.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -65.31 -36.03 82.81 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.597 0.759 . . . . 4.21 111.238 171.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -73.11 -36.9 66.85 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.129 -0.982 . . . . 4.1200000000000001 111.321 174.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -61.93 -33.37 74.13 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.063 -1.023 . . . . 5.1799999999999997 112.491 169.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.31 -46.58 60.34 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.997 1.319 . . . . 2.4300000000000002 112.232 174.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 66.6 mt -72.41 -29.48 63.77 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 120.605 -1.309 . . . . 3.0800000000000001 113.026 177.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.8 p -71.1 -32.34 68.91 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 120.695 -1.253 . . . . 3.9500000000000002 112.669 169.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.1 m -53.96 -39.96 66.42 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.852 1.206 . . . . 2.1400000000000001 110.782 171.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -61.05 -44.24 97.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.072 0.949 . . . . 5.2400000000000002 113.48 176.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.8 m -71.5 -19.6 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 CA-C-N 119.969 1.259 . . . . 3.48 113.097 176.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 87.4 m -80.48 -33.36 36.65 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.715 2.006 . . . . 2.0699999999999998 113.211 -179.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 p -70.82 -39.78 72.85 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.216 0.916 . . . . 2.46 108.87 158.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -62.98 -57.37 10.96 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.407 0.549 . . . . 2.7200000000000002 112.326 -167.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 -54.79 -44.99 74.23 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.728 -0.608 . . . . 4.5199999999999996 111.812 174.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -67.62 -42.72 81.89 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.872 0.869 . . . . 4.9699999999999998 112.492 -171.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -78.35 -29.21 47.38 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.605 -0.685 . . . . 3.3199999999999998 112.457 174.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.4 t -56.98 -19.04 15.99 Favored 'General case' 0 C--O 1.247 0.939 0 N-CA-C 114.738 1.385 . . . . 2.5699999999999998 114.738 174.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.68 -5.04 88.61 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 116.823 -2.098 . . . . 1.8799999999999999 116.869 175.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 -76.94 -23.9 52.41 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 119.87 1.835 . . . . 5.5899999999999999 115.633 -174.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -162.65 162.29 26.95 Favored 'General case' 0 C--O 1.248 0.993 0 C-N-CA 126.861 2.065 . . . . 5.0899999999999999 109.805 -173.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 47.09 -137.58 9.7 Favored Glycine 0 N--CA 1.474 1.214 0 C-N-CA 125.836 1.684 . . . . 2.1200000000000001 113.877 174.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.2 t -73.6 167.97 20.25 Favored 'General case' 0 C--O 1.251 1.164 0 CA-C-O 123.121 1.439 . . . . 3.1600000000000001 112.982 173.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 38.9 mttp -117.07 67.47 0.73 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 130.604 3.562 . . . . 8.1999999999999993 109.501 -175.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 164.18 -10.77 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.969 1 C-N-CA 133.71 4.804 . . . . 4.7999999999999998 110.502 -174.458 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.412 ' HG1' ' CD ' ' A' ' 66' ' ' GLU . 49.6 p -107.76 160.46 15.7 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.466 2.307 . . . . 2.3999999999999999 112.282 167.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.8 mt -108.76 101.53 10.65 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.75 1.62 . . . . 2.54 111.307 162.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.4 m -71.1 160.8 32.23 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 125.102 1.361 . . . . 3.1600000000000001 113.138 -177.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -41.07 -47.03 3.08 Favored 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 115.472 1.656 . . . . 6.1100000000000003 115.472 -172.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.52 -30.29 13.41 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 121.122 1.783 . . . . 5.2599999999999998 113.271 -178.086 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -49.87 -41.73 46.09 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.665 1.186 . . . . 3.1699999999999999 110.32 163.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -68.55 -50.31 52.88 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.496 1.118 . . . . 3.8799999999999999 112.032 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -56.77 -38.52 72.59 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.223 -0.923 . . . . 4.9500000000000002 113.232 -178.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.0 tp10 -66.03 -44.17 85.44 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.36 0.664 . . . . 3.71 112.786 173.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.2 -51.65 69.06 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.664 1.185 . . . . 3.1800000000000002 111.94 -176.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 35.3 mt -54.21 -48.65 66.26 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 CA-C-O 121.925 0.869 . . . . 1.72 110.478 179.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? -69.35 -8.88 50.33 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.371 1.068 . . . . 6.0700000000000003 112.405 -176.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.61 -71.14 0.66 Allowed 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.738 1.615 . . . . 5.7800000000000002 112.805 157.474 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -40.61 -51.39 2.98 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.256 1.422 . . . . 4.3499999999999996 111.864 -172.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.32 9.76 17.0 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 115.608 1.707 . . . . 3.3599999999999999 115.608 -162.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 53.1 t -73.13 74.72 1.26 Allowed 'General case' 0 CA--C 1.551 1.012 0 CA-C-O 123.945 1.831 . . . . 3.5800000000000001 113.043 -177.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -80.5 -47.75 13.82 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 126.366 1.866 . . . . 5.9699999999999998 109.243 166.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -125.04 162.52 19.32 Favored Glycine 0 CA--C 1.534 1.281 0 N-CA-C 108.054 -2.018 . . . . 4.7999999999999998 108.054 139.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.07 120.42 31.24 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.686 1.743 . . . . 8.7899999999999991 110.591 -178.335 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.9 ptm -70.55 141.0 51.9 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.071 -1.018 . . . . 3.7999999999999998 110.825 168.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.41 166.91 22.08 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.93 1.085 . . . . 5.2300000000000004 113.93 -166.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.35 -45.33 69.11 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 127.06 2.144 . . . . 5.9900000000000002 114.087 -168.366 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.4 p -76.06 -40.41 53.3 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 126.099 1.76 . . . . 3.23 112.342 177.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.8 m -61.02 -28.6 69.17 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.43 -0.794 . . . . 3.48 112.597 174.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.3 mt -70.91 -35.09 58.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-O 117.612 -1.185 . . . . 2.2799999999999998 112.243 171.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.32 -29.0 57.13 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 120.432 1.469 . . . . 3.04 113.5 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -72.67 -38.01 67.75 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.103 0.865 . . . . 2.3700000000000001 112.025 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -58.67 -47.32 84.9 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.445 0.698 . . . . 3.5 109.666 169.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.26 -44.76 80.0 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.796 1.239 . . . . 2.54 111.93 173.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.12 -22.92 61.63 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 119.881 1.219 . . . . 4.79 113.047 173.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.1 t -80.84 -36.93 30.85 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 119.81 -1.806 . . . . 2.9900000000000002 112.714 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.5 mp -64.57 -49.08 72.58 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 121.073 -1.017 . . . . 4.1299999999999999 110.608 168.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -103.05 71.44 1.13 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.255 1.822 . . . . 2.4399999999999999 111.718 -164.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -50.97 -27.94 8.77 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.916 1.686 . . . . 3.8900000000000001 114.074 -168.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 41.4 p30 -100.69 -11.52 19.89 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.318 1.847 . . . . 2.9500000000000002 114.744 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.4 t 50.49 52.65 14.41 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.825 1.25 . . . . 4.8899999999999997 112.047 -168.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.5 p30 -83.9 -11.13 57.37 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.575 1.55 . . . . 2.48 111.1 174.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 70.28 13.72 7.6 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 130.256 3.423 . . . . 4.9900000000000002 113.997 -177.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.412 ' CD ' ' HG1' ' A' ' 28' ' ' THR . 5.2 mm-40 -131.65 120.97 23.55 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 127.209 2.204 . . . . 2.48 108.924 179.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 47.4 mt -101.72 108.14 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.004 -1.06 . . . . 2.7999999999999998 111.709 -178.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -64.34 155.74 31.34 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 127.71 2.404 . . . . 2.5499999999999998 111.571 164.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -34.68 68.33 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.477 -1.389 . . . . 3.1499999999999999 114.324 -179.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? -83.72 -24.66 31.12 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 120.497 -1.377 . . . . 4.0099999999999998 112.502 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -60.46 -54.25 47.85 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 108.777 -0.823 . . . . 1.9299999999999999 108.777 157.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -62.07 -33.05 73.69 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 126.706 2.003 . . . . 4.5899999999999999 115.77 -174.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.41 -21.65 65.56 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 120.872 -1.143 . . . . 2.4399999999999999 112.452 -171.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.1 p -57.45 -35.29 49.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 123.632 0.773 . . . . 3.29 112.573 170.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -61.79 -61.01 2.81 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 126.144 1.778 . . . . 3.5899999999999999 111.299 -173.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.5 mt -68.15 -24.54 65.0 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.451 -0.785 . . . . 3.2000000000000002 111.332 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 30.0 m -61.59 -54.88 37.07 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.199 0.909 . . . . 1.71 110.983 168.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 78.1 mtm -58.36 -37.66 75.66 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.258 0.935 . . . . 2.4300000000000002 112.888 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 43.6 mt -73.36 -46.24 50.25 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.853 0.686 . . . . 2.4399999999999999 112.853 178.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 1.7 t -71.11 -25.86 62.78 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.418 -0.801 . . . . 2.71 112.721 178.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 44.6 mmm -58.82 -48.51 81.06 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.807 1.243 . . . . 2.5099999999999998 111.657 165.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.67 -37.85 85.58 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.17 -0.957 . . . . 1.99 112.067 174.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -64.88 -33.11 75.24 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.161 1.171 . . . . 3.5299999999999998 114.161 173.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -58.25 -46.7 85.49 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.608 1.095 . . . . 2.8700000000000001 111.499 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -75.47 -35.36 60.87 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.086 1.354 . . . . 3.8500000000000001 111.984 -172.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.21 -46.02 79.63 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.991 1.716 . . . . 3.3300000000000001 110.981 167.02 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -69.02 -27.49 65.72 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.672 1.189 . . . . 3.9199999999999999 112.466 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 78.6 mt -70.33 -41.36 73.33 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.967 -1.083 . . . . 2.7200000000000002 111.546 171.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -71.47 -13.73 61.91 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.954 1.464 . . . . 3.21 114.954 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -75.14 -58.95 2.97 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.377 -0.827 . . . . 4.6299999999999999 111.182 163.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -68.32 -11.52 59.63 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 115.524 1.675 . . . . 3.8799999999999999 115.524 -165.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.908 0 C-N-CA 126.583 1.953 . . . . 5.5 115.223 -179.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 118.02 -0.991 . . . . 6.4500000000000002 108.834 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.416 ' HB3' ' H ' ' B' ' 3' ' ' THR . 8.3 mm-40 -131.06 -131.82 0.2 Allowed 'General case' 0 CA--C 1.544 0.729 0 O-C-N 124.032 0.832 . . . . 9.1699999999999999 113.043 -164.418 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' THR . . . . . 0.416 ' H ' ' HB3' ' B' ' 2' ' ' GLU . 72.4 p -66.84 168.75 9.64 Favored Pre-proline 0 C--O 1.237 0.42 0 C-N-CA 128.832 2.853 . . . . 3.8999999999999999 113.189 -156.228 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -65.01 -14.51 45.7 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 121.571 1.514 . . . . 2.2000000000000002 112.489 168.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.2 -40.92 74.31 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-N 119.987 1.267 . . . . 4.0999999999999996 112.298 174.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -60.26 -27.6 67.38 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 120.676 1.58 . . . . 4.1500000000000004 112.58 171.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -74.7 -25.64 59.28 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.646 -1.284 . . . . 6.4500000000000002 111.869 171.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.45 -47.89 30.79 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.726 1.211 . . . . 1.8999999999999999 112.116 172.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mp -60.5 -41.63 94.71 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 120.552 1.523 . . . . 3.8199999999999998 112.086 176.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 17.6 p -65.68 -39.41 91.29 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 118.147 -0.93 . . . . 3.0800000000000001 112.231 174.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 87.8 m -57.3 -45.48 84.13 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.775 1.17 . . . . 1.96 110.893 169.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 4.4 tmm? -60.18 -53.08 61.91 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.089 1.355 . . . . 4.7800000000000002 111.584 -176.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 9.9 p -64.79 -25.06 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 O-C-N 121.241 -0.912 . . . . 3.2999999999999998 112.801 175.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 56.3 m -74.9 -45.42 42.82 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 117.978 -1.01 . . . . 1.55 111.276 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 8.6 p -58.48 -38.44 77.62 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.825 0.738 . . . . 2.2400000000000002 110.105 164.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -63.77 -51.98 62.41 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.927 -0.309 . . . . 3.6499999999999999 111.723 -173.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -78.16 -21.81 49.67 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 114.157 1.169 . . . . 2.5299999999999998 114.157 -177.276 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -68.6 -54.88 13.75 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.068 0.849 . . . . 5.0800000000000001 111.374 167.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -73.25 -27.49 61.61 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 121.577 -0.702 . . . . 3.75 112.412 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 10.5 p -68.74 -25.66 64.85 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.92 1.691 . . . . 2.5899999999999999 113.21 172.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.24 5.4 84.4 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 126.684 2.088 . . . . 1.6499999999999999 114.678 170.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -70.42 -29.11 65.63 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.166 1.483 . . . . 4.6799999999999997 112.171 172.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.414 ' CD ' ' HZ2' ' B' ' 32' ' ' LYS . 9.6 tt0 -156.75 153.84 29.03 Favored 'General case' 0 C--O 1.249 1.034 0 CA-C-O 121.899 0.857 . . . . 3.9500000000000002 112.255 176.542 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 58.08 -127.82 46.03 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 126.689 2.09 . . . . 2.7200000000000002 110.972 166.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.91 121.69 11.14 Favored 'General case' 0 C--O 1.249 1.027 0 O-C-N 122.267 -0.549 . . . . 3.6200000000000001 110.127 167.086 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -76.72 54.74 1.0 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 128.367 2.667 . . . . 8.4700000000000006 110.393 166.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 53.7 tp -161.28 -51.09 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 126.213 1.805 . . . . 3.4900000000000002 107.906 -178.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.6 p -92.28 157.42 16.67 Favored 'General case' 0 C--O 1.254 1.338 0 CA-C-O 123.513 1.625 . . . . 2.8599999999999999 112.626 175.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -103.4 107.21 17.95 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 111.636 -2.529 . . . . 4.3499999999999996 107.814 167.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 41.4 t -70.91 143.03 51.1 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 108.594 -0.891 . . . . 2.75 108.594 161.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -24.36 -51.51 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 128.727 2.811 . . . . 6.7999999999999998 116.352 -175.217 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.414 ' HZ2' ' CD ' ' B' ' 23' ' ' GLU . 0.0 OUTLIER -59.0 -44.18 91.63 Favored 'General case' 0 CA--C 1.554 1.112 0 N-CA-C 116.107 1.891 . . . . 5.75 116.107 174.134 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -59.95 -43.74 94.81 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.862 2.065 . . . . 1.8 109.514 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.38 -44.93 70.5 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.245 1.418 . . . . 4.3799999999999999 110.834 -179.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -54.96 -42.11 71.94 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.069 -1.02 . . . . 3.5 112.283 174.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -59.9 -49.06 79.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.532 0.733 . . . . 3.0299999999999998 111.805 174.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.5 tp -57.78 -44.52 86.29 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.144 0.978 . . . . 3.3599999999999999 112.715 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 73.8 mt -56.74 -55.4 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 N-CA-C 109.558 -0.534 . . . . 2.2799999999999998 109.558 171.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -63.5 -17.52 62.84 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 112.95 0.722 . . . . 5.2400000000000002 112.95 -175.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -87.25 -48.56 7.92 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 125.902 1.681 . . . . 5.7400000000000002 113.917 -178.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -116.09 -8.84 11.77 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 125.399 1.687 . . . . 6.5499999999999998 114.384 -159.254 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 24.0 tp -121.34 88.72 2.99 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.753 1.221 . . . . 3.8199999999999998 109.073 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 17.9 p -82.4 13.89 3.34 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 115.088 1.514 . . . . 4.96 115.088 -157.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 8.0 mp -75.98 134.16 40.24 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.121 0.968 . . . . 4.7000000000000002 111.173 -169.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.59 -20.97 59.86 Favored Glycine 0 CA--C 1.532 1.15 0 CA-C-O 119.625 -0.541 . . . . 3.4199999999999999 113.83 177.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.421 ' C ' ' H ' ' B' ' 48' ' ' LYS . 23.2 mm-40 -87.39 -3.81 59.02 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.886 1.275 . . . . 5.6900000000000004 113.629 175.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 7.3 tpt -77.06 39.16 0.23 Allowed 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 124.309 2.004 . . . . 3.0 112.144 171.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.421 ' H ' ' C ' ' B' ' 46' ' ' GLU . 60.0 mttp -57.84 125.89 25.01 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 127.138 2.175 . . . . 4.6500000000000004 109.848 -174.329 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 65.1 tt0 -58.38 -29.37 65.97 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 115.267 1.58 . . . . 4.0999999999999996 115.267 -166.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -66.66 -14.39 62.41 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 120.556 1.525 . . . . 2.9199999999999999 113.789 173.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 9.4 t -97.19 -7.84 31.44 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.669 1.588 . . . . 2.9300000000000002 112.422 172.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 12.5 mt -65.28 -40.39 88.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 119.843 1.202 . . . . 2.1099999999999999 110.813 176.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -72.0 -23.89 61.48 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.206 0.817 . . . . 3.0800000000000001 113.206 -174.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -76.1 -37.22 58.38 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.467 0.707 . . . . 2.3900000000000001 111.809 172.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 10.3 tt -62.62 -49.39 75.38 Favored 'General case' 0 C--N 1.343 0.316 0 O-C-N 121.506 -0.746 . . . . 3.5800000000000001 110.184 168.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.09 -48.78 67.49 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 124.341 1.056 . . . . 3.5 111.72 177.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -58.4 -36.47 73.61 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.313 1.845 . . . . 4.7699999999999996 113.056 173.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 67.9 m -77.57 -19.43 55.67 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.317 1.847 . . . . 2.8199999999999998 114.315 177.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 20.4 mt -78.08 -54.37 6.34 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.338 -0.851 . . . . 2.96 109.568 159.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -82.88 53.43 2.41 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 129.699 3.2 . . . . 2.0600000000000001 112.197 -172.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -58.53 -19.17 35.42 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.049 1.74 . . . . 4.3799999999999999 113.642 -172.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 50.9 p30 -96.23 -8.33 33.23 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.39 1.876 . . . . 2.52 115.145 174.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 68.1 m 60.68 28.64 18.35 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.916 1.686 . . . . 2.8999999999999999 114.743 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 47.1 p30 -79.11 -8.54 59.06 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.173 -0.954 . . . . 2.29 111.562 177.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 71.12 -15.22 0.42 Allowed 'General case' 0 C--O 1.236 0.369 0 C-N-CA 131.038 3.735 . . . . 4.0800000000000001 115.282 171.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -78.3 150.14 33.37 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-O 122.752 1.263 . . . . 3.71 110.16 159.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 37.1 mm -113.72 112.14 39.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 125.824 1.649 . . . . 2.4500000000000002 108.561 164.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . 0.414 ' CG ' ' HZ1' ' B' ' 70' ' ' LYS . 0.0 OUTLIER -82.73 168.68 16.97 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.607 1.163 . . . . 2.8799999999999999 111.315 163.54 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -56.63 -33.27 66.14 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.508 0.929 . . . . 3.8700000000000001 113.508 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.414 ' HZ1' ' CG ' ' B' ' 68' ' ' ASP . 8.6 mtmp? -70.14 -44.28 69.19 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.555 -1.34 . . . . 4.8399999999999999 111.975 176.378 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -59.59 -47.91 83.74 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 118.838 0.744 . . . . 1.77 109.812 171.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -59.42 -31.91 69.71 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.849 1.66 . . . . 3.1400000000000001 114.851 179.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 38.3 t -56.43 -30.63 63.06 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.753 -1.217 . . . . 2.25 112.518 171.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 45.5 t -60.13 -44.47 95.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 O-C-N 121.394 -0.817 . . . . 2.6200000000000001 110.471 175.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -58.24 -53.3 59.88 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.659 0.784 . . . . 2.5600000000000001 111.384 176.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 59.8 mt -60.28 -40.2 89.6 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.131 0.973 . . . . 2.5099999999999998 111.604 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.9 m -62.02 -53.26 58.12 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.322 1.449 . . . . 1.79 110.981 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.9 mtm -57.43 -38.79 74.95 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.383 0.512 . . . . 2.2799999999999998 112.383 179.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 95.1 mt -70.39 -47.28 61.59 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 118.572 -0.728 . . . . 2.5099999999999998 111.699 178.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 65.0 m -64.4 -30.18 71.23 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 120.034 1.288 . . . . 2.6299999999999999 113.872 175.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 81.3 mtp -64.39 -48.69 74.49 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.074 0.852 . . . . 3.1400000000000001 111.242 165.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.76 -39.01 92.84 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.298 0.953 . . . . 1.8999999999999999 112.513 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -66.66 -33.31 75.36 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.427 1.012 . . . . 4.7699999999999996 112.803 174.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.96 -49.99 58.5 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.271 1.028 . . . . 2.4700000000000002 111.001 172.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -64.2 -46.69 82.8 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.802 1.241 . . . . 4.2000000000000002 110.725 -175.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -62.39 -41.26 98.53 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.234 1.813 . . . . 3.0499999999999998 112.509 174.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -64.26 -32.43 74.02 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 120.802 -1.186 . . . . 3.8700000000000001 111.104 174.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 66.0 mt -73.22 -17.25 61.37 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 117.934 -1.031 . . . . 2.8900000000000001 113.573 173.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -83.34 -15.01 51.66 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.905 1.23 . . . . 4.8700000000000001 113.679 168.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -85.57 -59.65 2.25 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.075 1.35 . . . . 3.1200000000000001 111.645 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.62 -4.67 32.3 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 115.064 1.505 . . . . 2.8599999999999999 115.064 -170.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.046 0 C-N-CA 126.649 1.98 . . . . 4.7800000000000002 114.969 175.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.6 ttm . . . . . 0 N--CA 1.476 0.852 0 N-CA-C 107.289 -1.374 . . . . 9.0199999999999996 107.289 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.4 mp0 -123.29 -67.8 0.92 Allowed 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 107.169 -1.419 . . . . 4.9199999999999999 107.169 -157.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 24.9 p -151.73 157.73 34.4 Favored Pre-proline 0 C--O 1.238 0.485 0 C-N-CA 128.569 2.747 . . . . 3.98 108.617 177.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.77 -25.98 16.43 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 122.926 2.418 . . . . 3.02 111.199 162.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.66 -47.01 85.55 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.676 1.59 . . . . 3.7799999999999998 112.351 -178.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -60.8 -34.73 74.95 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.258 0.481 . . . . 4.0599999999999996 111.746 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.33 -28.82 65.42 Favored 'General case' 0 CA--C 1.552 1.033 0 O-C-N 119.851 -1.781 . . . . 5.2999999999999998 112.17 175.424 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.16 -39.89 62.95 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.63 -0.669 . . . . 2.6400000000000001 111.657 173.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 97.6 mt -59.9 -47.0 87.55 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.859 0.754 . . . . 2.27 110.887 172.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 m -52.96 -54.52 33.76 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.424 1.49 . . . . 3.71 112.031 171.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.7 t -66.86 -28.48 68.37 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-N 120.5 1.5 . . . . 3.9100000000000001 112.879 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.98 -48.45 63.1 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 117.782 -1.104 . . . . 4.8200000000000003 112.365 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.0 p -63.74 -24.5 35.97 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-N 120.689 1.586 . . . . 3.52 111.848 175.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.9 m -73.9 -53.07 10.96 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.347 1.459 . . . . 1.9299999999999999 111.923 179.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.4 p -63.77 -35.01 79.18 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.701 1.137 . . . . 2.4700000000000002 110.533 171.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -59.05 -62.87 1.56 Allowed 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 108.925 -0.768 . . . . 2.9700000000000002 108.925 177.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.99 -31.13 69.74 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.647 1.112 . . . . 2.48 112.725 -172.165 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -57.77 -49.25 77.22 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.704 -0.623 . . . . 5.0499999999999998 112.358 169.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -83.94 -29.57 26.99 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.951 -1.093 . . . . 4.2999999999999998 113.397 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.9 p -69.46 -30.69 68.65 Favored 'General case' 0 C--O 1.242 0.689 0 O-C-N 120.82 -1.175 . . . . 2.9900000000000002 111.047 172.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.57 -1.15 70.04 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 127.518 2.485 . . . . 1.8799999999999999 115.467 171.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -72.23 -42.56 65.55 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.879 1.839 . . . . 6.6399999999999997 111.37 -177.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -149.56 166.44 29.22 Favored 'General case' 0 C--O 1.244 0.775 0 C-N-CA 125.781 1.633 . . . . 3.8500000000000001 113.011 -177.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.62 -132.77 51.62 Favored Glycine 0 C--N 1.339 0.735 0 C-N-CA 125.292 1.425 . . . . 2.5800000000000001 110.779 171.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.5 m -64.34 138.21 58.31 Favored 'General case' 0 C--O 1.249 1.051 0 O-C-N 121.934 -0.745 . . . . 2.9900000000000002 110.555 163.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 36.1 pttt -67.81 -24.81 65.33 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.31 0.644 . . . . 6.2699999999999996 111.929 171.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.0 mt -81.57 -23.74 36.95 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.931 1.292 . . . . 4.6200000000000001 113.683 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 61.1 p -109.26 146.15 34.74 Favored 'General case' 0 C--O 1.244 0.799 0 CA-C-N 119.934 1.243 . . . . 2.1800000000000002 111.276 175.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.84 83.37 2.54 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.245 -1.02 . . . . 3.3199999999999998 108.245 163.251 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.0 m -58.16 143.62 43.4 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 123.914 0.885 . . . . 4.1799999999999997 108.803 176.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 35.7 ptt-85 -47.47 -34.89 7.89 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 117.241 2.312 . . . . 7.7300000000000004 117.241 -158.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.5 ptmm? -51.76 -39.53 58.71 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 116.337 1.977 . . . . 5.5300000000000002 116.337 168.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -68.1 -52.57 33.49 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 128.334 2.654 . . . . 1.6599999999999999 108.747 169.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.6 tp -64.37 -33.95 77.03 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.799 0.666 . . . . 3.6499999999999999 112.799 -172.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -8.84 54.07 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 115.184 1.55 . . . . 5.8099999999999996 115.184 -179.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -74.96 -66.79 0.71 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 118.592 -0.718 . . . . 3.9500000000000002 109.758 156.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 31.8 tp -44.33 -54.49 5.76 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.319 1.448 . . . . 3.7400000000000002 113.26 -167.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 28.6 mt -48.14 -44.47 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 123.43 0.692 . . . . 2.0 112.102 -176.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.275 0.0 OUTLIER -84.45 -9.07 58.71 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-O 118.626 -0.702 . . . . 5.0 110.896 -167.769 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -67.28 -57.58 6.39 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.733 1.151 . . . . 3.4900000000000002 109.627 168.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -54.95 -69.16 0.14 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.885 2.074 . . . . 4.5099999999999998 110.421 171.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -79.23 65.23 4.34 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.66 1.219 . . . . 3.7400000000000002 108.402 176.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.8 p -59.96 -55.09 38.31 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.411 1.884 . . . . 3.98 111.647 176.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.4 mp -14.28 -110.82 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.737 1 C-N-CA 132.378 4.271 . . . . 5.04 115.876 -174.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -147.13 -28.63 0.07 OUTLIER Glycine 0 N--CA 1.473 1.119 0 O-C-N 121.473 -0.767 . . . . 4.3300000000000001 114.595 175.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 27.1 mp0 -63.24 -43.04 99.15 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 128.339 2.656 . . . . 5.5199999999999996 111.581 -177.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.17 67.59 6.04 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 123.961 1.838 . . . . 2.1200000000000001 110.333 165.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.3 tptp -72.5 160.23 32.64 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 111.49 -2.595 . . . . 7.7599999999999998 109.652 160.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.536 ' CD ' ' H ' ' A' ' 49' ' ' GLU . 4.4 mp0 -52.25 -45.85 65.53 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.624 1.57 . . . . 4.75 113.188 -170.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.8 t -80.02 -15.17 57.77 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.507 1.299 . . . . 3.4399999999999999 114.507 178.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.9 m -68.04 -19.27 64.87 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.129 1.332 . . . . 3.1699999999999999 111.712 173.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 70.6 mt -85.93 -24.12 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 125.548 1.539 . . . . 2.4500000000000002 112.808 -175.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -57.0 -58.08 9.74 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.698 -0.852 . . . . 3.6200000000000001 108.698 162.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -66.45 -38.61 87.74 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.339 0.866 . . . . 2.5299999999999998 113.339 -175.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.68 -51.35 70.32 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 118.582 -0.723 . . . . 3.5299999999999998 110.395 171.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.08 -33.26 70.03 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.236 0.925 . . . . 2.71 112.5 -176.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.3 mtpt -58.72 -39.38 80.67 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.446 1.021 . . . . 5.6900000000000004 112.489 170.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.7 t -77.41 -30.37 53.48 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.617 0.969 . . . . 2.73 113.617 173.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.52 -36.36 76.36 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 124.398 1.079 . . . . 3.79 112.143 178.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -72.45 77.48 1.04 Allowed 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.682 1.193 . . . . 1.6200000000000001 111.276 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 3.5 0.21 Allowed 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.863 1.665 . . . . 6.4100000000000001 114.974 -170.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 38.7 p30 -137.67 -0.79 2.11 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 127.298 2.239 . . . . 3.8799999999999999 114.525 173.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.9 m 60.73 37.48 18.92 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 115.182 1.549 . . . . 4.5800000000000001 115.182 168.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -88.11 -32.0 18.92 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 126.905 2.082 . . . . 2.7599999999999998 112.975 177.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 105.89 -1.17 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.043 1 C-N-CA 136.455 5.902 . . . . 4.6399999999999997 114.087 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -107.92 136.38 47.73 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 128.21 2.604 . . . . 2.5800000000000001 110.429 178.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 24.7 mm -112.05 114.34 46.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 124.173 0.989 . . . . 2.4100000000000001 108.468 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -103.48 156.92 17.4 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.558 2.343 . . . . 3.3199999999999998 108.589 173.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -37.82 -45.19 0.81 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.976 1.71 . . . . 3.8399999999999999 114.241 176.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.3 pttt -63.9 -18.31 64.07 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.965 1.306 . . . . 4.4299999999999997 114.025 -177.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -105.14 -53.17 2.71 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 127.797 2.439 . . . . 2.9100000000000001 108.147 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -45.25 -35.1 3.17 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 128.384 2.674 . . . . 3.4900000000000002 114.81 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.1 m -68.79 -15.3 63.47 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 120.657 -1.277 . . . . 2.2999999999999998 113.182 178.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 84.3 t -67.06 -31.37 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-N 119.348 0.977 . . . . 3.1299999999999999 110.637 169.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -59.33 -53.19 61.08 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 118.983 0.811 . . . . 2.8999999999999999 110.323 168.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 22.1 mt -62.73 -35.91 81.28 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.255 0.622 . . . . 2.6099999999999999 111.186 -176.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.4 m -63.2 -42.39 99.31 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 125.12 1.368 . . . . 2.3100000000000001 111.507 172.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 44.3 ttm -61.6 -42.6 99.1 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.499 1.12 . . . . 4.0999999999999996 111.431 178.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.34 -56.66 10.05 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.056 0.543 . . . . 3.9399999999999999 111.253 173.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.3 m -60.99 -34.34 74.65 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.8 1.037 . . . . 2.3999999999999999 113.8 -175.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 56.0 mtp -76.7 -24.99 53.11 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.927 1.24 . . . . 3.2799999999999998 113.918 173.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.3 -43.63 40.61 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 120.525 1.511 . . . . 2.1200000000000001 111.454 169.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -63.61 -28.73 70.12 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.494 1.043 . . . . 3.4399999999999999 112.914 173.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -54.38 -56.72 15.72 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.577 0.751 . . . . 2.7400000000000002 111.75 165.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.75 -42.35 81.93 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.855 0.862 . . . . 3.2400000000000002 111.661 -176.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.52 -44.44 69.14 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.589 1.956 . . . . 3.3100000000000001 112.347 172.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -70.62 -32.2 69.44 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.577 -1.327 . . . . 4.3300000000000001 111.723 176.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.3 mt -84.41 -1.52 55.69 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 125.466 1.507 . . . . 2.9700000000000002 113.546 174.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -74.11 -22.42 59.48 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 121.088 -1.007 . . . . 5.2300000000000004 112.348 162.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -106.28 -65.07 1.1 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.379 1.872 . . . . 5.0099999999999998 111.39 176.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -84.22 42.84 0.9 Allowed 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 126.726 2.011 . . . . 4.2199999999999998 112.467 -178.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.5 mmtt . . . . . 0 C--O 1.252 1.215 0 C-N-CA 130.375 3.47 . . . . 8.2899999999999991 115.959 -177.669 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.75 0 N-CA-C 103.636 -2.727 . . . . 5.9100000000000001 103.636 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.581 ' CD ' ' H ' ' B' ' 2' ' ' GLU . 7.5 mp0 -58.03 171.37 0.53 Allowed 'General case' 0 C--O 1.246 0.908 0 C-N-CA 126.119 1.767 . . . . 6.04 109.203 140.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 48.4 p -90.74 165.59 21.96 Favored Pre-proline 0 N--CA 1.469 0.486 0 C-N-CA 125.053 1.341 . . . . 2.3799999999999999 112.629 -163.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -63.41 -20.66 70.51 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 121.818 1.679 . . . . 2.4300000000000002 112.898 168.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -80.19 -43.39 21.62 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-O 117.136 -1.412 . . . . 3.4199999999999999 111.905 175.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.93 -46.98 81.67 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.436 1.471 . . . . 4.6200000000000001 110.922 168.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -57.97 -27.8 63.78 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.103 -0.998 . . . . 6.1600000000000001 112.959 172.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.09 -39.85 54.39 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 120.597 -1.314 . . . . 3.02 111.659 176.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 96.0 mt -66.22 -32.5 73.96 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.016 0.926 . . . . 2.7400000000000002 112.011 171.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.4 m -60.44 -55.98 26.96 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.087 0.858 . . . . 2.8199999999999998 110.777 161.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 83.4 m -53.07 -39.48 63.33 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.15 1.38 . . . . 3.3500000000000001 111.375 -174.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -48.25 -42.6 30.91 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.027 1.731 . . . . 4.7999999999999998 112.864 174.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 66.4 t -62.41 -28.64 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 124.967 1.307 . . . . 3.3900000000000001 112.674 178.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 14.5 m -66.07 -39.96 90.5 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.991 1.716 . . . . 1.9099999999999999 112.423 -179.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -44.94 68.34 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 126.548 1.939 . . . . 2.4100000000000001 108.713 169.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -67.73 -43.97 78.72 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 123.719 0.637 . . . . 3.29 111.721 -169.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.46 -47.84 83.93 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.895 0.878 . . . . 3.4100000000000001 111.479 170.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.419 ' HZ2' ' HB2' ' B' ' 18' ' ' LYS . 3.7 ttmp? -73.19 -40.61 64.63 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.667 0.988 . . . . 4.6299999999999999 113.667 -171.222 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -70.67 -26.07 63.27 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.047 -0.978 . . . . 3.5800000000000001 112.187 166.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 32.3 m -68.19 -40.54 82.19 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 120.702 1.592 . . . . 2.2799999999999998 113.118 167.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.59 -12.88 83.78 Favored Glycine 0 CA--C 1.532 1.153 0 C-N-CA 125.769 1.652 . . . . 1.78 112.9 -178.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.06 97.83 0.53 Allowed 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 105.832 -1.914 . . . . 5.4800000000000004 105.832 153.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 65.17 175.45 0.21 Allowed 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 126.175 1.79 . . . . 5.4400000000000004 114.655 167.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.66 -140.03 30.56 Favored Glycine 0 N--CA 1.474 1.231 0 C-N-CA 125.919 1.723 . . . . 2.6800000000000002 113.036 174.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 67.6 m -78.36 162.42 26.47 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.517 -0.99 . . . . 3.9700000000000002 112.553 171.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 19.2 ttmt -85.65 128.24 34.72 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 127.187 2.195 . . . . 7.7699999999999996 107.363 156.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.0 tt 91.59 -24.66 0.06 Allowed 'General case' 0 N--CA 1.492 1.625 0 C-N-CA 128.819 2.848 . . . . 4.6200000000000001 112.321 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.55 137.1 47.06 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 125.287 1.435 . . . . 2.5099999999999998 109.623 170.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 75.7 mt -98.29 98.39 9.65 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.928 1.291 . . . . 2.5499999999999998 110.627 175.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 3.6 m -52.43 153.56 2.93 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 122.102 0.953 . . . . 2.8900000000000001 112.493 163.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 19.1 ttp85 -48.52 -39.55 23.7 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.893 1.277 . . . . 4.3099999999999996 114.162 -172.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -68.59 -40.72 80.37 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 119.58 -1.95 . . . . 7.0700000000000003 111.7 178.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -53.77 -51.13 64.39 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.638 1.575 . . . . 1.76 109.245 177.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 15.0 tp -64.77 -45.61 85.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.477 1.111 . . . . 3.0099999999999998 112.657 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 2.1 tmpt? -58.17 -34.31 70.18 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 118.883 0.765 . . . . 5.9900000000000002 111.711 175.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -68.64 -54.54 15.75 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.624 0.769 . . . . 4.4000000000000004 111.676 172.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.43 -52.74 64.17 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 126.16 1.784 . . . . 3.2200000000000002 112.294 -176.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 29.0 mt -59.72 -44.44 93.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 119.338 0.972 . . . . 2.3700000000000001 110.092 178.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.446 ' HZ1' ' CD ' ' B' ' 49' ' ' GLU . 13.8 tppt? -66.65 -11.79 55.36 Favored 'General case' 0 CA--C 1.557 1.23 0 O-C-N 121.512 -0.743 . . . . 5.8200000000000003 112.488 178.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmtm -105.46 -35.59 7.43 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.796 2.038 . . . . 6.1399999999999997 114.591 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -69.71 -63.26 1.11 Allowed 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 124.8 1.24 . . . . 5.04 109.668 170.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -86.32 56.83 4.16 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.022 0.929 . . . . 3.2799999999999998 108.976 179.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 4.8 t -70.09 24.78 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 125.588 1.555 . . . . 3.7799999999999998 114.868 -173.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 38.6 mt -77.41 -3.86 42.41 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 128.746 2.818 . . . . 4.4199999999999999 113.516 -177.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.14 -49.24 4.19 Favored Glycine 0 N--CA 1.47 0.945 0 C-N-CA 125.042 1.306 . . . . 4.75 112.692 179.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -60.48 -10.16 4.61 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.583 1.553 . . . . 5.46 114.381 176.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 8.0 tpt -71.31 69.05 0.54 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.106 1.762 . . . . 2.5699999999999998 111.203 170.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -88.94 153.41 21.05 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.656 1.982 . . . . 4.46 112.845 -166.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.446 ' CD ' ' HZ1' ' B' ' 39' ' ' LYS . 5.3 mp0 -49.64 -57.32 7.42 Favored 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 127.12 2.168 . . . . 4.25 112.096 -165.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 12.0 m -73.12 -0.21 13.45 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.317 1.599 . . . . 3.2599999999999998 115.317 -179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 15.7 t -97.27 -33.39 11.47 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.437 1.095 . . . . 3.2400000000000002 111.451 164.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 38.8 mt -58.81 -35.33 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 124.677 1.191 . . . . 2.5899999999999999 110.015 166.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -61.66 -25.04 67.14 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.515 1.126 . . . . 3.8399999999999999 113.829 170.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.5 ' HA ' ' HE2' ' B' ' 57' ' ' LYS . 7.8 t70 -89.93 -32.95 16.6 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 121.021 1.737 . . . . 4.1799999999999997 113.051 173.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -52.0 -41.72 62.41 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 118.646 -0.693 . . . . 3.5699999999999998 109.42 158.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -53.49 52.56 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 120.139 1.336 . . . . 3.04 111.55 175.389 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . 0.5 ' HE2' ' HA ' ' B' ' 54' ' ' ASP . 30.0 mtmm -51.1 -44.1 61.21 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 118.988 0.813 . . . . 4.3499999999999996 112.9 176.119 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 38.9 m -76.06 -40.39 53.37 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.895 1.278 . . . . 2.5099999999999998 113.279 -176.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 9.6 mp -71.36 -35.8 71.26 Favored 'General case' 0 C--O 1.225 -0.194 0 O-C-N 120.959 -1.088 . . . . 3.4300000000000002 111.808 178.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -100.11 98.49 9.2 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 119.612 1.096 . . . . 1.4299999999999999 113.897 -163.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -98.14 -14.8 20.22 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.933 1.693 . . . . 4.0599999999999996 115.278 -176.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.88 -21.27 60.15 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 119.448 1.022 . . . . 2.8300000000000001 110.303 152.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 50.6 m 60.78 66.69 0.89 Allowed 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.04 1.736 . . . . 4.8399999999999999 111.165 168.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -147.3 -116.49 0.07 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.665 1.586 . . . . 3.5600000000000001 109.5 -148.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -149.74 -5.18 0.36 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 116.57 2.063 . . . . 4.54 116.57 169.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -115.37 139.13 50.27 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.89 1.276 . . . . 2.46 111.527 167.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 8.0 mm -94.27 110.78 24.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 126.24 1.816 . . . . 2.1699999999999999 109.858 172.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -58.22 156.26 10.1 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.593 1.157 . . . . 3.3999999999999999 110.705 166.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.99 -39.52 66.1 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.164 -1.585 . . . . 3.5499999999999998 111.525 169.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -76.59 -18.07 58.84 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.751 1.389 . . . . 4.9400000000000004 114.751 178.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -73.97 -50.33 20.46 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 108.322 -0.992 . . . . 1.8799999999999999 108.322 163.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -61.1 -26.28 67.56 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 128.814 2.845 . . . . 2.9500000000000002 115.338 -177.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 68.6 m -47.91 -34.55 9.17 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 120.851 -1.156 . . . . 2.5499999999999998 113.441 172.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 6.6 m -69.22 -22.45 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 O-C-N 121.208 -0.933 . . . . 3.8100000000000001 113.155 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -64.97 -59.54 4.05 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.101 0.96 . . . . 2.8300000000000001 110.031 175.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 58.6 mt -55.19 -37.65 67.34 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.792 0.837 . . . . 2.54 110.839 176.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 30.8 m -57.95 -61.84 2.25 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.619 1.168 . . . . 2.02 111.677 173.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 24.3 ptp -68.08 -32.21 72.37 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 118.949 0.795 . . . . 3.1400000000000001 112.848 -174.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -46.02 81.22 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.923 0.889 . . . . 4.2800000000000002 110.529 175.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.6 t -69.9 -27.67 64.98 Favored 'General case' 0 CA--C 1.545 0.786 0 O-C-N 121.736 -0.602 . . . . 3.1200000000000001 112.5 175.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 61.6 mtp -67.19 -40.38 86.53 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.837 -1.164 . . . . 2.7999999999999998 112.768 168.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.81 -37.3 78.76 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.566 1.076 . . . . 1.6000000000000001 111.397 172.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 5.0 m-30 -65.7 -24.16 66.93 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.955 1.094 . . . . 3.3799999999999999 113.955 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -70.28 -41.3 73.59 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 119.82 1.191 . . . . 3.2999999999999998 111.866 174.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -65.61 -44.56 86.19 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.375 1.07 . . . . 3.3199999999999998 110.519 176.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.82 -47.05 77.88 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.14 1.776 . . . . 3.1099999999999999 111.884 174.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -63.66 -21.37 66.34 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.192 1.397 . . . . 3.9500000000000002 112.382 175.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 85.5 mt -88.27 -7.19 57.16 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 114.305 1.224 . . . . 2.7000000000000002 114.305 176.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -70.18 -35.2 73.79 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.171 0.896 . . . . 5.1399999999999997 111.779 161.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -100.75 -65.34 0.97 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.538 1.935 . . . . 3.54 112.681 -168.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -79.91 34.36 0.29 Allowed 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 125.594 1.558 . . . . 3.9100000000000001 112.501 175.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.875 0 C-N-CA 131.521 3.928 . . . . 7.4500000000000002 117.518 -172.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.407 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 5.9 ptt? . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 108.569 -0.9 . . . . 8.6699999999999999 108.569 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.407 ' OE1' ' HA ' ' A' ' 1' ' ' MET . 16.5 mp0 -110.67 -93.92 0.43 Allowed 'General case' 0 CA--C 1.537 0.445 0 O-C-N 124.907 1.379 . . . . 3.75 108.633 -153.018 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.2 p -153.26 179.61 1.25 Allowed Pre-proline 0 N--CA 1.478 0.965 0 C-N-CA 127.03 2.132 . . . . 2.3599999999999999 109.123 169.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -76.9 -9.31 18.12 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 121.471 1.447 . . . . 1.6399999999999999 113.7 171.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -76.92 -49.63 15.15 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.022 1.329 . . . . 3.8100000000000001 112.67 -178.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -56.66 -34.96 67.86 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.574 1.079 . . . . 4.5 110.876 169.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.7 mtpm? -73.24 -26.65 61.21 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.575 -1.328 . . . . 5.7000000000000002 113.415 173.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.0 -49.99 39.11 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.756 1.222 . . . . 2.5099999999999998 109.921 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.3 mt -56.16 -45.49 79.65 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.319 1.048 . . . . 2.8500000000000001 111.258 171.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.4 m -54.42 -53.34 55.48 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.091 0.956 . . . . 2.77 111.736 171.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 t -67.39 -32.76 73.9 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 120.094 1.315 . . . . 3.5099999999999998 112.172 -178.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 95.4 mtp -59.0 -51.65 69.16 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.412 1.085 . . . . 3.8100000000000001 112.452 169.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.2 m -68.82 -28.55 40.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 CA-C-N 119.153 0.888 . . . . 3.3199999999999998 112.745 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 90.9 m -60.84 -57.02 14.41 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.88 1.272 . . . . 2.0800000000000001 110.089 173.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -57.94 -40.06 79.59 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 122.789 0.436 . . . . 3.0 110.736 172.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -64.14 -47.86 78.29 Favored 'General case' 0 C--N 1.334 -0.077 0 C-N-CA 119.901 -0.719 . . . . 3.0099999999999998 112.078 -171.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -40.67 74.57 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.881 1.218 . . . . 2.8799999999999999 111.759 178.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -58.37 -47.33 84.17 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.684 1.993 . . . . 4.3499999999999996 113.427 178.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -70.78 -37.38 73.33 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.827 0.851 . . . . 3.5099999999999998 112.481 168.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.3 m -64.22 -20.59 66.13 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.816 -1.178 . . . . 2.7599999999999998 113.771 178.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -98.33 40.35 2.51 Favored Glycine 0 CA--C 1.533 1.186 0 C-N-CA 127.501 2.477 . . . . 1.99 113.11 171.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.1 mmp_? -105.08 -17.89 14.34 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.275 1.03 . . . . 5.6900000000000004 113.169 167.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.497 ' CD ' ' HZ3' ' A' ' 32' ' ' LYS . 28.2 tt0 -175.03 172.41 2.84 Favored 'General case' 0 C--O 1.248 0.984 0 C-N-CA 127.172 2.189 . . . . 4.7000000000000002 110.737 -173.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.57 -135.48 50.57 Favored Glycine 0 C--N 1.337 0.629 0 C-N-CA 124.915 1.245 . . . . 2.4199999999999999 111.726 171.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.1 m -84.89 164.46 18.38 Favored 'General case' 0 C--O 1.246 0.872 0 CA-C-O 121.494 0.664 . . . . 2.98 112.079 163.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -84.64 156.31 21.6 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.18 0.992 . . . . 5.7699999999999996 110.224 157.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.2 tp 73.15 -2.74 2.64 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.745 2.018 . . . . 4.8099999999999996 112.392 -159.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 61.3 p -138.89 150.41 45.93 Favored 'General case' 0 C--O 1.253 1.272 0 C-N-CA 125.342 1.457 . . . . 1.8899999999999999 113.798 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.1 mt -114.87 109.79 18.68 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.711 2.004 . . . . 2.6699999999999999 111.631 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.9 t -84.42 173.76 10.63 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.042 1.337 . . . . 2.7799999999999998 112.042 167.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -51.36 -41.72 60.83 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 114.724 1.379 . . . . 4.5999999999999996 114.724 -163.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.497 ' HZ3' ' CD ' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -82.68 -28.94 30.27 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 120.332 1.424 . . . . 4.2400000000000002 113.414 178.545 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -56.45 -46.09 80.5 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.281 0.946 . . . . 1.7 109.81 166.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -73.09 -41.86 63.61 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.124 0.97 . . . . 3.6499999999999999 111.016 -173.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.74 -41.16 77.04 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.253 -0.905 . . . . 7.5700000000000003 113.28 167.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -70.61 -31.43 68.41 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.943 0.72 . . . . 3.2599999999999998 112.943 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 tt -64.75 -63.48 1.11 Allowed 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.47 -0.937 . . . . 3.46 108.47 174.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.7 mt -56.28 -56.72 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-N 119.044 0.838 . . . . 2.2400000000000002 112.305 -172.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 mmmm -79.26 4.22 15.67 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.496 1.295 . . . . 5.9400000000000004 114.496 -171.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -112.37 -36.5 5.26 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 117.718 -1.134 . . . . 4.0899999999999999 113.656 166.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -66.27 -34.15 77.35 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.104 1.361 . . . . 3.9399999999999999 112.81 172.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -105.82 108.72 20.38 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 107.974 -1.121 . . . . 3.73 107.974 168.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 28.2 p -80.13 51.99 1.47 Allowed 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.101 0.96 . . . . 4.7699999999999996 113.227 -178.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.5 mp -111.11 153.51 25.59 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.773 2.029 . . . . 4.54 112.722 -170.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -82.91 -17.95 66.44 Favored Glycine 0 CA--C 1.536 1.355 0 O-C-N 121.219 -0.926 . . . . 4.54 112.59 166.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -79.34 -157.18 0.12 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 129.561 3.144 . . . . 5.9000000000000004 111.024 178.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.8 tpt 55.86 22.01 5.29 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 123.494 1.616 . . . . 3.1800000000000002 113.589 -178.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.6 tttm -72.03 154.44 41.13 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 113.732 -1.576 . . . . 6.6100000000000003 114.136 -141.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.423 ' CD ' ' H ' ' A' ' 49' ' ' GLU . 21.7 mp0 -66.02 -22.17 66.43 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 116.058 1.873 . . . . 5.5999999999999996 116.058 -134.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.7 t -67.09 -15.23 63.59 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.3 -1.5 . . . . 2.6200000000000001 113.783 171.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.7 t -82.98 -12.23 57.46 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.667 1.187 . . . . 3.8700000000000001 113.4 170.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 18.0 mm -74.87 -35.05 34.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 124.568 1.147 . . . . 3.0499999999999998 110.924 -176.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.92 -33.23 75.23 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.661 1.584 . . . . 3.0600000000000001 110.899 176.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -75.23 -47.39 28.35 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-O 118.397 -0.811 . . . . 2.4199999999999999 111.79 165.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.23 -45.12 68.58 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.581 1.082 . . . . 3.6699999999999999 110.87 -172.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.6 ppp? -62.88 -48.67 77.97 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 122.149 -0.344 . . . . 2.5899999999999999 111.701 175.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -18.95 47.81 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.406 2.282 . . . . 5.04 114.342 173.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.9 m -94.98 -27.63 15.55 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 127.411 2.284 . . . . 3.6800000000000002 112.934 177.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 96.9 mt -76.91 -33.46 57.75 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.366 1.066 . . . . 2.9100000000000001 112.002 165.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -73.35 68.65 1.09 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.985 2.114 . . . . 1.78 112.582 -173.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.1 tttt -54.29 -23.84 16.68 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 127.97 2.508 . . . . 5.46 114.009 -175.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -85.06 -23.13 28.69 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.472 1.286 . . . . 2.9900000000000002 114.472 173.057 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.3 t 57.73 63.75 1.73 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.043 1.337 . . . . 3.21 112.432 -167.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -120.12 -108.75 0.35 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.427 2.291 . . . . 2.7400000000000002 109.338 -172.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -142.45 -19.9 0.69 Allowed 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 115.231 1.567 . . . . 6.1299999999999999 115.231 167.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -132.7 145.5 51.1 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 122.599 1.19 . . . . 2.6499999999999999 110.815 -169.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 8.8 mm -86.88 113.48 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 125.713 1.605 . . . . 2.1099999999999999 107.666 174.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.34 174.12 11.92 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.767 0.827 . . . . 3.0899999999999999 111.702 167.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -54.5 -38.24 66.25 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-O 122.564 1.173 . . . . 3.4300000000000002 112.163 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -78.45 -22.06 48.17 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.107 2.163 . . . . 3.79 113.577 -173.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -79.01 -54.11 6.35 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.213 1.805 . . . . 1.72 109.005 161.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -53.7 -37.72 63.55 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 128.122 2.569 . . . . 3.7000000000000002 115.005 -173.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -20.23 56.7 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 120.988 -1.07 . . . . 2.5299999999999998 113.755 174.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 53.3 t -70.13 -28.24 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 120.875 -1.141 . . . . 2.8900000000000001 110.973 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -64.58 -53.56 45.93 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.369 -0.832 . . . . 3.1800000000000002 110.928 171.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -54.64 -45.79 73.84 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.427 1.091 . . . . 3.2799999999999998 110.548 177.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 88.1 m -53.6 -49.28 68.12 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.373 1.069 . . . . 1.8100000000000001 112.263 176.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 50.4 mtm -62.18 -47.48 84.29 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 118.684 0.675 . . . . 2.3199999999999998 112.596 178.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.8 mt -65.56 -36.75 84.7 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.737 -0.602 . . . . 2.52 112.125 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 4.3 t -68.44 -32.34 72.3 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 118.467 -0.777 . . . . 2.3799999999999999 112.477 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -47.72 85.12 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 118.855 0.752 . . . . 4.8099999999999996 110.921 171.185 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.26 -38.02 89.04 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.196 0.907 . . . . 2.3399999999999999 113.086 -175.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -68.68 -29.93 68.5 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.134 0.79 . . . . 3.8500000000000001 113.134 174.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -73.79 -44.27 56.45 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.943 0.792 . . . . 2.3799999999999999 111.669 171.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -72.44 -16.7 61.82 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.435 1.094 . . . . 4.4900000000000002 111.664 -173.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -50.91 -57.83 7.52 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.624 1.97 . . . . 4.1299999999999999 111.682 166.037 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -55.18 -28.9 56.22 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.973 0.909 . . . . 5.04 112.584 176.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 71.6 mt -83.39 -18.47 38.69 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.782 0.833 . . . . 2.6400000000000001 111.324 -172.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -90.4 -15.32 31.22 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.905 1.446 . . . . 3.7999999999999998 114.905 164.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -77.15 -29.2 54.47 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.607 1.163 . . . . 3.4700000000000002 111.818 163.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -85.95 56.89 4.18 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.711 2.005 . . . . 5.2800000000000002 112.64 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm . . . . . 0 C--O 1.25 1.118 0 C-N-CA 128.548 2.739 . . . . 4.9400000000000004 114.037 172.05 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.479 1.007 0 N-CA-C 107.927 -1.138 . . . . 6.2400000000000002 107.927 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -69.57 170.06 11.42 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 126.459 1.904 . . . . 6.0899999999999999 109.663 168.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 71.6 p -71.03 159.62 85.02 Favored Pre-proline 0 N--CA 1.476 0.854 0 O-C-N 121.984 -0.447 . . . . 2.5600000000000001 111.52 177.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -62.46 -20.06 69.36 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.005 1.803 . . . . 1.52 112.738 174.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -83.13 -41.72 18.19 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.736 1.215 . . . . 4.1900000000000004 111.949 174.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -58.29 -31.88 67.9 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.606 1.094 . . . . 3.6099999999999999 110.923 164.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.81 -30.46 62.73 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.106 -1.621 . . . . 4.9699999999999998 112.921 172.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.16 -43.35 92.08 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.206 -0.934 . . . . 1.78 111.027 168.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 81.6 mt -61.36 -44.77 96.6 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.429 1.091 . . . . 2.5499999999999998 111.84 169.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 85.7 m -53.43 -47.2 69.84 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.73 1.212 . . . . 2.9900000000000002 110.543 174.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 27.3 m -59.42 -52.5 65.36 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.041 0.937 . . . . 2.1600000000000001 109.326 174.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 4.3 tpp -50.13 -53.56 26.71 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.943 1.697 . . . . 4.5199999999999996 112.299 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 21.2 m -70.99 -21.27 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 112.706 0.632 . . . . 3.7000000000000002 112.706 -175.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 61.5 m -83.42 -45.29 13.84 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.034 1.333 . . . . 1.8899999999999999 111.283 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -54.61 -41.08 69.52 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.497 -0.557 . . . . 2.1299999999999999 109.497 164.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -71.75 -35.22 70.05 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 120.326 -0.55 . . . . 3.5800000000000001 111.662 -176.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -64.42 -51.12 64.74 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 120.444 -1.41 . . . . 3.1299999999999999 112.095 170.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -55.93 -51.84 66.23 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.924 0.889 . . . . 7.0300000000000002 111.788 177.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -83.43 -34.99 25.35 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 117.372 -1.299 . . . . 3.0899999999999999 112.504 -172.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 60.2 p -68.39 -28.68 67.31 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 121.351 1.887 . . . . 2.4500000000000002 111.733 174.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.27 17.37 5.08 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 125.81 1.671 . . . . 1.7 114.516 170.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 5.6 mmp_? -92.45 62.88 4.03 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 120.372 2.086 . . . . 7.6399999999999997 109.608 166.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 71.2 -177.91 0.21 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.195 1.398 . . . . 4.3300000000000001 112.123 -175.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.72 -146.0 50.14 Favored Glycine 0 CA--C 1.53 0.988 0 N-CA-C 109.829 -1.309 . . . . 2.8199999999999998 109.829 -156.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 73.3 m -78.67 153.97 30.54 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.277 -1.131 . . . . 3.7799999999999998 111.405 161.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 15.4 ttpt -68.24 55.81 0.07 Allowed 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 125.344 1.458 . . . . 8.4399999999999995 111.153 160.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -170.88 -31.99 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 126.42 1.888 . . . . 4.4299999999999997 111.658 -165.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 20.7 p -119.34 151.58 38.22 Favored 'General case' 0 C--O 1.242 0.694 0 C-N-CA 125.764 1.626 . . . . 1.8400000000000001 113.422 -175.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 87.4 mt -114.53 119.44 36.82 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.274 2.23 . . . . 2.8900000000000001 112.243 178.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 4.8 t -104.18 179.22 4.34 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 113.506 0.928 . . . . 3.79 113.506 162.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 31.0 ttp180 -56.16 -36.02 67.84 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.71 1.744 . . . . 4.6200000000000001 115.71 -161.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -29.04 64.0 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 120.457 -1.402 . . . . 6.0700000000000003 113.452 173.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -72.22 -51.68 19.93 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 108.006 -1.109 . . . . 2.1000000000000001 108.006 177.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 mt -67.71 -33.15 74.33 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-O 117.475 -1.25 . . . . 3.6499999999999999 113.884 176.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.7 ttmt -53.13 -48.63 67.75 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 120.816 1.644 . . . . 4.1299999999999999 111.788 170.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -66.38 -45.54 79.7 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.378 0.881 . . . . 3.8599999999999999 113.378 176.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 55.1 tp -74.05 -45.24 50.72 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 117.682 -1.152 . . . . 3.2400000000000002 112.572 -175.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 28.6 mt -57.25 -52.43 56.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 CA-C-N 121.041 1.746 . . . . 2.1400000000000001 107.999 176.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . 0.344 0.0 OUTLIER -70.49 8.46 0.82 Allowed 'General case' 0 CA--C 1.558 1.268 0 CA-C-O 122.022 0.915 . . . . 6.5300000000000002 113.106 -178.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 10.1 mmtm -118.99 -29.6 5.23 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 127.158 2.183 . . . . 6.7599999999999998 115.696 170.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -67.86 -29.73 68.94 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.964 1.256 . . . . 5.6100000000000003 109.706 160.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -111.49 63.86 0.62 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 126.391 1.877 . . . . 3.4900000000000002 109.015 170.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.9 t -62.72 -33.69 75.64 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 120.443 -1.411 . . . . 4.3099999999999996 111.945 -178.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -90.49 -5.0 56.57 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.022 1.729 . . . . 5.04 114.996 172.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -103.79 10.98 52.97 Favored Glycine 0 N--CA 1.475 1.296 0 CA-C-O 118.401 -1.222 . . . . 4.0599999999999996 115.915 -162.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 70.87 -83.52 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.339 1.855 . . . . 6.3099999999999996 112.663 169.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 1.1 mmt 70.71 87.91 0.11 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 128.455 2.702 . . . . 3.3599999999999999 113.309 -168.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 mttp -61.59 133.61 55.85 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.655 -1.278 . . . . 4.3600000000000003 110.951 166.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -36.06 -56.89 0.72 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 127.12 2.168 . . . . 3.7999999999999998 114.998 -177.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 29.3 t -67.28 -15.01 63.44 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.389 1.255 . . . . 3.6299999999999999 114.389 -176.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 10.5 t -85.43 -12.51 51.82 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.405 1.002 . . . . 3.0699999999999998 112.796 171.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 71.3 mt -77.74 -37.53 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 CA-C-N 119.316 0.962 . . . . 4.0499999999999998 109.871 179.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -70.79 -39.93 72.85 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.718 1.207 . . . . 2.9100000000000001 113.108 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -68.77 -40.25 79.8 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 118.489 0.586 . . . . 2.9900000000000002 111.4 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 25.4 tp -59.23 -48.42 81.68 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 117.429 -1.272 . . . . 3.1000000000000001 110.437 172.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 58.0 mmm -50.18 -48.83 53.86 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 120.158 1.344 . . . . 2.6899999999999999 111.823 173.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -16.82 48.83 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.107 1.763 . . . . 5.1699999999999999 113.994 175.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.13 -31.9 12.23 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.399 1.48 . . . . 2.6000000000000001 113.659 171.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 13.1 mt -76.21 -24.13 54.65 Favored 'General case' 0 N--CA 1.463 0.186 0 O-C-N 120.933 -1.104 . . . . 2.8399999999999999 111.56 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -94.04 149.05 21.58 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.504 1.122 . . . . 1.98 113.664 168.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -99.78 -11.76 20.53 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.734 1.614 . . . . 4.5199999999999996 113.169 172.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.63 -62.79 1.53 Allowed 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.342 0.868 . . . . 2.5600000000000001 113.342 -157.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 58.6 m 109.98 12.57 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.116 1 C-N-CA 132.332 4.253 . . . . 3.54 111.667 -157.146 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 48.0 p-10 -83.82 8.18 15.62 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 119.377 -2.077 . . . . 2.71 112.289 -165.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 55.18 2.05 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 130.564 3.546 . . . . 4.3300000000000001 115.923 -166.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -131.88 121.14 23.57 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 125.499 1.52 . . . . 2.8100000000000001 111.342 -168.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 2.8 mp -93.06 103.84 15.1 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.398 1.479 . . . . 3.0699999999999998 107.736 177.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.24 160.18 32.65 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.268 1.427 . . . . 3.3599999999999999 111.517 169.51 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -47.69 -46.93 29.89 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.579 1.551 . . . . 3.6400000000000001 112.512 -179.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -69.2 -17.45 63.8 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.817 0.847 . . . . 5.4100000000000001 112.776 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -84.44 -51.96 6.53 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.592 1.157 . . . . 2.1899999999999999 109.966 170.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -53.13 -25.81 14.54 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.89 2.476 . . . . 2.8100000000000001 114.14 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.27 -20.17 65.22 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.776 -1.202 . . . . 2.5499999999999998 111.426 177.53 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.3 p -70.45 -31.32 46.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 O-C-N 120.79 -1.194 . . . . 3.2999999999999998 112.252 172.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -63.36 -56.16 18.61 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 108.682 -0.858 . . . . 2.8300000000000001 108.682 174.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 96.2 mt -53.88 -39.56 65.81 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.832 1.253 . . . . 2.3500000000000001 112.385 175.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 97.8 m -62.16 -53.58 53.28 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.294 1.038 . . . . 1.9299999999999999 111.862 176.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 19.7 ptp -68.82 -32.87 72.88 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 118.604 0.638 . . . . 3.27 112.64 -177.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -65.64 -49.69 67.77 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.043 0.937 . . . . 3.6800000000000002 112.277 170.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 12.8 t -65.45 -32.0 73.38 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.035 0.383 . . . . 3.02 112.035 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -45.9 92.84 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.837 0.744 . . . . 3.7400000000000002 112.255 167.034 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.02 -40.73 94.68 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.176 0.898 . . . . 1.72 111.89 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -60.95 -24.8 66.35 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.431 1.271 . . . . 3.2999999999999998 114.431 176.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -70.03 -42.55 72.8 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.636 1.107 . . . . 2.71 111.909 174.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -69.8 -41.3 75.23 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.959 0.904 . . . . 3.02 110.315 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -51.45 -53.09 40.62 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.581 1.552 . . . . 3.3100000000000001 110.9 169.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -61.96 -24.25 66.89 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.54 1.536 . . . . 4.3600000000000003 113.705 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 47.0 mt -79.7 -23.44 42.4 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.529 -1.357 . . . . 2.7400000000000002 112.456 174.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.529 ' CD ' ' HZ2' ' B' ' 92' ' ' LYS . 29.2 mm-40 -94.55 -6.69 43.09 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.74 1.385 . . . . 4.04 114.74 170.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -86.38 -37.57 18.28 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 127.35 2.26 . . . . 3.7400000000000002 113.488 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -82.33 49.55 1.45 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.193 1.797 . . . . 3.8399999999999999 113.244 -167.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . 0.529 ' HZ2' ' CD ' ' B' ' 89' ' ' GLU . 1.1 mptm? . . . . . 0 C--O 1.252 1.219 0 C-N-CA 128.095 2.558 . . . . 7.71 114.334 178.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.478 0.958 0 CA-C-O 117.242 -1.361 . . . . 7.5599999999999996 110.226 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 46.62 -120.51 1.04 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.769 2.028 . . . . 3.75 112.821 167.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 66.2 p -153.17 162.43 26.47 Favored Pre-proline 0 N--CA 1.472 0.665 0 C-N-CA 124.893 1.277 . . . . 3.0 111.61 -161.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -64.5 -11.75 30.06 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 122.426 2.084 . . . . 1.8 113.128 166.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.91 -38.05 15.94 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.104 1.362 . . . . 3.4300000000000002 111.471 178.29 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -55.44 -50.5 69.67 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 108.961 -0.755 . . . . 4.8499999999999996 108.961 159.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.43 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -59.18 -31.08 68.68 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.665 -0.647 . . . . 4.7599999999999998 112.6 177.063 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.34 -53.69 39.95 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.429 0.692 . . . . 2.1699999999999999 110.861 172.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 44.8 mt -54.77 -44.75 73.95 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.058 0.943 . . . . 3.1299999999999999 112.234 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.8 p -69.37 -36.87 77.25 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 117.844 -1.074 . . . . 3.48 112.447 176.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.4 m -62.32 -39.92 94.62 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 120.292 1.405 . . . . 2.0699999999999998 111.564 171.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 72.8 mtp -60.59 -51.92 67.37 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.067 0.947 . . . . 4.21 112.173 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.3 p -63.46 -34.37 67.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 CA-C-N 118.692 0.678 . . . . 3.5899999999999999 111.506 173.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 85.3 m -61.74 -53.71 52.31 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 117.923 -1.037 . . . . 1.8600000000000001 111.067 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.5 p -55.97 -43.29 77.43 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.036 0.835 . . . . 2.9500000000000002 109.559 172.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -64.64 -54.63 28.84 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.302 0.376 . . . . 3.0299999999999998 111.51 -169.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.7 -32.65 73.45 Favored 'General case' 0 CA--C 1.548 0.869 0 O-C-N 121.544 -0.723 . . . . 2.75 111.831 179.221 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -76.81 -12.87 60.04 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.453 1.279 . . . . 4.96 114.453 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -92.43 -33.24 14.61 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 119.527 1.058 . . . . 3.8799999999999999 112.56 155.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.8 p -42.76 -48.3 5.6 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 117.389 2.366 . . . . 4.7699999999999996 117.389 -163.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -88.01 4.82 85.49 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 125.393 1.473 . . . . 1.95 114.319 -173.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 35.3 mtp180 -92.6 50.26 1.57 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.663 1.232 . . . . 6.8700000000000001 108.957 175.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.429 ' CD ' ' HZ3' ' A' ' 32' ' ' LYS . 19.7 tt0 115.34 151.76 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.877 1 C-N-CA 131.832 4.053 . . . . 4.4000000000000004 111.455 -177.928 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.86 -159.99 48.51 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 120.752 -1.218 . . . . 2.8300000000000001 113.391 -179.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.4 t -75.22 161.91 28.93 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.885 -0.773 . . . . 4.3499999999999996 111.981 172.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.0 mmtp -49.96 -24.92 2.84 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.279 1.432 . . . . 5.2800000000000002 112.404 155.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 18.9 tp -93.47 -13.64 27.65 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 117.35 -1.309 . . . . 4.7800000000000002 114.095 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 53.7 p -128.04 145.04 51.11 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-N 120.714 1.597 . . . . 2.1800000000000002 114.983 -168.012 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.8 mt -101.19 120.44 40.23 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.772 1.629 . . . . 2.6600000000000001 111.876 170.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.4 p -78.37 171.81 14.53 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.961 1.467 . . . . 3.5800000000000001 114.961 -177.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -45.43 -27.6 0.73 Allowed 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 115.021 1.489 . . . . 4.3499999999999996 115.021 167.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.429 ' HZ3' ' CD ' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -104.93 -38.97 6.43 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.863 1.265 . . . . 4.4400000000000004 113.148 -178.593 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -67.63 -30.06 69.53 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.062 1.345 . . . . 3.6299999999999999 111.584 175.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.2 tp -75.33 -47.97 25.3 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.097 0.959 . . . . 2.8999999999999999 112.417 173.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -15.2 57.59 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.95 1.463 . . . . 5.8700000000000001 114.95 -172.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -94.87 -39.23 10.34 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.951 1.093 . . . . 4.6299999999999999 113.951 175.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 39.6 tp -58.33 -50.78 72.43 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.469 1.031 . . . . 3.5499999999999998 111.558 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.1 mt -52.51 -57.09 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-O 121.628 0.728 . . . . 2.0099999999999998 109.081 175.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.406 ' HE2' ' OE1' ' A' ' 49' ' ' GLU . 25.9 ttpp -67.11 -8.3 29.71 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.254 1.205 . . . . 4.7400000000000002 114.254 -176.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.9 mmtm -95.27 -33.43 12.57 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 125.358 1.463 . . . . 4.79 112.212 172.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.421 ' C ' ' H ' ' A' ' 43' ' ' CYS . 40.1 tt0 -68.61 -66.96 0.51 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.086 1.754 . . . . 4.9500000000000002 110.045 169.465 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -70.52 22.54 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 126.667 1.987 . . . . 3.79 113.667 176.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.421 ' H ' ' C ' ' A' ' 41' ' ' GLU . 12.9 t -67.36 2.27 1.78 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.708 2.003 . . . . 3.4399999999999999 113.951 177.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -68.96 -10.99 60.23 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.638 0.775 . . . . 5.0999999999999996 112.639 167.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 145.38 13.08 0.22 Allowed Glycine 0 CA--C 1.528 0.889 0 CA-C-O 117.909 -1.495 . . . . 4.2000000000000002 116.709 169.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -124.49 -175.13 3.18 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.674 1.737 . . . . 5.0700000000000003 113.282 -176.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 63.35 33.84 13.59 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-O 123.552 1.644 . . . . 2.48 113.686 169.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -59.77 151.75 24.61 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 113.359 -1.746 . . . . 5.9299999999999997 110.429 166.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.406 ' OE1' ' HE2' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -44.31 -44.12 7.9 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.941 1.46 . . . . 4.3799999999999999 114.941 -165.93 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.0 t -63.73 -15.57 58.89 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 115.061 1.504 . . . . 3.3799999999999999 115.061 -178.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 43.4 m -90.02 -7.8 53.08 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.371 0.987 . . . . 2.5899999999999999 113.091 172.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 45.2 mt -88.25 -35.75 8.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 117.745 -1.122 . . . . 2.75 113.326 -166.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.87 -25.75 64.78 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.427 1.467 . . . . 2.6699999999999999 113.197 -176.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.55 -44.09 71.61 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.899 0.772 . . . . 3.3999999999999999 111.169 164.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 tp -62.54 -43.49 98.68 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 118.611 -0.709 . . . . 3.1499999999999999 109.922 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.5 tpt -53.93 -53.96 45.49 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 125.914 1.686 . . . . 2.3799999999999999 110.791 170.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.83 -35.67 64.19 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.008 1.323 . . . . 5.0899999999999999 113.147 176.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 61.3 m -86.69 -33.3 20.09 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 126.15 1.78 . . . . 2.5899999999999999 111.964 -173.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -69.57 -42.78 74.07 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 126.776 2.03 . . . . 3.5299999999999998 112.015 169.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -74.72 63.09 1.11 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 123.384 1.564 . . . . 1.51 110.77 -176.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -69.84 -4.95 22.5 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.83 1.252 . . . . 6.21 113.427 -164.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -110.5 -5.69 15.08 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.85 2.46 . . . . 3.2200000000000002 113.785 171.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 37.7 t 58.69 64.55 1.41 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.074 1.35 . . . . 3.3900000000000001 112.797 172.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.45 ' CG ' ' H ' ' A' ' 65' ' ' GLN . 5.0 p-10 -115.07 -88.97 0.56 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.384 1.473 . . . . 2.8100000000000001 108.67 176.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.45 ' H ' ' CG ' ' A' ' 64' ' ' ASP . 20.6 pt20 -173.19 -26.32 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.746 2.419 . . . . 6.1799999999999997 114.724 -176.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -124.78 163.22 22.6 Favored 'General case' 0 C--O 1.243 0.729 0 CA-C-O 123.249 1.5 . . . . 3.1000000000000001 111.944 175.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.6 mm -104.95 100.08 9.8 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.882 2.473 . . . . 2.2400000000000002 110.401 -178.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -66.16 163.13 18.31 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.538 0.735 . . . . 3.7999999999999998 111.636 167.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -47.13 -42.32 19.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.603 0.761 . . . . 3.25 112.882 -178.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 -30.39 67.03 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 120.895 -1.128 . . . . 8.5700000000000003 112.649 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -68.3 -54.36 18.02 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 107.855 -1.165 . . . . 1.96 107.855 171.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -51.2 -37.34 46.13 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.864 2.066 . . . . 3.7999999999999998 114.401 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.0 p -66.17 -14.89 62.6 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 120.307 -1.496 . . . . 2.8599999999999999 114.647 173.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 44.7 t -71.82 -33.02 46.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 CA-C-N 120.441 1.473 . . . . 3.2799999999999998 111.212 171.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -56.32 -54.72 42.09 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.466 1.03 . . . . 2.8999999999999999 110.637 172.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 67.0 mt -64.07 -30.49 71.56 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.165 0.986 . . . . 2.75 111.864 -178.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 15.3 m -68.13 -50.98 51.22 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.284 0.947 . . . . 1.6899999999999999 111.942 170.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 65.3 mtp -51.87 -48.01 64.23 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.182 0.901 . . . . 2.5299999999999998 111.088 177.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 99.6 mt -65.45 -48.68 71.88 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.086 0.955 . . . . 2.0499999999999998 112.599 176.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.414 ' HG ' HG23 ' B' ' 13' ' ' VAL . 34.6 t -64.84 -33.04 75.06 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.352 0.978 . . . . 2.3399999999999999 113.213 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 88.7 mtp -63.39 -46.59 85.73 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 118.687 0.676 . . . . 2.6099999999999999 110.813 168.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.94 -42.94 97.18 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.626 0.602 . . . . 2.3599999999999999 112.626 -178.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -65.39 -25.71 67.68 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.574 -0.704 . . . . 4.0999999999999996 112.346 178.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -69.56 -37.21 76.94 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.103 0.865 . . . . 4.29 112.351 173.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -70.65 -47.46 59.88 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.979 1.312 . . . . 2.8100000000000001 110.703 172.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -52.41 -47.42 66.32 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 126.09 1.756 . . . . 4.3499999999999996 110.98 177.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -53.53 -33.1 53.32 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.504 1.522 . . . . 3.7999999999999998 113.045 177.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 24.7 mt -81.86 -20.73 38.31 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.99 0.916 . . . . 2.5800000000000001 112.506 -177.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.488 ' CD ' ' HZ3' ' A' ' 92' ' ' LYS . 57.7 mm-40 -96.5 -7.85 33.61 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.641 1.348 . . . . 2.9399999999999999 114.641 172.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -108.43 -53.37 2.64 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.89 2.076 . . . . 3.71 112.686 -174.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -81.68 55.84 2.82 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 123.222 1.487 . . . . 4.2400000000000002 110.844 174.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.488 ' HZ3' ' CD ' ' A' ' 89' ' ' GLU . 54.1 mmtt . . . . . 0 C--O 1.251 1.17 0 C-N-CA 127.92 2.488 . . . . 4.9100000000000001 114.807 167.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 18.5 ttt . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 108.221 -1.029 . . . . 12.52 108.221 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -149.13 -12.84 0.31 Allowed 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 116.065 1.876 . . . . 5.1100000000000003 116.065 -153.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 1.2 p 66.51 -176.95 0.04 OUTLIER Pre-proline 0 N--CA 1.483 1.213 0 C-N-CA 125.314 1.446 . . . . 2.77 109.769 -173.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -81.8 -15.04 9.73 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 121.759 1.639 . . . . 2.1299999999999999 113.139 166.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.26 -39.31 68.49 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.604 1.093 . . . . 3.3199999999999998 111.967 -174.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -50.69 -55.46 16.42 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.604 0.762 . . . . 5.1200000000000001 110.522 167.496 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 43.4 mttm -67.54 -19.23 65.26 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.221 -0.924 . . . . 4.4400000000000004 112.365 -176.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.59 -43.17 39.83 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.018 1.327 . . . . 1.8799999999999999 111.891 171.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 56.7 mt -61.47 -44.62 96.78 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.177 1.391 . . . . 2.5899999999999999 111.69 169.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 88.2 m -58.26 -48.99 78.7 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.542 1.537 . . . . 2.3700000000000001 110.445 171.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 23.2 m -54.92 -49.96 70.0 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 119.539 1.063 . . . . 2.48 110.897 175.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 14.9 mmm -50.68 -51.46 49.18 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.684 1.194 . . . . 3.6499999999999999 112.623 174.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.414 HG23 ' HG ' ' A' ' 80' ' ' CYS . 4.0 t -59.31 -40.7 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.848 0.859 . . . . 2.7200000000000002 112.34 175.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 87.9 m -72.28 -44.12 63.25 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.766 1.627 . . . . 1.8799999999999999 111.753 -173.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 19.2 p -67.74 -44.88 76.53 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 108.913 -0.773 . . . . 2.3500000000000001 108.913 172.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -63.57 -53.65 48.41 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 123.597 0.561 . . . . 3.7400000000000002 110.518 -173.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -66.19 -30.01 70.4 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 112.506 0.558 . . . . 2.77 112.506 -178.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 19.4 ttmm -70.91 -47.06 61.22 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 120.868 -1.145 . . . . 4.8499999999999996 112.117 176.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -73.18 -32.95 65.14 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.351 -0.843 . . . . 3.6099999999999999 112.486 176.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 53.1 p -68.44 -29.02 67.58 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-N 119.666 1.121 . . . . 2.5899999999999999 113.012 176.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.35 -5.91 84.59 Favored Glycine 0 C--N 1.342 0.88 0 C-N-CA 127.625 2.536 . . . . 1.5 114.756 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -64.48 -41.68 96.33 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.896 1.848 . . . . 4.1900000000000004 111.392 175.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -147.93 156.02 42.22 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 123.252 1.501 . . . . 3.48 114.799 -173.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.43 -126.79 43.21 Favored Glycine 0 C--N 1.34 0.765 0 C-N-CA 127.156 2.313 . . . . 2.2799999999999998 111.123 171.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 2.3 m -54.53 116.31 2.6 Favored 'General case' 0 C--O 1.249 1.035 0 CA-C-O 121.207 0.527 . . . . 4.6699999999999999 109.736 162.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -18.81 60.65 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.445 0.906 . . . . 7.0899999999999999 113.445 -176.061 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -91.27 -13.71 32.2 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.622 1.569 . . . . 5.2199999999999998 113.58 177.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -127.86 162.27 27.09 Favored 'General case' 0 C--O 1.249 1.042 0 N-CA-C 114.226 1.195 . . . . 2.9700000000000002 114.226 -178.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 91.8 mt -107.16 108.51 20.0 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.89 2.476 . . . . 2.8300000000000001 111.592 -178.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 95.9 p -70.72 163.37 27.31 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 121.26 -0.9 . . . . 2.7400000000000002 113.211 164.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -42.28 -38.16 1.72 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 125.642 1.577 . . . . 7.4900000000000002 114.545 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.63 -28.0 25.06 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 116.438 2.014 . . . . 4.6200000000000001 116.438 176.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -67.53 -48.64 66.41 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 120.103 1.32 . . . . 1.6699999999999999 109.221 166.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 24.6 tp -58.07 -42.95 86.63 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.679 1.191 . . . . 2.9199999999999999 111.827 177.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -51.37 -40.79 59.91 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.915 0.886 . . . . 4.4199999999999999 111.885 177.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -64.33 -51.98 60.7 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.948 0.499 . . . . 2.9700000000000002 110.364 177.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 29.6 tp -57.65 -55.24 37.35 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 117.067 -1.444 . . . . 3.3599999999999999 111.0 -178.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 30.7 mt -54.46 -51.44 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-N 120.201 1.364 . . . . 1.9399999999999999 110.469 178.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 44.1 tttm -65.89 -18.53 65.4 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.755 1.02 . . . . 5.1399999999999997 113.755 -176.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm -85.78 -59.75 2.22 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.752 1.621 . . . . 3.8700000000000001 110.609 168.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 72.3 tt0 -43.54 -62.52 1.06 Allowed 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 130.97 3.708 . . . . 5.1600000000000001 112.846 -177.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -82.22 -37.65 25.69 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.296 1.038 . . . . 3.4300000000000002 111.939 178.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 8.2 t 70.33 -44.44 0.57 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 127.691 2.396 . . . . 3.25 114.998 175.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -63.31 -4.24 2.46 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 117.351 2.352 . . . . 4.2199999999999998 117.351 -167.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.48 16.55 77.71 Favored Glycine 0 N--CA 1.474 1.215 0 O-C-N 120.812 -1.18 . . . . 4.9000000000000004 115.105 173.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -46.05 -71.36 0.08 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 127.45 2.3 . . . . 7.9800000000000004 112.204 176.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.84 125.46 26.89 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.944 0.878 . . . . 4.25 111.431 173.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -87.18 173.88 8.96 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.836 -0.54 . . . . 4.2199999999999998 109.809 166.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.01 -37.5 74.41 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 115.062 1.504 . . . . 3.4700000000000002 115.062 -169.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 13.1 t -72.59 -11.15 60.53 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 114.148 1.166 . . . . 3.04 114.148 172.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 1.7 m -94.17 -31.68 14.04 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.992 1.717 . . . . 3.71 111.544 172.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 86.6 mt -65.99 -32.96 60.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.293 0.637 . . . . 2.8999999999999999 110.718 170.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.0 -66.12 0.56 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.232 1.013 . . . . 3.0800000000000001 111.207 176.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.61 -24.64 62.78 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 113.885 1.068 . . . . 3.9199999999999999 113.885 -173.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.77 -52.96 63.46 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.52 0.728 . . . . 3.3199999999999998 109.992 164.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -60.89 -49.47 77.34 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.377 1.071 . . . . 2.77 111.922 -179.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 24.8 mtpt -57.16 -36.22 70.5 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.44 1.096 . . . . 6.1399999999999997 113.011 173.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 52.1 m -75.07 -30.64 61.02 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 120.956 -1.09 . . . . 3.2599999999999998 113.479 177.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 mp -65.34 -52.8 51.41 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 118.031 -0.985 . . . . 4.0199999999999996 110.504 167.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -73.93 74.91 1.66 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.322 2.249 . . . . 1.45 114.343 -169.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . 0.401 ' HZ1' HG11 ' B' ' 74' ' ' VAL . 14.8 mptt -53.96 -27.57 32.12 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 115.113 1.523 . . . . 4.1699999999999999 115.113 -176.542 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -88.25 -15.28 36.29 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.723 1.209 . . . . 2.4100000000000001 113.379 177.529 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 29.4 t 58.17 32.05 21.54 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.473 1.109 . . . . 2.96 112.552 -176.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -84.47 -0.24 52.19 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.378 1.471 . . . . 2.3500000000000001 112.02 -175.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 82.3 -0.96 1.42 Allowed 'General case' 0 C--O 1.238 0.477 0 C-N-CA 130.36 3.464 . . . . 4.4800000000000004 113.204 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -126.38 135.21 51.16 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 123.045 1.403 . . . . 2.27 113.106 178.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 21.3 mm -74.58 100.0 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-N 115.016 -0.993 . . . . 2.6000000000000001 109.232 170.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.35 158.31 31.91 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.293 1.037 . . . . 4.9900000000000002 109.846 169.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.57 -35.17 53.36 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 120.517 -1.364 . . . . 4.2300000000000004 113.496 175.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.18 -25.96 66.4 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.862 0.865 . . . . 6.2199999999999998 112.48 177.45 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -88.03 -40.74 13.6 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.246 1.418 . . . . 2.5600000000000001 110.35 174.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -54.78 -23.67 19.05 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 120.39 -1.444 . . . . 3.1499999999999999 113.059 173.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 36.1 t -65.8 -30.61 71.28 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.518 1.527 . . . . 2.8599999999999999 112.989 174.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . 0.401 HG11 ' HZ1' ' B' ' 61' ' ' LYS . 0.9 OUTLIER -86.85 -28.57 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.714 0.805 . . . . 3.6200000000000001 111.544 -176.974 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -58.93 -67.03 0.41 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.945 1.298 . . . . 2.5899999999999999 111.396 179.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -59.92 -36.77 77.71 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.452 1.101 . . . . 4.9900000000000002 112.0 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 31.5 m -51.19 -54.35 26.33 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.664 0.786 . . . . 1.97 110.492 173.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.4 mtm -58.68 -46.11 87.94 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 118.544 0.611 . . . . 2.1800000000000002 111.593 179.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.08 -45.54 94.32 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.147 0.579 . . . . 2.4500000000000002 112.436 178.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.4 t -72.68 -29.41 63.38 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.328 -0.857 . . . . 3.2200000000000002 113.1 -178.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 91.5 mtp -69.9 -39.45 76.2 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 118.79 -0.624 . . . . 2.9700000000000002 110.948 170.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.65 -36.16 81.93 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.493 1.042 . . . . 1.79 112.524 173.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -68.26 -35.43 77.89 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.083 1.142 . . . . 3.9100000000000001 114.083 170.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 17.1 t30 -64.72 -42.38 95.28 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.521 1.055 . . . . 2.46 112.607 171.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -73.43 -24.7 60.28 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.11 0.964 . . . . 4.0199999999999996 111.186 -177.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -55.98 26.53 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.492 1.517 . . . . 3.6200000000000001 112.104 160.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -57.46 -26.62 61.51 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.862 1.665 . . . . 3.48 112.3 -179.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 55.0 mt -77.05 -7.89 56.48 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.728 1.381 . . . . 2.6699999999999999 114.728 174.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -94.78 -29.78 14.58 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 113.86 1.059 . . . . 4.4699999999999998 113.86 162.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -74.6 -46.91 35.49 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.956 1.302 . . . . 3.6099999999999999 112.464 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -136.77 41.36 2.52 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 127.723 2.409 . . . . 4.4500000000000002 110.874 -165.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 36.8 mttm . . . . . 0 C--O 1.253 1.239 0 C-N-CA 130.386 3.475 . . . . 8.5500000000000007 117.047 -175.607 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.407 ' H1 ' ' CD ' ' A' ' 2' ' ' GLU . 65.1 mtt . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 109.585 -0.524 . . . . 9.3100000000000005 109.585 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.407 ' CD ' ' H1 ' ' A' ' 1' ' ' MET . 1.8 mp0 -92.23 -80.04 0.37 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.148 0.499 . . . . 3.4199999999999999 111.421 -144.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 67.3 p -110.49 165.2 13.14 Favored Pre-proline 0 N--CA 1.472 0.645 0 C-N-CA 126.474 1.909 . . . . 2.3500000000000001 110.652 -168.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -69.62 -23.09 31.81 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 121.118 1.212 . . . . 1.6000000000000001 112.26 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.34 -40.39 44.28 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.7 1.137 . . . . 3.6299999999999999 113.63 173.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -64.75 -34.44 78.33 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.114 1.325 . . . . 4.0599999999999996 110.625 172.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 59.1 mttt -68.21 -29.02 67.76 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 120.051 -1.656 . . . . 5.2599999999999998 112.255 170.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.13 -50.79 29.76 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.273 1.029 . . . . 2.2400000000000002 111.204 174.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.2 mt -55.9 -43.56 77.41 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.745 1.218 . . . . 2.7999999999999998 111.87 174.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 85.4 m -53.49 -54.71 33.16 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.342 1.057 . . . . 2.8199999999999998 111.366 168.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.3 m -58.55 -37.24 75.28 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.489 1.115 . . . . 1.97 111.924 -179.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 60.0 mtp -61.91 -52.54 63.67 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.032 0.933 . . . . 4.2599999999999998 111.113 174.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 19.2 m -67.77 -28.25 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 CA-C-N 119.803 1.183 . . . . 3.4199999999999999 113.299 177.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 57.2 m -58.64 -55.85 29.73 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.891 1.276 . . . . 1.8999999999999999 110.851 174.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -74.53 -34.45 63.01 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 119.304 -0.379 . . . . 3.3399999999999999 110.275 -176.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -61.66 -51.59 67.8 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 118.397 -0.811 . . . . 2.8300000000000001 110.999 176.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -66.29 -39.25 89.25 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 120.307 1.412 . . . . 2.6200000000000001 112.23 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -53.71 52.65 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.756 1.222 . . . . 5.96 113.097 176.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -74.13 -32.2 63.07 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.358 -0.839 . . . . 3.73 112.091 176.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.5 t -58.79 -38.6 78.91 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 120.429 1.468 . . . . 2.9300000000000002 114.145 178.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.55 -6.17 83.74 Favored Glycine 0 CA--C 1.528 0.85 0 CA-C-O 117.958 -1.468 . . . . 1.96 115.184 -171.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -69.0 -41.56 77.63 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.239 1.519 . . . . 7.7999999999999998 112.616 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -149.98 143.49 25.24 Favored 'General case' 0 C--O 1.247 0.93 0 C-N-CA 124.217 1.007 . . . . 4.6100000000000003 110.551 -154.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.39 -131.8 34.4 Favored Glycine 0 C--N 1.337 0.592 0 CA-C-N 114.522 -1.217 . . . . 2.1200000000000001 110.973 -178.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.9 m -65.4 155.02 36.72 Favored 'General case' 0 C--O 1.247 0.973 0 C-N-CA 123.896 0.878 . . . . 3.04 112.995 170.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -112.86 10.73 19.1 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 115.037 1.495 . . . . 5.4800000000000004 115.037 170.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.8 mp -93.11 -1.66 56.22 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.339 1.056 . . . . 5.2599999999999998 111.485 167.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -159.7 148.29 17.56 Favored 'General case' 0 C--O 1.247 0.972 0 C-N-CA 126.841 2.056 . . . . 2.4199999999999999 110.915 -157.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -96.21 103.14 15.02 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 113.859 -1.518 . . . . 3.9399999999999999 108.354 175.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.3 p -70.95 155.93 40.23 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.854 -1.066 . . . . 2.9199999999999999 110.348 171.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.1 ttm-85 -40.56 -50.9 2.98 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.665 1.186 . . . . 4.7199999999999998 113.897 -169.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -74.16 -30.33 62.21 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 115.39 1.626 . . . . 6.8399999999999999 115.39 -175.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -58.12 -44.93 88.02 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.165 0.586 . . . . 1.96 111.227 166.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.73 -46.48 65.81 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.246 1.018 . . . . 3.8199999999999998 110.854 -175.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.1 ttmt -60.31 -44.29 95.56 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.43 -1.419 . . . . 5.1500000000000004 112.702 177.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.12 -43.2 87.09 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 114.026 1.121 . . . . 5.1799999999999997 114.026 168.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.9 tp -62.01 -54.01 47.57 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.4 1.08 . . . . 3.27 111.149 179.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.7 mt -56.51 -44.52 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 CA-C-N 118.893 0.77 . . . . 1.6200000000000001 109.962 175.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -67.96 -18.98 64.91 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 114.149 1.166 . . . . 4.8200000000000003 114.149 -176.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -91.81 -40.48 11.19 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.57 1.548 . . . . 3.8700000000000001 112.498 -179.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -81.29 -26.38 35.77 Favored 'General case' 0 CA--C 1.552 1.041 0 O-C-N 124.413 1.071 . . . . 4.6600000000000001 111.815 176.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.0 mt -133.62 131.74 39.96 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 123.277 1.513 . . . . 3.7599999999999998 113.442 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 4.3 t -149.15 7.51 0.71 Allowed 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.508 1.67 . . . . 4.8099999999999996 115.508 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -87.43 170.35 11.45 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.327 1.051 . . . . 4.3799999999999999 111.556 170.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.55 -131.08 26.44 Favored Glycine 0 N--CA 1.472 1.079 0 N-CA-C 109.977 -1.249 . . . . 5.0800000000000001 109.977 -172.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -119.89 86.28 2.53 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.666 0.746 . . . . 7.29 109.137 148.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.0 tpt -74.65 78.47 2.02 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 120.51 -1.369 . . . . 2.6800000000000002 109.287 169.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.9 tttm -89.44 151.37 22.05 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.799 1.407 . . . . 7.0999999999999996 114.799 -157.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.3 -40.31 81.64 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.589 0.959 . . . . 4.5199999999999996 113.589 174.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.7 t -83.84 -41.76 17.15 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.134 0.974 . . . . 3.21 113.458 174.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.9 m -61.92 -24.82 67.21 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.492 1.117 . . . . 3.46 112.442 177.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 65.8 mt -69.51 -28.13 36.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 124.265 1.026 . . . . 2.2000000000000002 113.111 167.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.92 -30.19 68.61 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.958 1.708 . . . . 2.7799999999999998 112.123 -176.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -79.68 -35.77 38.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.747 0.819 . . . . 3.1699999999999999 112.401 168.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.9 tp -59.63 -32.42 70.42 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.559 -0.713 . . . . 3.0 111.236 170.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 6.0 tpt -55.16 -46.78 75.75 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.292 1.437 . . . . 2.6699999999999999 111.517 173.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -65.87 -29.28 69.71 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.799 1.24 . . . . 3.73 112.524 171.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.9 t -75.35 -31.29 60.49 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.041 0.936 . . . . 2.6899999999999999 112.794 177.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.0 mp -71.38 -55.55 7.75 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.39 1.076 . . . . 3.8399999999999999 111.348 167.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -70.78 148.5 47.84 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 113.07 0.767 . . . . 2.1200000000000001 113.07 -168.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm -125.44 7.54 7.69 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.758 1.223 . . . . 4.0300000000000002 113.0 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -122.17 -21.19 5.98 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.587 1.155 . . . . 3.4300000000000002 112.995 176.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 7.8 t 74.35 20.89 2.49 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.408 2.283 . . . . 2.96 112.584 -171.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 p30 -83.4 -23.75 32.24 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.928 2.091 . . . . 1.97 112.287 -163.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 73.59 19.23 3.35 Favored 'General case' 0 CA--C 1.548 0.874 1 C-N-CA 132.1 4.16 . . . . 4.21 113.736 -172.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -121.85 122.57 39.74 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 128.719 2.808 . . . . 3.71 109.211 169.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 18.2 mm -91.47 107.75 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 O-C-N 120.652 -1.28 . . . . 2.0699999999999998 110.441 175.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 59.1 t0 -74.85 151.81 38.98 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 127.07 2.148 . . . . 2.7599999999999998 109.66 164.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -46.33 -43.61 16.11 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 115.299 1.592 . . . . 3.5499999999999998 115.299 -177.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.98 -21.59 63.22 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 113.831 1.048 . . . . 3.7599999999999998 113.831 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -74.03 -53.36 10.19 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.718 1.207 . . . . 1.6699999999999999 108.634 165.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -52.9 -30.04 31.89 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 120.304 -1.497 . . . . 3.3999999999999999 114.401 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 33.1 t -40.76 -45.1 2.36 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.125 1.77 . . . . 4.2599999999999998 113.284 165.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.3 m -75.05 -27.99 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 CA-C-N 118.925 0.784 . . . . 3.6299999999999999 112.419 -172.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -59.25 -58.23 9.53 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 118.724 0.693 . . . . 2.9500000000000002 110.499 168.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 38.3 mt -65.42 -29.61 70.33 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.517 0.727 . . . . 2.46 111.902 -177.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.0 m -65.91 -46.64 77.53 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.331 1.052 . . . . 2.1099999999999999 111.196 174.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 59.0 mtm -61.45 -47.79 84.09 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.668 1.122 . . . . 2.0899999999999999 112.116 177.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 96.7 mt -62.21 -44.85 95.65 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.737 0.815 . . . . 2.27 112.002 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 16.3 t -66.49 -35.2 79.68 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 113.012 0.745 . . . . 2.3399999999999999 113.012 175.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.1 -41.3 96.41 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.009 0.744 . . . . 3.77 113.009 174.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.54 -38.1 86.41 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 118.53 -0.748 . . . . 2.3599999999999999 111.468 174.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -63.05 -28.17 69.91 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 120.011 1.278 . . . . 4.0999999999999996 114.059 176.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -60.55 -52.04 66.85 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.869 1.213 . . . . 2.7999999999999998 110.919 170.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -73.11 -30.42 63.62 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.063 1.345 . . . . 3.3900000000000001 112.107 -175.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.77 -54.03 51.1 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.7 1.6 . . . . 4.8300000000000001 110.132 168.192 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -55.76 -38.12 69.43 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.29 1.436 . . . . 3.7999999999999998 112.489 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 85.5 mt -70.66 -16.07 62.78 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.879 1.066 . . . . 2.7799999999999998 113.879 177.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.51 ' CD ' ' HZ1' ' A' ' 92' ' ' LYS . 13.7 mm-40 -109.89 2.52 19.88 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.156 1.782 . . . . 3.25 113.621 175.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -118.36 -55.25 2.24 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 126.539 1.936 . . . . 2.9900000000000002 112.311 -174.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -82.49 37.52 0.52 Allowed 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.531 1.533 . . . . 4.3200000000000003 112.422 175.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.51 ' HZ1' ' CD ' ' A' ' 89' ' ' GLU . 5.9 ptmt . . . . . 0 C--O 1.249 1.042 0 C-N-CA 128.43 2.692 . . . . 5.2699999999999996 115.898 -172.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 34.4 mmt . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 107.705 -1.22 . . . . 7.29 107.705 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -105.01 -51.85 2.96 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 125.132 1.52 . . . . 5.1799999999999997 112.398 -148.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 3.9 t -173.53 154.79 2.52 Favored Pre-proline 0 N--CA 1.472 0.631 0 C-N-CA 124.912 1.285 . . . . 4.04 110.727 -166.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -65.77 -24.52 54.38 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 122.079 1.853 . . . . 1.73 113.065 164.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 14.0 tp -65.69 -63.48 1.08 Allowed 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 121.135 1.788 . . . . 3.7400000000000002 111.451 -176.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -57.99 -37.85 75.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.234 1.016 . . . . 5.3200000000000003 110.646 178.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . 0.411 ' HA ' ' HE2' ' B' ' 7' ' ' LYS . 0.2 OUTLIER -63.92 -31.53 72.75 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 120.361 -1.462 . . . . 6.1799999999999997 112.997 174.994 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -79.38 -27.74 41.9 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.58 1.152 . . . . 2.3799999999999999 112.862 178.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 56.8 mt -60.31 -32.55 71.33 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 120.864 -1.148 . . . . 2.9500000000000002 111.799 168.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.7 m -60.35 -40.57 91.2 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.074 -1.016 . . . . 2.5299999999999998 111.722 167.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 5.9 m -57.74 -38.82 76.01 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.175 0.898 . . . . 2.2200000000000002 111.261 177.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 13.7 ttm -59.53 -37.42 78.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.447 0.906 . . . . 3.6699999999999999 113.447 173.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -75.06 -27.26 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 CA-C-N 119.911 1.232 . . . . 3.6099999999999999 112.092 172.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 85.5 m -71.94 -46.75 56.41 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.708 1.603 . . . . 1.8899999999999999 110.24 -171.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 38.1 p -69.9 -39.12 76.42 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 123.538 0.735 . . . . 2.1600000000000001 109.68 170.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -62.37 -53.63 52.14 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-O 118.455 -0.783 . . . . 3.5299999999999998 111.966 -175.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -19.44 62.62 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 120.269 1.395 . . . . 2.98 112.328 -178.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -72.63 -49.36 32.43 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.698 -1.251 . . . . 5.1799999999999997 112.519 168.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -74.54 -39.6 62.24 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.688 -1.258 . . . . 3.6899999999999999 112.886 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 18.2 m -55.96 -42.0 75.58 Favored 'General case' 0 C--O 1.245 0.831 0 C-N-CA 124.299 1.04 . . . . 2.1699999999999999 112.337 166.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.94 -9.03 86.86 Favored Glycine 0 C--N 1.343 0.928 0 C-N-CA 127.237 2.351 . . . . 1.3400000000000001 113.999 -176.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -56.75 -67.52 0.3 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.184 1.794 . . . . 4.6299999999999999 109.373 174.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -138.01 168.61 19.36 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 124.167 0.987 . . . . 3.5699999999999998 113.025 -168.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.2 -132.18 48.84 Favored Glycine 0 C--N 1.341 0.839 0 C-N-CA 125.785 1.66 . . . . 2.5600000000000001 111.816 176.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -50.51 121.78 6.21 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.176 0.991 . . . . 4.4900000000000002 110.227 158.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -85.17 -16.22 41.12 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 120.657 -1.277 . . . . 9.0099999999999998 114.411 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 60.8 tp -72.72 -36.62 67.83 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.504 1.121 . . . . 3.5600000000000001 112.226 168.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 3.2 p -119.23 166.5 12.91 Favored 'General case' 0 C--O 1.252 1.236 0 C-N-CA 126.283 1.833 . . . . 2.2999999999999998 114.553 -172.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.81 129.46 47.04 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 113.663 -1.608 . . . . 3.5699999999999998 113.83 176.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.64 175.51 5.47 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.712 1.605 . . . . 3.5800000000000001 110.698 175.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . 0.448 HH11 ' HG2' ' B' ' 31' ' ' ARG . 14.9 ttt-85 -44.77 -33.04 1.74 Allowed 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 116.738 2.125 . . . . 6.2800000000000002 116.738 -170.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -79.99 -36.49 35.92 Favored 'General case' 0 CA--C 1.549 0.931 0 O-C-N 120.337 -1.477 . . . . 4.5599999999999996 114.076 176.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -70.27 -48.2 57.85 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 108.831 -0.803 . . . . 1.8400000000000001 108.831 173.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 15.7 mt -52.09 -45.88 65.0 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.714 1.605 . . . . 4.1200000000000001 113.498 175.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -52.77 -41.95 64.54 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.373 0.533 . . . . 3.6899999999999999 111.518 178.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -71.91 -38.75 69.86 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.498 0.925 . . . . 3.2400000000000002 113.498 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 7.2 tt -57.13 -59.6 4.85 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.473 0.709 . . . . 2.98 109.876 173.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 41.8 mt -54.84 -54.57 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.957 0.903 . . . . 2.0 109.974 -172.077 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -72.61 -22.64 60.93 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 118.507 -1.277 . . . . 7.3899999999999997 114.135 -171.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -83.31 -34.89 25.61 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 117.457 -1.258 . . . . 5.1100000000000003 113.531 173.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 80.7 mt-10 -72.43 -58.12 3.64 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.736 1.153 . . . . 3.7400000000000002 111.143 172.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mp -91.97 91.47 7.87 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.72 -0.844 . . . . 4.6699999999999999 108.72 175.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 89.0 m -55.75 -37.61 68.74 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 121.599 -0.688 . . . . 4.0099999999999998 112.526 174.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.46 -156.93 0.29 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 127.492 2.317 . . . . 4.1500000000000004 114.354 -171.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.11 162.07 33.57 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.186 1.85 . . . . 5.1799999999999997 113.547 177.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -79.47 43.81 0.57 Allowed 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 122.498 1.142 . . . . 6.2000000000000002 109.995 165.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 4.2 tpt -80.49 65.55 5.68 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.519 1.527 . . . . 2.54 112.533 -157.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -71.16 164.79 24.93 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.089 1.755 . . . . 4.5 111.646 175.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -45.15 -53.53 7.97 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.789 1.636 . . . . 4.7599999999999998 112.581 175.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -66.32 -29.3 69.47 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.2 -0.938 . . . . 3.3799999999999999 113.104 -178.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 24.4 t -76.66 -18.06 58.78 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 118.089 -0.958 . . . . 3.1299999999999999 112.201 175.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 81.2 mt -86.39 -36.5 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 126.451 1.9 . . . . 2.5600000000000001 109.834 173.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -59.01 -58.4 8.82 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.704 2.002 . . . . 4.1399999999999997 111.248 168.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.402 ' CG ' ' HZ1' ' B' ' 57' ' ' LYS . 2.4 m-20 -67.63 -26.42 66.23 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.305 0.957 . . . . 2.9199999999999999 113.58 176.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.19 -56.59 19.66 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.209 0.913 . . . . 3.5099999999999998 110.282 165.278 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -69.26 -29.57 67.5 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 117.75 -1.119 . . . . 2.77 112.108 -172.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . 0.402 ' HZ1' ' CG ' ' B' ' 54' ' ' ASP . 18.5 mtpt -64.48 -36.64 84.84 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 120.397 1.453 . . . . 4.4500000000000002 113.076 164.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 22.7 t -69.18 -31.76 70.6 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.868 -1.145 . . . . 3.4100000000000001 112.599 175.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 10.4 mp -69.93 -55.62 9.19 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 120.666 -1.271 . . . . 3.7599999999999998 110.79 167.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -79.21 61.59 3.36 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 129.029 2.932 . . . . 1.3600000000000001 113.079 -173.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 22.8 mttp -54.85 -18.75 5.25 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 115.117 1.525 . . . . 4.0599999999999996 115.117 -172.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -105.79 -3.57 21.86 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.003 1.721 . . . . 3.0800000000000001 115.106 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 15.0 t 68.79 25.36 6.3 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 114.678 1.362 . . . . 2.7599999999999998 114.678 177.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 13.6 p30 -78.27 -14.31 59.48 Favored 'General case' 0 CA--C 1.552 1.022 0 O-C-N 120.682 -1.261 . . . . 2.2999999999999998 112.001 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 75.79 -6.13 2.04 Favored 'General case' 0 CA--C 1.543 0.705 1 C-N-CA 133.243 4.617 . . . . 4.6500000000000004 115.052 177.395 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -97.43 152.86 18.53 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 127.347 2.259 . . . . 3.7200000000000002 109.304 169.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 29.6 mm -115.22 97.07 5.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-O 122.322 1.058 . . . . 3.0499999999999998 109.816 171.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.92 153.4 43.63 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.297 1.839 . . . . 2.8300000000000001 110.771 159.433 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.97 -33.91 39.97 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.298 1.222 . . . . 3.8300000000000001 114.298 -174.312 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -25.83 61.77 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.778 -1.202 . . . . 4.6799999999999997 112.09 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -78.87 -47.58 16.26 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.892 1.277 . . . . 1.6799999999999999 109.342 169.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -52.92 -48.53 67.21 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 127.61 2.364 . . . . 4.3700000000000001 114.228 -174.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 97.2 p -61.17 -25.64 67.16 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.236 -0.915 . . . . 2.6400000000000001 113.149 -172.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 37.3 t -65.56 -21.74 29.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 123.784 0.834 . . . . 3.3900000000000001 111.964 178.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -57.48 -58.44 8.28 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.487 1.115 . . . . 4.3200000000000003 111.595 168.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -61.62 -40.6 95.41 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.788 0.835 . . . . 4.4000000000000004 111.037 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 52.3 m -53.39 -52.55 58.96 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 118.191 -0.909 . . . . 2.2200000000000002 112.358 172.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 74.6 mtm -57.74 -49.94 74.9 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 119.808 1.186 . . . . 2.7000000000000002 112.452 177.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 84.5 mt -62.49 -37.93 87.88 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.724 0.41 . . . . 2.4700000000000002 111.598 -179.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 8.5 t -69.22 -31.64 70.36 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.02 0.928 . . . . 2.98 112.921 175.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 67.3 mtp -61.46 -46.43 90.09 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 119.029 0.831 . . . . 2.7999999999999998 110.73 167.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.31 -45.63 90.42 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 118.728 0.695 . . . . 1.55 112.836 177.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -59.12 -27.03 65.23 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.651 -0.656 . . . . 3.77 112.759 176.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -72.86 -35.55 67.21 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.337 1.426 . . . . 2.5 112.685 176.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.79 -39.89 72.89 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.81 0.844 . . . . 2.8399999999999999 110.261 175.127 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.56 -50.87 68.9 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.167 1.387 . . . . 3.04 110.812 170.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -58.04 -29.85 65.69 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.175 1.39 . . . . 3.5299999999999998 113.123 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 24.8 mt -73.65 -24.44 60.0 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.324 1.05 . . . . 2.2599999999999998 113.547 177.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -97.74 -32.48 11.72 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 114.388 1.255 . . . . 4.1699999999999999 114.388 175.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -74.33 -27.42 60.69 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.365 1.466 . . . . 4.2800000000000002 113.568 -170.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -88.13 -1.85 58.25 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.898 0.879 . . . . 4.8799999999999999 112.853 176.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.042 0 C-N-CA 126.277 1.831 . . . . 6.1100000000000003 114.25 -159.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.6 mtt . . . . . 0 N--CA 1.479 1.017 0 CA-C-O 117.67 -1.157 . . . . 7.5800000000000001 110.073 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.4 mp0 56.4 -141.1 0.83 Allowed 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.279 1.832 . . . . 3.2200000000000002 109.145 177.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.4 p -118.27 163.99 22.41 Favored Pre-proline 0 C--O 1.238 0.481 0 C-N-CA 125.059 1.344 . . . . 2.9500000000000002 108.954 172.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -64.38 -12.75 34.59 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 121.985 1.79 . . . . 2.1699999999999999 113.516 175.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.8 tt -79.7 -35.09 39.53 Favored 'General case' 0 C--N 1.347 0.492 0 CA-C-N 120.238 1.381 . . . . 4.1600000000000001 112.512 170.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -52.69 52.68 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.339 1.427 . . . . 3.8599999999999999 108.7 167.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.494 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -57.5 -26.14 60.86 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 113.096 0.776 . . . . 5.2300000000000004 113.096 -179.137 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.64 -53.62 44.68 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-O 118.335 -0.841 . . . . 2.29 111.844 168.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 47.5 mt -54.45 -48.36 71.82 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 120.041 1.292 . . . . 2.8999999999999999 111.597 177.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.7 p -67.52 -36.31 80.79 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 117.636 -1.174 . . . . 3.8799999999999999 113.289 177.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.42 -29.12 66.77 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 121.149 1.795 . . . . 3.3700000000000001 112.078 170.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.96 -55.97 18.58 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.378 1.071 . . . . 4.5300000000000002 110.815 -178.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.7 m -62.56 -25.13 37.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 113.021 0.749 . . . . 3.3900000000000001 113.021 177.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.1 m -70.17 -49.22 52.63 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.697 1.599 . . . . 2.29 112.512 175.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -48.13 81.22 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.054 0.843 . . . . 3.1200000000000001 109.68 167.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -62.85 -50.96 68.9 Favored 'General case' 0 N--CA 1.465 0.319 0 O-C-N 124.222 0.951 . . . . 4.0599999999999996 111.1 -166.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 24.0 m170 -68.21 -34.81 76.95 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 118.394 -0.812 . . . . 3.3999999999999999 112.42 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -70.81 -43.02 69.49 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 120.056 1.298 . . . . 5.3300000000000001 113.315 177.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -70.53 -23.16 62.58 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.312 0.96 . . . . 3.3100000000000001 112.045 170.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.0 p -69.88 -36.67 75.66 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.326 -1.484 . . . . 3.7400000000000002 111.181 169.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.47 -15.37 75.17 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 125.871 1.7 . . . . 1.75 113.516 175.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -64.11 92.94 0.08 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 106.999 -1.482 . . . . 5.3799999999999999 106.999 157.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 60.63 178.08 0.1 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.764 2.026 . . . . 6.7800000000000002 115.635 169.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.36 -140.3 44.79 Favored Glycine 0 C--N 1.343 0.938 0 C-N-CA 126.294 1.902 . . . . 2.46 112.522 166.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.5 t -54.14 132.38 42.92 Favored 'General case' 0 C--O 1.241 0.613 0 O-C-N 121.817 -0.813 . . . . 3.0800000000000001 110.343 156.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.5 ptmm? -86.31 16.79 4.14 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.063 0.945 . . . . 4.8600000000000003 113.546 171.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.2 mt -128.85 -39.6 1.59 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.561 1.144 . . . . 5.1699999999999999 111.475 178.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 12.5 p -101.0 162.33 12.96 Favored 'General case' 0 C--O 1.248 0.995 0 C-N-CA 124.996 1.318 . . . . 2.4399999999999999 111.508 174.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 92.6 mt -90.48 98.17 11.62 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 112.304 -2.225 . . . . 2.5299999999999998 109.127 172.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.2 t -63.0 166.15 6.11 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 121.59 0.709 . . . . 2.3500000000000001 112.242 170.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.65 -40.61 1.99 Allowed 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 127.008 2.123 . . . . 4.5999999999999996 115.419 -175.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -79.71 -36.87 36.82 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.06 1.133 . . . . 7.21 114.06 176.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -66.09 -47.72 73.29 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.533 1.533 . . . . 1.54 109.615 -175.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 38.1 tp -53.93 -50.41 66.48 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.569 1.148 . . . . 2.8100000000000001 111.049 175.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.551 ' HZ3' ' CD ' ' A' ' 49' ' ' GLU . 38.0 ttmt -57.46 -44.74 85.04 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 112.958 0.725 . . . . 4.3300000000000001 112.958 176.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -58.31 -38.8 77.81 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 119.264 0.938 . . . . 3.77 112.488 174.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.413 HD13 ' HH ' ' A' ' 72' ' ' TYR . 3.4 tm? -68.7 -57.84 5.08 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.482 1.113 . . . . 3.7200000000000002 110.734 177.032 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.6 mt -58.27 -49.37 82.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 118.517 0.599 . . . . 1.9299999999999999 110.107 -175.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.62 -8.18 53.99 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 120.818 -1.176 . . . . 5.5499999999999998 111.874 -173.181 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -95.42 -39.03 10.21 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.998 1.319 . . . . 4.1500000000000004 113.455 166.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -72.72 -64.94 0.86 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.761 1.225 . . . . 4.5300000000000002 109.637 177.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -82.33 72.99 9.39 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 123.177 1.465 . . . . 3.1499999999999999 107.399 165.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.9 t -65.58 7.56 0.23 Allowed 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 114.877 1.436 . . . . 3.3199999999999998 114.877 178.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -49.71 157.19 0.59 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 129.452 3.101 . . . . 4.9699999999999998 114.322 -177.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -83.1 -19.64 62.43 Favored Glycine 0 N--CA 1.474 1.222 0 C-N-CA 124.313 0.959 . . . . 4.25 112.165 168.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -69.47 -29.45 67.12 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 128.806 2.842 . . . . 5.5 111.34 170.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.7 85.35 2.72 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.578 1.551 . . . . 2.9700000000000002 110.943 173.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.6 mmtp -111.53 170.71 7.94 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.728 2.411 . . . . 4.8300000000000001 110.081 176.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.551 ' CD ' ' HZ3' ' A' ' 35' ' ' LYS . 6.9 mm-40 -57.01 -42.11 79.73 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.637 -0.664 . . . . 4.3600000000000003 112.477 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -70.92 -4.2 23.31 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.824 1.416 . . . . 3.7200000000000002 114.824 173.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.4 m -101.56 -39.07 7.67 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.586 1.154 . . . . 3.0 110.715 172.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 34.8 mm -71.3 -36.24 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 125.213 1.405 . . . . 3.3500000000000001 112.242 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -66.55 -33.92 76.76 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.82 1.044 . . . . 4.04 113.82 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -83.57 -34.2 25.24 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 113.201 0.815 . . . . 2.8799999999999999 113.201 176.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.9 tt -54.51 -50.96 66.6 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.816 0.846 . . . . 3.3999999999999999 109.313 169.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.2 ttt -60.34 -40.42 90.62 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.254 1.022 . . . . 2.2599999999999998 113.009 172.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.2 ttmm -58.74 -35.25 72.41 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.206 1.002 . . . . 5.1500000000000004 112.553 176.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 68.1 m -80.44 -23.2 40.45 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.529 1.931 . . . . 2.4900000000000002 113.442 177.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.2 mt -73.66 -54.03 9.05 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.018 -1.051 . . . . 2.98 113.5 176.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -88.03 143.96 26.79 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.562 1.074 . . . . 1.9299999999999999 113.843 -167.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -115.83 7.08 14.45 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 125.252 1.421 . . . . 3.48 113.424 -177.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -118.8 -23.44 6.99 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.95 1.3 . . . . 3.4199999999999999 114.224 -170.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 54.3 m 58.77 39.55 24.05 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.448 2.299 . . . . 3.9700000000000002 112.577 -157.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.6 p30 -87.73 -26.02 23.14 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.018 1.327 . . . . 2.75 112.93 -173.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 75.35 4.4 4.09 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 130.693 3.597 . . . . 4.0499999999999998 114.346 -170.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -116.38 121.6 42.4 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.386 2.274 . . . . 2.7400000000000002 109.599 -179.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 29.0 mm -78.83 106.4 9.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 115.36 -0.836 . . . . 1.8999999999999999 109.431 177.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -58.67 147.99 30.81 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.037 1.335 . . . . 4.0999999999999996 109.468 169.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -57.29 -35.39 69.74 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 120.062 -1.649 . . . . 4.3899999999999997 111.726 173.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -50.38 -44.15 54.76 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.989 1.716 . . . . 4.6900000000000004 113.142 167.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -79.41 -40.96 28.78 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.284 1.834 . . . . 1.7 111.275 -177.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.413 ' HH ' HD13 ' A' ' 37' ' ' LEU . 6.3 t80 -58.16 -28.21 64.53 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.558 1.143 . . . . 3.1899999999999999 112.625 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 53.2 p -53.34 -33.23 52.72 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 121.025 -1.047 . . . . 3.3300000000000001 113.676 168.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.4 t -67.16 -41.63 87.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.298 1.039 . . . . 2.7799999999999998 109.725 -178.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -55.51 -57.15 13.12 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.648 0.779 . . . . 3.75 111.202 171.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.31 -33.91 73.05 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 113.06 0.763 . . . . 2.6800000000000002 113.06 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 63.7 m -70.32 -44.38 68.37 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.554 0.742 . . . . 1.74 111.481 -179.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 79.5 mtm -55.56 -41.01 72.67 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.482 0.583 . . . . 2.25 111.556 172.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.5 mt -73.23 -41.49 63.66 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.777 0.831 . . . . 2.1800000000000002 113.177 -179.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 3.5 p -67.75 -31.84 72.03 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 119.29 0.95 . . . . 4.1600000000000001 112.643 175.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 70.8 mtp -71.57 -37.73 71.03 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.791 -0.568 . . . . 2.7599999999999998 111.919 170.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.88 -36.6 83.87 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.461 1.028 . . . . 1.6899999999999999 113.213 176.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -66.76 -18.1 65.2 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.254 -0.904 . . . . 3.77 113.347 170.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -74.57 -39.85 62.0 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 119.938 1.245 . . . . 3.3300000000000001 112.915 174.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -58.53 -48.98 79.05 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.115 0.966 . . . . 4.3300000000000001 110.103 171.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.82 -46.09 64.19 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.468 1.507 . . . . 3.1699999999999999 112.876 174.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -67.09 -22.92 65.8 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.994 1.318 . . . . 3.6299999999999999 112.943 -179.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.1 mt -86.45 -24.99 25.45 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.425 1.09 . . . . 2.5 112.232 172.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.527 ' CD ' ' HZ2' ' A' ' 92' ' ' LYS . 55.5 mm-40 -89.23 -20.8 23.71 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 115.479 1.659 . . . . 2.7599999999999998 115.479 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -79.58 -34.97 40.38 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.55 1.14 . . . . 2.9199999999999999 112.39 167.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -91.55 60.21 4.0 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 123.397 1.57 . . . . 2.6800000000000002 112.163 -169.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.527 ' HZ2' ' CD ' ' A' ' 89' ' ' GLU . 50.4 mmtt . . . . . 0 C--O 1.251 1.172 0 C-N-CA 128.286 2.634 . . . . 4.5199999999999996 114.661 172.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.493 ' H1 ' ' CD ' ' B' ' 2' ' ' GLU . 67.9 mtm . . . . . 0 N--CA 1.476 0.861 0 N-CA-C 108.233 -1.025 . . . . 6.6200000000000001 108.233 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.493 ' CD ' ' H1 ' ' B' ' 1' ' ' MET . 5.6 mp0 -92.45 -17.86 23.99 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.71 1.204 . . . . 4.7599999999999998 113.639 -148.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 2.6 t -174.47 150.34 1.45 Allowed Pre-proline 0 N--CA 1.47 0.557 0 C-N-CA 127.58 2.352 . . . . 3.79 108.022 -172.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -60.39 -11.51 16.83 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.186 1.924 . . . . 2.0600000000000001 113.677 175.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.21 -33.19 59.26 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 119.356 0.98 . . . . 3.7799999999999998 112.574 171.02 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -58.97 -46.28 88.47 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 121.144 -0.973 . . . . 4.8399999999999999 109.484 167.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . 0.431 ' HE2' ' SD ' ' B' ' 1' ' ' MET . 8.5 mmtm -65.43 -29.95 70.69 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.134 1.161 . . . . 5.0 114.134 175.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.46 -43.99 79.73 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.661 0.784 . . . . 2.1800000000000002 111.795 170.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 48.8 mt -62.7 -41.63 99.22 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.014 0.926 . . . . 2.5800000000000001 112.057 174.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -55.7 24.34 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 118.814 0.734 . . . . 2.0899999999999999 109.845 167.313 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 42.0 m -54.91 -38.8 68.08 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.202 1.801 . . . . 2.2200000000000002 112.623 -174.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 88.4 mtp -53.37 -43.49 67.84 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.973 0.806 . . . . 3.7999999999999998 111.602 175.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 19.5 t -71.36 -34.81 55.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.824 1.249 . . . . 3.2200000000000002 111.47 176.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.9 m -62.3 -47.37 84.61 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 121.123 -0.986 . . . . 2.0299999999999998 112.387 174.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 p -62.55 -28.53 69.93 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.404 1.082 . . . . 2.5699999999999998 112.065 170.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -63.56 -59.53 4.5 Favored 'General case' 0 C--O 1.225 -0.202 0 O-C-N 124.001 0.813 . . . . 3.6600000000000001 109.63 -178.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -74.67 -27.96 60.64 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 117.426 -1.273 . . . . 4.5599999999999996 114.139 -177.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 24.8 mtpt -41.05 -47.75 3.16 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.773 1.229 . . . . 7.5 112.322 167.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -108.09 -36.64 6.27 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.786 1.234 . . . . 3.2400000000000002 113.06 -175.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 29.2 t -58.47 -26.57 63.52 Favored 'General case' 0 C--O 1.246 0.874 0 O-C-N 120.824 -1.173 . . . . 2.0600000000000001 112.95 173.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.7 -7.25 87.3 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 127.61 2.529 . . . . 1.78 115.402 175.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 11.7 mmp_? -57.92 -73.33 0.07 Allowed 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 120.118 1.959 . . . . 5.4100000000000001 110.362 168.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -127.06 161.92 27.27 Favored 'General case' 0 C--O 1.246 0.909 0 C-N-CA 126.546 1.938 . . . . 3.7799999999999998 110.65 -156.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.06 -136.26 48.44 Favored Glycine 0 C--N 1.338 0.686 0 C-N-CA 125.709 1.623 . . . . 2.2200000000000002 110.978 174.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 46.1 t -63.09 141.21 58.85 Favored 'General case' 0 C--O 1.248 1.011 0 CA-C-O 123.207 1.48 . . . . 4.6399999999999997 110.828 162.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 55.4 mttm -85.86 1.29 50.41 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.902 1.281 . . . . 9.1600000000000001 112.695 173.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 76.3 mt -88.96 -33.85 17.08 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.662 1.585 . . . . 5.71 112.083 164.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 65.5 p -109.2 152.05 25.68 Favored 'General case' 0 C--O 1.249 1.032 0 C-N-CA 125.292 1.437 . . . . 2.8300000000000001 112.686 -176.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.7 pp -105.47 112.88 26.14 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 114.932 -1.031 . . . . 3.2400000000000002 111.492 170.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 2.3 p -77.74 171.01 15.6 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.853 1.261 . . . . 2.7599999999999998 112.229 170.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 -41.19 -32.69 0.29 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 117.026 2.232 . . . . 4.3099999999999996 117.026 174.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.65 -41.78 15.99 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 120.161 -1.587 . . . . 5.4199999999999999 112.196 179.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -57.85 -38.4 75.62 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.561 1.544 . . . . 1.9099999999999999 109.821 169.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 tt -68.47 -50.66 50.78 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.019 1.728 . . . . 4.1299999999999999 113.129 176.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 7.6 ptpt -71.19 -15.57 62.48 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 120.085 1.311 . . . . 3.5600000000000001 114.27 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -72.99 -56.46 5.1 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.925 0.89 . . . . 3.8999999999999999 110.974 163.108 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.1 tt -52.21 -58.99 4.94 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 126.197 1.799 . . . . 3.1800000000000002 112.598 -175.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 33.1 mt -56.55 -50.06 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 N-CA-C 109.084 -0.71 . . . . 1.9199999999999999 109.084 -172.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -71.24 -13.24 61.84 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 124.047 0.939 . . . . 4.8899999999999997 113.482 -171.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -99.59 -33.28 10.7 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 114.195 1.183 . . . . 4.79 114.195 174.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -79.95 -50.04 11.0 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.011 0.823 . . . . 4.8600000000000003 110.29 173.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 39.6 mt -81.07 64.31 5.76 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 122.955 1.359 . . . . 3.7000000000000002 109.606 160.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 8.2 p -65.64 37.19 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.034 2.534 . . . . 4.7300000000000004 112.772 164.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 98.5 mt -121.41 172.38 8.09 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 126.689 1.996 . . . . 5.29 111.178 -171.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -75.39 22.44 1.67 Allowed Glycine 0 CA--C 1.535 1.312 0 CA-C-O 117.738 -1.59 . . . . 3.5499999999999998 114.666 176.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.19 -128.65 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 126.005 1.722 . . . . 9.4299999999999997 112.181 -171.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 14.3 ptp -62.85 146.07 53.57 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.813 1.642 . . . . 4.9400000000000004 114.494 -172.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -121.59 161.21 22.82 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.547 1.139 . . . . 4.8899999999999997 109.364 -173.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -66.79 -12.83 60.36 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 117.783 2.512 . . . . 4.5199999999999996 117.783 -155.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 12.9 t -72.75 -12.16 60.9 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 120.617 1.553 . . . . 3.0 114.199 167.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 7.7 m -103.73 -16.21 15.51 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.055 1.342 . . . . 3.5699999999999998 112.534 175.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 10.7 mm -64.53 -34.28 68.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.793 1.237 . . . . 2.9300000000000002 111.757 177.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.25 -18.97 57.21 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.195 0.998 . . . . 2.9100000000000001 112.646 176.456 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -80.47 -42.63 22.23 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.272 -0.893 . . . . 3.0299999999999998 110.802 166.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -57.25 -46.9 82.59 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.931 1.293 . . . . 3.7999999999999998 109.967 175.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 6.9 tpt -48.31 -57.73 5.59 Favored 'General case' 0 C--O 1.217 -0.648 0 C-N-CA 125.782 1.633 . . . . 2.8300000000000001 111.134 167.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.04 -25.44 67.83 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.25 1.42 . . . . 5.0300000000000002 114.017 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 15.1 m -82.11 -39.6 23.12 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.44 1.896 . . . . 2.2999999999999998 111.764 -178.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 12.4 mt -57.33 -59.06 5.69 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.116 1.366 . . . . 4.0599999999999996 111.044 158.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -80.77 47.92 1.02 Allowed 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 127.574 2.349 . . . . 1.7 112.103 -173.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -51.57 -24.42 5.34 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.31 1.844 . . . . 6.5 112.954 170.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 52.5 p30 -88.74 -6.88 57.13 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 115.616 1.709 . . . . 2.8399999999999999 115.616 172.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 19.1 m 69.42 25.22 5.53 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.258 1.823 . . . . 3.9399999999999999 115.417 163.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 p30 -100.71 -2.87 31.39 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.818 1.647 . . . . 2.48 113.048 -177.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 63.99 -7.64 0.2 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 131.154 3.782 . . . . 4.25 115.989 -174.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -92.83 145.78 24.13 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 123.706 0.802 . . . . 4.2999999999999998 108.965 174.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 42.6 mm -117.63 113.14 41.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 125.313 1.445 . . . . 2.6000000000000001 108.875 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.28 173.23 9.31 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.615 1.166 . . . . 2.73 110.571 161.344 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -54.39 -38.4 66.12 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.933 1.086 . . . . 4.4400000000000004 113.933 175.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 18.1 mtpp -71.47 -25.2 62.18 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.492 0.717 . . . . 5.4800000000000004 112.447 -177.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -75.66 -53.45 8.54 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.073 0.949 . . . . 1.6799999999999999 110.188 161.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -51.58 -37.49 50.05 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.498 1.919 . . . . 3.8700000000000001 114.874 -173.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 4.8 m -59.44 -26.49 65.24 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 117.791 -1.1 . . . . 2.4500000000000002 113.848 173.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 68.0 t -62.46 -47.12 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 CA-C-N 120.679 1.581 . . . . 2.54 110.277 178.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -57.89 -50.75 72.27 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.488 1.115 . . . . 2.6499999999999999 112.219 172.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 82.9 mt -67.85 -29.0 68.03 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 118.693 -0.67 . . . . 2.8300000000000001 112.31 -176.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 31.5 m -65.16 -50.75 64.77 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.219 1.008 . . . . 1.76 110.538 167.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 72.8 mtp -55.78 -41.61 74.32 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.207 1.003 . . . . 3.0099999999999998 113.197 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 39.8 mt -69.16 -50.56 46.56 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 118.531 0.605 . . . . 2.5099999999999998 112.094 174.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -65.84 -26.7 67.78 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 121.513 -0.742 . . . . 2.3399999999999999 111.984 -177.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 60.7 mmm -63.19 -44.49 95.22 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.554 1.142 . . . . 3.1099999999999999 112.553 165.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.1 -36.92 80.99 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.863 1.21 . . . . 1.9299999999999999 112.455 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -69.96 -23.31 63.16 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.966 1.099 . . . . 3.52 113.966 171.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -63.26 -48.59 77.55 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.463 1.029 . . . . 3.5 111.452 175.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -63.27 -43.71 97.17 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.764 1.225 . . . . 3.1400000000000001 112.214 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -54.36 -50.93 66.33 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.363 1.465 . . . . 4.2800000000000002 111.649 176.694 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -63.76 -27.44 69.2 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.121 0.968 . . . . 3.9100000000000001 111.882 -176.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 82.3 mt -81.17 -14.27 57.77 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 117.749 -1.12 . . . . 2.8399999999999999 112.834 177.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -92.96 -21.45 19.78 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.405 1.261 . . . . 4.3499999999999996 114.405 166.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -73.99 -36.5 64.52 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.372 1.469 . . . . 3.9900000000000002 112.816 175.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -99.25 47.06 0.97 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.745 1.218 . . . . 2.7799999999999998 112.655 -167.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt . . . . . 0 C--O 1.249 1.052 0 C-N-CA 127.752 2.421 . . . . 4.9900000000000002 114.797 -174.864 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.523 ' HA ' ' OE2' ' A' ' 6' ' ' GLU . 3.7 mmt . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 117.492 -1.242 . . . . 12.630000000000001 109.476 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.473 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 24.2 mt-10 -145.64 -101.41 0.1 Allowed 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 113.884 1.068 . . . . 6.3499999999999996 113.884 -139.316 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 9.9 p -107.19 178.19 1.14 Allowed Pre-proline 0 N--CA 1.48 1.069 0 C-N-CA 127.169 2.187 . . . . 2.71 113.059 -159.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.34 -24.9 19.03 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 122.201 1.934 . . . . 1.8500000000000001 113.986 170.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.2 tt -75.12 -41.37 58.61 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 119.645 1.112 . . . . 4.0700000000000003 111.173 173.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.523 ' OE2' ' HA ' ' A' ' 1' ' ' MET . 1.6 tm-20 -59.29 -43.8 92.55 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.654 0.782 . . . . 4.4100000000000001 110.772 173.667 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.3 mttp -68.34 -32.86 73.27 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.453 -1.404 . . . . 3.9700000000000002 113.224 173.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.96 -50.25 74.17 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.81 0.732 . . . . 1.9199999999999999 112.016 174.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.5 mt -69.75 -33.49 72.5 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.179 0.9 . . . . 3.27 111.873 178.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 88.7 m -57.84 -45.34 86.37 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 118.055 -0.974 . . . . 2.4700000000000002 111.111 169.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.4 m -58.16 -40.08 80.5 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.742 1.156 . . . . 2.3300000000000001 111.648 175.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 16.3 mtp -62.67 -52.37 63.59 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 118.65 0.659 . . . . 4.3600000000000003 110.779 174.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.0 t -58.0 -37.24 60.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 121.217 -0.927 . . . . 3.1800000000000002 112.725 176.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.4 m -67.15 -57.0 7.58 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.587 1.555 . . . . 2.5699999999999998 110.73 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.4 p -58.79 -41.08 85.86 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.329 0.651 . . . . 2.75 109.976 176.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.43 -65.61 0.66 Allowed 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 118.687 -0.673 . . . . 3.54 109.241 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -58.07 -36.21 72.48 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 120.078 1.308 . . . . 2.96 112.446 -177.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -63.37 -56.11 19.02 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 120.52 -1.363 . . . . 5.6600000000000001 113.348 174.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -70.95 -31.24 67.75 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.188 0.995 . . . . 4.29 111.459 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.0 t -58.23 -37.64 75.26 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 124.908 1.283 . . . . 2.48 111.017 169.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.98 6.88 11.01 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 127.906 2.67 . . . . 1.8 116.379 175.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -94.48 123.25 37.78 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 105.332 -2.099 . . . . 5.8799999999999999 105.332 150.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 60.77 169.42 0.09 Allowed 'General case' 0 CA--C 1.559 1.303 0 N-CA-C 116.069 1.877 . . . . 5.7199999999999998 116.069 161.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.25 -106.33 1.56 Allowed Glycine 0 N--CA 1.472 1.078 0 N-CA-C 108.39 -1.884 . . . . 2.5699999999999998 108.39 -175.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.7 m -129.63 -179.85 5.41 Favored 'General case' 0 C--O 1.24 0.592 0 O-C-N 121.741 -0.858 . . . . 4.0899999999999999 111.946 141.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.2 ttmm -66.87 -9.62 39.72 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 127.973 2.509 . . . . 5.0300000000000002 113.326 174.142 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.9 mt -84.5 -43.62 14.39 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.698 1.599 . . . . 4.6299999999999999 111.302 170.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.7 p -101.51 134.6 44.37 Favored 'General case' 0 C--O 1.243 0.712 0 C-N-CA 125.862 1.665 . . . . 2.5 112.241 -168.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 68.4 mt -88.02 96.04 10.36 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.354 1.462 . . . . 2.6699999999999999 108.848 162.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.4 m -66.87 157.62 32.66 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.227 -0.921 . . . . 3.3300000000000001 112.133 171.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 45.5 ttt-85 -50.63 -9.88 0.06 Allowed 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 128.115 2.566 . . . . 4.2000000000000002 117.527 -177.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.43 -44.0 7.04 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 119.895 -1.753 . . . . 5.9100000000000001 113.259 167.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -54.42 -45.95 73.1 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.084 1.354 . . . . 1.5600000000000001 109.711 170.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.3 tp -67.28 -40.41 86.13 Favored 'General case' 0 C--N 1.344 0.368 0 C-N-CA 123.203 0.601 . . . . 3.2799999999999998 112.307 -179.505 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -59.51 -44.54 93.09 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.88 0.764 . . . . 3.96 111.658 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.424 ' HG2' ' HE2' ' A' ' 40' ' ' LYS . 53.3 tt0 -63.92 -52.19 60.98 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-O 119.035 -0.507 . . . . 3.8999999999999999 112.096 173.329 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -61.69 -47.39 85.53 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.843 1.257 . . . . 4.0199999999999996 112.647 -174.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 48.0 mt -49.77 -47.39 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 119.378 0.99 . . . . 1.9399999999999999 109.291 170.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.3 tptt -74.08 -12.7 60.68 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 112.995 0.739 . . . . 6.3899999999999997 112.995 -173.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.424 ' HE2' ' HG2' ' A' ' 36' ' ' GLU . 68.1 mmtt -79.69 -40.32 29.26 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.894 1.224 . . . . 3.5499999999999998 112.573 163.57 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -67.06 -71.76 0.19 Allowed 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 108.973 -0.751 . . . . 4.71 108.973 175.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.5 mt -76.45 65.5 2.33 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.956 1.302 . . . . 4.0199999999999996 111.824 172.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 14.9 t -79.63 -27.02 40.98 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.885 1.674 . . . . 4.7999999999999998 112.942 174.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -54.7 1.63 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 130.159 3.384 . . . . 4.5599999999999996 120.086 -161.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 104.8 -23.49 30.96 Favored Glycine 0 N--CA 1.473 1.118 0 C-N-CA 125.861 1.696 . . . . 4.29 113.465 -175.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.465 ' CD ' ' HZ2' ' A' ' 48' ' ' LYS . 2.6 mm-40 -80.87 171.36 15.11 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 117.475 0.637 . . . . 5.46 112.19 160.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 31.1 tpp 72.6 106.3 0.07 Allowed 'General case' 0 C--O 1.235 0.328 0 C-N-CA 129.165 2.986 . . . . 2.5499999999999998 112.49 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.465 ' HZ2' ' CD ' ' A' ' 46' ' ' GLU . 5.0 mptt -131.1 157.3 43.48 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.429 1.892 . . . . 6.2300000000000004 111.129 -174.103 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -26.46 -74.88 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 128.34 2.656 . . . . 4.6699999999999999 114.921 -168.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.1 m -65.14 -17.0 64.11 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.543 1.312 . . . . 3.2799999999999998 114.543 -169.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -76.17 -15.69 60.01 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.246 -0.909 . . . . 3.4399999999999999 112.919 173.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 81.0 mt -75.11 -30.15 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.1 0.96 . . . . 2.7400000000000002 110.482 -178.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.2 -22.09 36.12 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.543 0.942 . . . . 2.6299999999999999 113.543 -179.643 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -68.75 -44.13 74.39 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 121.188 -0.945 . . . . 3.2400000000000002 109.886 157.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 17.1 tp -62.57 -39.03 92.36 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 117.684 -1.15 . . . . 2.7400000000000002 110.958 -176.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.6 mmm -51.95 -56.79 12.01 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 126.022 1.729 . . . . 2.6600000000000001 112.113 167.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.4 tmmm? -58.91 -31.34 68.54 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.567 1.547 . . . . 4.3099999999999996 112.874 177.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 20.6 m -88.72 -26.86 21.56 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.82 1.648 . . . . 2.52 112.775 -175.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.6 mp -66.52 -44.0 83.71 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.099 0.863 . . . . 4.2999999999999998 110.76 160.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -58.69 147.07 34.24 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 123.134 1.445 . . . . 2.9500000000000002 113.617 174.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.38 15.24 13.87 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.852 1.261 . . . . 3.5 111.876 161.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 27.7 p-10 -137.85 -48.63 0.56 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.099 1.759 . . . . 3.9100000000000001 112.851 -177.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 2.9 t 95.62 104.18 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 129.163 2.985 . . . . 3.8399999999999999 108.383 -173.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.8 p30 -145.64 -139.31 0.1 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.736 1.215 . . . . 4.1799999999999997 109.349 -178.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -141.38 24.56 2.09 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.085 0.954 . . . . 4.7800000000000002 111.068 164.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -144.89 136.78 25.73 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 126.026 1.73 . . . . 3.2999999999999998 112.683 -173.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 39.8 mm -120.94 124.31 72.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 125.515 1.526 . . . . 2.23 110.274 -173.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.4 -176.23 3.33 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.967 1.707 . . . . 2.9700000000000002 111.794 168.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -57.44 -37.5 72.92 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 116.326 1.973 . . . . 4.8899999999999997 116.326 175.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 43.5 mtmt -74.58 -31.95 62.22 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.835 0.854 . . . . 4.4100000000000001 111.964 -178.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -69.76 -65.04 0.77 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.63 0.772 . . . . 2.2200000000000002 109.337 162.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -47.34 -36.45 9.49 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.996 2.119 . . . . 3.5499999999999998 115.224 -174.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.5 m -70.0 -19.38 63.33 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 120.314 -1.491 . . . . 2.8999999999999999 111.97 -177.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -74.05 -22.29 18.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 O-C-N 121.292 -0.88 . . . . 3.3199999999999998 112.696 173.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -65.28 -66.5 0.54 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.449 1.5 . . . . 4.1600000000000001 110.477 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.75 -33.2 55.01 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.316 1.446 . . . . 3.6000000000000001 112.523 170.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.6 m -59.57 -44.72 93.2 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.854 1.206 . . . . 1.96 112.139 173.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 51.4 mtp -60.23 -42.94 96.28 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.933 0.788 . . . . 2.7000000000000002 111.234 178.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 44.0 mt -66.57 -50.04 64.41 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.332 1.053 . . . . 2.0800000000000001 110.87 178.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 3.2 t -64.31 -27.26 68.91 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.269 1.428 . . . . 2.0499999999999998 113.051 -177.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 71.8 mtm -72.63 -39.39 67.25 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.051 1.13 . . . . 4.8200000000000003 114.051 165.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.6 -44.37 82.29 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.612 1.096 . . . . 2.27 112.036 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -60.9 -24.75 66.22 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.669 0.618 . . . . 3.48 112.669 173.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -65.93 -51.98 53.83 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 118.978 0.808 . . . . 3.4300000000000002 112.083 175.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -58.8 -51.05 71.63 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.207 1.803 . . . . 2.9199999999999999 111.581 174.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -50.93 -47.14 61.02 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.62 1.568 . . . . 4.0899999999999999 111.439 178.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -64.41 -33.76 76.62 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.913 0.885 . . . . 3.8900000000000001 112.852 -178.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.3 mt -74.61 -18.39 60.57 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.819 0.848 . . . . 2.77 112.745 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -96.96 -13.91 22.05 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.742 1.386 . . . . 4.8499999999999996 114.742 172.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -93.37 -52.1 4.68 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.343 1.457 . . . . 3.1499999999999999 112.668 179.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -83.46 43.88 0.92 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.066 1.346 . . . . 3.0 112.113 179.068 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.6 mmtm . . . . . 0 C--O 1.251 1.145 0 CA-C-O 114.737 -2.554 . . . . 5.8499999999999996 115.08 171.721 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 108.97 -0.752 . . . . 5.9800000000000004 108.97 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -115.06 -171.5 1.96 Allowed 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 130.907 3.683 . . . . 4.9500000000000002 109.644 -179.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 74.1 p -94.16 164.88 18.96 Favored Pre-proline 0 N--CA 1.47 0.552 0 C-N-CA 124.689 1.195 . . . . 2.6800000000000002 110.225 165.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -64.72 -6.62 12.74 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 123.04 2.493 . . . . 1.6100000000000001 114.692 175.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 10.6 mp -76.91 -55.52 5.4 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.907 1.231 . . . . 4.6900000000000004 111.165 174.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -59.62 -29.85 68.29 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-O 122.297 1.046 . . . . 4.3099999999999996 111.82 170.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.74 -37.15 65.17 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 119.411 -2.055 . . . . 5.7599999999999998 113.869 170.495 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.02 -45.46 93.47 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.507 1.123 . . . . 2.1299999999999999 112.467 170.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 58.8 mt -58.45 -44.64 89.31 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 124.758 1.223 . . . . 2.46 111.425 173.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 64.7 m -53.48 -56.17 19.2 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 118.272 -0.871 . . . . 2.23 110.711 169.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 94.9 m -58.86 -37.1 75.73 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.144 1.378 . . . . 2.5699999999999998 111.811 -178.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.2 mmm -59.06 -51.81 68.45 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.304 1.042 . . . . 4.2000000000000002 112.674 171.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 85.6 t -68.79 -31.67 51.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 121.126 -0.984 . . . . 2.8700000000000001 111.909 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 31.8 m -59.02 -59.86 4.8 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.131 1.373 . . . . 2.2000000000000002 110.178 175.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.7 -31.48 71.47 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 124.743 1.217 . . . . 3.3100000000000001 110.046 -174.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -63.06 -46.73 86.13 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.892 0.701 . . . . 3.0699999999999998 112.892 174.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -61.99 -39.32 91.82 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.996 -1.065 . . . . 2.7599999999999998 112.408 175.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.475 ' HE2' ' CZ ' ' B' ' 19' ' ' TYR . 4.9 tttt -53.65 -33.44 55.24 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 125.501 1.52 . . . . 6.6600000000000001 113.468 171.341 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.475 ' CZ ' ' HE2' ' B' ' 18' ' ' LYS . 67.1 m-85 -96.02 -37.25 10.72 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 115.614 1.709 . . . . 3.5699999999999998 115.614 176.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 62.8 m -66.66 -22.69 66.09 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 116.661 2.097 . . . . 2.1200000000000001 116.661 -172.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.02 -17.18 63.56 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-O 118.43 -1.206 . . . . 2.0600000000000001 113.982 179.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 28.7 ttt-85 -58.07 -26.99 63.23 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.408 2.283 . . . . 4.5199999999999996 114.107 -175.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.426 ' C ' ' H ' ' B' ' 25' ' ' SER . 22.5 tt0 -151.33 144.41 24.62 Favored 'General case' 0 C--O 1.243 0.76 0 C-N-CA 128.617 2.767 . . . . 3.79 108.382 178.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.18 -12.76 0.58 Allowed Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.318 1.437 . . . . 2.2799999999999998 114.766 -172.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' SER . . . . . 0.426 ' H ' ' C ' ' B' ' 23' ' ' GLU . 0.9 OUTLIER 63.72 -159.66 0.3 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.56 1.944 . . . . 7.2400000000000002 110.747 -161.173 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 31.5 mmtm 73.62 -176.28 0.16 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.306 2.242 . . . . 9.9100000000000001 113.193 163.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -72.82 -9.3 58.51 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.79 1.236 . . . . 3.6299999999999999 113.521 168.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 5.9 p -90.43 135.21 33.83 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.974 1.309 . . . . 2.1699999999999999 110.954 -171.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -114.93 108.42 16.69 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.42 1.888 . . . . 3.2200000000000002 110.691 -159.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.429 ' HA ' ' HA ' ' B' ' 66' ' ' GLU . 0.9 OUTLIER -76.17 162.29 28.1 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 119.394 -2.066 . . . . 3.2400000000000002 115.364 -171.278 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -44.23 -38.28 3.71 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.728 0.811 . . . . 4.3700000000000001 112.176 169.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.66 -41.51 26.76 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.773 -1.204 . . . . 5.2400000000000002 114.055 177.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -58.31 -40.16 81.3 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.139 0.575 . . . . 1.76 109.978 173.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 18.3 tp -65.68 -41.86 91.93 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.818 1.247 . . . . 2.98 112.669 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 20.7 mtpt -49.73 -53.06 27.08 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 120.305 1.411 . . . . 4.2800000000000002 111.483 176.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -67.14 -41.61 85.79 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 117.959 -1.02 . . . . 3.1200000000000001 113.305 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.6 tt -54.87 -54.21 45.41 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.618 1.099 . . . . 2.9300000000000002 110.471 175.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 29.1 mt -57.88 -48.57 83.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 118.186 -0.911 . . . . 2.3599999999999999 109.856 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -75.65 -8.12 56.01 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 115.205 1.557 . . . . 6.0300000000000002 115.205 -172.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -108.29 -45.24 3.95 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.162 1.385 . . . . 4.5099999999999998 112.353 174.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -80.23 -19.83 46.01 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.122 0.569 . . . . 5.5099999999999998 111.357 -178.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mp -128.66 174.14 9.68 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.351 1.861 . . . . 4.7300000000000004 108.77 156.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 27.0 p -150.91 4.17 0.47 Allowed 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 116.755 2.132 . . . . 3.52 116.755 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 4.5 mp -43.16 -32.34 0.72 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 117.405 2.372 . . . . 3.7999999999999998 117.405 -168.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.64 -26.98 2.6 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 124.82 1.2 . . . . 3.8900000000000001 113.515 -178.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -61.03 -25.82 67.18 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.471 1.135 . . . . 5.8399999999999999 113.007 167.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.92 72.97 0.18 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 122.839 1.304 . . . . 3.2000000000000002 110.622 147.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.1 mppt? -66.13 159.23 26.64 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.05 -0.977 . . . . 5.4500000000000002 108.742 166.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -52.2 -37.66 55.55 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 113.359 0.874 . . . . 4.96 113.359 -177.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 35.2 t -62.37 -16.7 56.18 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 115.021 1.489 . . . . 4.46 115.021 174.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 3.3 t -106.33 -3.38 21.22 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.419 1.488 . . . . 3.6699999999999999 112.264 173.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 19.6 mm -80.2 -44.0 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 O-C-N 120.025 -1.672 . . . . 2.8399999999999999 110.839 175.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -70.98 -42.58 69.48 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.55 0.574 . . . . 3.3700000000000001 112.55 -178.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.95 -35.08 69.48 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 120.43 -1.419 . . . . 2.4300000000000002 112.483 -177.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -54.42 -47.88 72.28 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.324 1.049 . . . . 3.3999999999999999 110.285 164.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.49 -44.33 89.35 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.849 1.26 . . . . 2.6899999999999999 112.378 177.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -69.6 -27.22 64.91 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 120.832 -1.167 . . . . 4.8899999999999997 113.597 176.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 23.0 t -71.71 -36.13 70.44 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 121.125 -0.984 . . . . 3.29 111.523 170.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 8.7 mp -62.78 -50.33 71.47 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-O 118.352 -0.833 . . . . 3.8599999999999999 112.102 168.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -87.57 82.4 7.46 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 122.086 0.946 . . . . 1.6699999999999999 113.293 -169.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -21.65 58.74 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.121 1.156 . . . . 4.5 114.121 -177.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -84.69 -22.89 29.62 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.28 0.945 . . . . 2.7000000000000002 112.101 175.599 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 32.2 t 58.5 38.92 25.44 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.576 1.151 . . . . 2.9500000000000002 112.138 -167.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -88.54 -119.24 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.478 1.511 . . . . 3.04 107.152 176.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -148.6 -3.82 0.46 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 117.447 2.388 . . . . 4.9199999999999999 117.447 166.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . 0.429 ' HA ' ' HA ' ' B' ' 30' ' ' SER . 16.8 mt-10 -118.5 146.69 44.33 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 123.175 1.464 . . . . 3.25 112.702 166.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 79.1 mt -103.07 115.62 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 126.958 2.103 . . . . 3.0600000000000001 109.405 -175.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.74 161.73 25.57 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.808 2.043 . . . . 2.6299999999999999 111.2 169.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.2 -31.93 67.79 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 119.982 -1.699 . . . . 3.7000000000000002 114.749 -174.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.9 mtmp? -83.11 -16.98 44.7 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.222 1.409 . . . . 4.0999999999999996 113.151 177.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -70.66 -61.85 1.61 Allowed 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 107.389 -1.338 . . . . 1.99 107.389 156.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -58.45 -29.86 66.49 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 127.975 2.51 . . . . 4.0199999999999996 117.3 -171.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 60.2 p -58.29 -24.01 58.15 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 120.777 1.626 . . . . 2.79 113.745 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.9 p -67.56 -22.82 28.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 O-C-N 121.529 -0.732 . . . . 3.2999999999999998 112.578 174.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -63.73 -51.15 66.21 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.233 1.013 . . . . 4.6600000000000001 110.397 174.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 39.5 mt -60.74 -44.56 96.52 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 124.183 0.993 . . . . 2.9199999999999999 110.39 176.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 43.4 m -54.69 -54.35 42.94 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.743 0.817 . . . . 2.0899999999999999 111.423 176.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 48.5 mtm -60.32 -45.15 94.43 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.403 0.681 . . . . 2.6400000000000001 112.124 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 82.4 mt -63.17 -43.71 97.5 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 118.467 0.576 . . . . 3.1000000000000001 112.354 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 93.3 m -67.76 -33.82 75.6 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 122.742 0.417 . . . . 3.0899999999999999 112.073 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 64.5 mtp -68.56 -38.76 81.04 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 118.777 0.717 . . . . 2.8900000000000001 112.847 172.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.23 -38.19 66.13 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.482 1.037 . . . . 2.0800000000000001 112.351 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -68.31 -25.66 65.24 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.403 1.001 . . . . 3.2999999999999998 113.362 177.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 17.7 t30 -59.54 -46.09 89.89 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.358 0.981 . . . . 2.9900000000000002 111.499 169.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.89 -34.69 44.55 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.307 1.443 . . . . 3.1400000000000001 111.973 -175.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -53.32 -54.49 35.77 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.331 1.452 . . . . 4.4000000000000004 110.019 166.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -54.11 -36.28 63.05 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.895 1.278 . . . . 3.8900000000000001 112.757 177.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 55.1 mt -74.16 -19.16 60.65 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.916 1.08 . . . . 2.9300000000000002 113.916 178.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -101.83 -14.94 17.07 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.567 1.321 . . . . 3.5699999999999998 114.567 171.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -96.47 -48.45 5.56 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.312 1.845 . . . . 4.7599999999999998 112.548 -176.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -87.83 46.75 1.41 Allowed 'General case' 0 CA--C 1.548 0.866 0 CA-C-O 122.903 1.335 . . . . 4.2999999999999998 111.316 173.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm . . . . . 0 C--O 1.25 1.107 0 CA-C-O 114.903 -2.475 . . . . 5.5700000000000003 114.894 168.874 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.6 tpt . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 107.244 -1.391 . . . . 7.8200000000000003 107.244 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -110.88 -64.87 1.22 Allowed 'General case' 0 C--N 1.327 -0.38 0 O-C-N 124.505 1.128 . . . . 3.8300000000000001 108.648 -153.554 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.9 t 174.13 150.76 0.25 Allowed Pre-proline 0 C--O 1.236 0.386 0 C-N-CA 127.331 2.253 . . . . 3.5499999999999998 107.612 -163.498 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -73.51 -24.25 16.38 Favored 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 121.925 1.75 . . . . 1.6899999999999999 112.437 175.564 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -69.54 -43.05 73.79 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.141 -0.933 . . . . 4.3600000000000003 112.584 -171.557 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -53.08 -34.52 56.96 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 122.137 0.97 . . . . 4.2400000000000002 112.563 171.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 46.9 mttt -80.68 -25.52 38.16 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.67 -1.269 . . . . 5.0 111.455 -179.037 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.47 -42.23 62.16 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.027 0.931 . . . . 1.95 111.198 169.461 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 83.7 mt -64.3 -43.02 96.04 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.185 0.994 . . . . 2.3599999999999999 111.224 171.741 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 87.2 m -55.35 -42.84 74.41 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.136 -0.977 . . . . 2.4399999999999999 111.664 167.912 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.5 m -61.63 -38.34 87.3 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 119.763 1.165 . . . . 2.1400000000000001 111.387 178.73 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 33.1 ttm -56.34 -53.88 52.06 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 118.473 0.579 . . . . 3.7599999999999998 111.388 169.924 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 93.2 t -62.39 -37.07 77.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-N 118.798 0.727 . . . . 2.8199999999999998 112.498 178.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 76.0 m -57.43 -59.17 5.55 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.907 1.283 . . . . 1.8400000000000001 110.408 177.315 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.21 -34.28 70.7 Favored 'General case' 0 CA--C 1.521 -0.167 0 C-N-CA 123.789 0.836 . . . . 3.0499999999999998 110.599 -170.109 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -57.59 -40.35 78.84 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.344 0.658 . . . . 3.7999999999999998 110.976 174.612 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 36.6 m170 -78.81 -28.17 44.45 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.931 1.086 . . . . 3.1200000000000001 113.931 176.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.1 mtmp? -60.27 -55.72 30.33 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.366 1.439 . . . . 5.5 111.438 166.553 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -71.24 -32.28 68.57 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.516 -0.74 . . . . 3.3199999999999998 111.96 -177.485 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.0 t -73.04 -6.43 45.49 Favored 'General case' 0 C--O 1.247 0.948 0 N-CA-C 116.465 2.024 . . . . 2.6699999999999999 116.465 -178.389 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.7 -12.62 74.34 Favored Glycine 0 CA--C 1.539 1.551 0 CA-C-O 119.061 -0.855 . . . . 2.2400000000000002 113.02 166.338 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -60.98 -31.35 70.94 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.507 1.523 . . . . 7.5300000000000002 113.652 -177.315 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 173.13 -149.95 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 129.662 3.185 . . . . 4.2199999999999998 111.706 164.337 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.04 -149.44 21.8 Favored Glycine 0 N--CA 1.476 1.352 0 O-C-N 120.351 -1.468 . . . . 2.8199999999999998 111.973 -175.229 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.7 m -78.48 -177.49 5.31 Favored 'General case' 0 CA--C 1.55 0.975 0 O-C-N 121.007 -1.29 . . . . 2.9199999999999999 112.072 158.351 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.48 ' HZ2' ' C ' ' B' ' 92' ' ' LYS . 38.1 ttmt -84.54 -32.99 23.58 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.191 1.397 . . . . 5.0300000000000002 111.726 169.579 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.07 6.84 14.99 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.923 1.689 . . . . 4.1299999999999999 114.711 178.022 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 24.1 p -146.95 150.9 36.09 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.843 1.657 . . . . 1.8200000000000001 110.554 -170.141 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 79.1 mt -116.82 109.36 16.99 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.248 1.019 . . . . 2.5600000000000001 112.331 174.603 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.0 t -77.46 151.93 34.47 Favored 'General case' 0 CA--C 1.549 0.924 0 O-C-N 121.325 -0.859 . . . . 2.4300000000000002 111.886 173.316 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.42 -46.19 4.63 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 126.087 1.755 . . . . 6.8700000000000001 115.604 -172.169 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.38 -18.06 61.21 Favored 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 115.051 1.5 . . . . 5.4400000000000004 115.051 178.996 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -90.73 -45.57 8.77 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 128.77 2.828 . . . . 3.1499999999999999 109.837 175.276 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.19 -31.04 72.01 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.281 1.033 . . . . 4.0300000000000002 112.906 175.318 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.95 -17.72 65.05 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.754 1.39 . . . . 6.2400000000000002 114.754 177.097 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.22 -58.2 3.42 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.38 1.072 . . . . 3.6899999999999999 108.894 171.529 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.9 tt -50.03 -56.02 12.44 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.729 1.611 . . . . 3.0600000000000001 112.121 -179.145 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.5 mt -53.69 -60.19 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 CA-C-N 118.85 0.75 . . . . 1.95 109.937 -175.142 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.4 tptt -72.39 -9.64 58.77 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 113.264 0.839 . . . . 6.6399999999999997 113.264 -174.794 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 46.0 mmtt -91.69 -35.91 13.91 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.82 1.648 . . . . 4.2800000000000002 114.988 173.702 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -104.25 -44.38 4.98 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.652 0.781 . . . . 5.1399999999999997 112.094 -175.04 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -104.47 61.4 0.72 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.434 1.894 . . . . 3.75 107.92 175.131 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 59.1 m -45.8 -64.94 0.62 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.537 1.535 . . . . 4.0499999999999998 113.066 -166.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 95.9 mt 65.19 152.17 0.05 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 127.862 2.465 . . . . 5.5 115.974 168.426 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.57 -25.29 63.35 Favored Glycine 0 N--CA 1.474 1.199 0 O-C-N 121.378 -0.826 . . . . 3.54 111.336 171.513 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.48 -160.2 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 129.484 3.114 . . . . 6.7000000000000002 110.894 173.312 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 17.8 mmt 43.5 93.38 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.22 1.808 . . . . 3.1200000000000001 115.187 -179.729 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.53 126.96 50.99 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.131 -1.062 . . . . 4.8399999999999999 108.131 164.076 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -12.73 -83.7 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 127.705 2.402 . . . . 4.9299999999999997 114.951 -157.652 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.5 t -60.08 -11.44 5.98 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.884 1.809 . . . . 4.4500000000000002 115.884 -172.009 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.9 t -61.53 -13.88 24.97 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 120.749 -1.219 . . . . 2.8599999999999999 113.513 164.684 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 88.9 mt -77.03 -21.35 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 126.585 1.954 . . . . 2.3500000000000001 111.828 171.156 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -70.66 -53.53 15.41 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.858 0.754 . . . . 3.0099999999999998 111.3 -169.462 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -67.47 -34.01 76.29 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 121.51 -0.744 . . . . 3.2999999999999998 111.889 172.467 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.6 tp -54.73 -59.37 4.8 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 118.52 -0.752 . . . . 2.9500000000000002 110.186 174.11 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -67.4 -33.02 74.32 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.465 0.575 . . . . 3.1299999999999999 112.161 -179.323 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.5 tmtm? -65.78 -22.25 66.56 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 120.782 -1.198 . . . . 7.1100000000000003 112.885 169.455 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.2 t -86.89 -28.33 22.88 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.352 1.861 . . . . 2.27 112.637 170.054 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.7 mt -65.83 -33.71 76.48 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.436 -0.79 . . . . 2.8999999999999999 111.335 167.444 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.422 ' CG ' ' H ' ' A' ' 64' ' ' ASP . 6.0 t0 -68.32 99.14 0.89 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 122.636 1.208 . . . . 2.3999999999999999 111.818 176.925 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -67.42 -23.6 65.56 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.691 1.196 . . . . 6.46 113.697 -176.764 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -83.9 -29.81 26.86 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.322 1.449 . . . . 3.1600000000000001 112.079 167.81 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.7 t 72.25 41.67 0.61 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 128.707 2.803 . . . . 3.9700000000000002 112.143 -167.569 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.422 ' H ' ' CG ' ' A' ' 60' ' ' ASP . 3.2 p30 -94.9 -117.82 0.1 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.736 1.615 . . . . 3.8599999999999999 106.775 -179.656 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -153.04 -9.12 0.17 Allowed 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 116.394 1.998 . . . . 4.4500000000000002 116.394 173.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -101.41 128.97 47.37 Favored 'General case' 0 C--O 1.242 0.665 0 N-CA-C 106.857 -1.534 . . . . 2.6000000000000001 106.857 171.788 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 20.1 mm -96.54 89.74 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 124.451 1.1 . . . . 2.1099999999999999 109.586 174.086 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -56.68 151.95 13.02 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.698 1.199 . . . . 2.98 111.3 165.106 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -46.95 -39.92 13.31 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.356 1.243 . . . . 3.4100000000000001 114.356 -175.831 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.58 -10.04 58.53 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.708 1.203 . . . . 4.1900000000000004 113.906 -179.544 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -73.1 -63.2 1.23 Allowed 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 106.633 -1.617 . . . . 2.04 106.633 155.599 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -49.04 -30.84 6.75 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 128.375 2.67 . . . . 3.29 115.74 -173.931 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.5 m -53.45 -30.54 41.15 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.597 -1.314 . . . . 2.8700000000000001 113.229 173.158 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.0 m -68.98 -27.01 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 CA-C-N 119.903 1.229 . . . . 3.6899999999999999 112.935 179.816 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -59.47 -55.09 39.06 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.11 0.964 . . . . 2.9199999999999999 109.968 173.416 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 52.3 mt -71.12 -25.91 62.79 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.015 -0.993 . . . . 3.1499999999999999 111.481 -179.599 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 41.5 m -64.48 -51.53 62.56 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.154 0.888 . . . . 2.1200000000000001 111.33 169.582 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 29.3 mtm -58.1 -45.57 87.02 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.455 1.025 . . . . 2.7999999999999998 111.909 179.121 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 72.6 mt -67.15 -38.18 85.08 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.905 -0.497 . . . . 2.1400000000000001 112.085 178.563 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 33.5 t -63.28 -31.6 72.8 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.248 0.619 . . . . 3.1200000000000001 112.387 172.541 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 71.1 mtp -68.39 -40.19 81.46 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 119.701 1.137 . . . . 2.52 112.324 167.448 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.15 -42.52 99.47 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.762 0.71 . . . . 1.6599999999999999 112.654 -179.112 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -60.69 -26.68 67.3 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.876 1.065 . . . . 4.3399999999999999 113.876 173.354 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -69.96 -37.7 75.88 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.466 1.03 . . . . 2.6400000000000001 112.796 176.402 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -73.04 -38.5 66.48 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.687 0.795 . . . . 3.2000000000000002 111.253 176.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -53.16 -51.47 61.9 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.131 1.372 . . . . 3.8300000000000001 110.959 172.198 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -55.54 -27.35 48.38 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.387 1.475 . . . . 3.5499999999999998 113.156 178.2 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 44.3 mt -84.03 -12.21 55.55 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.589 1.156 . . . . 2.5699999999999998 113.496 178.776 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.453 ' CD ' ' HZ2' ' A' ' 92' ' ' LYS . 82.0 mm-40 -90.88 -38.34 12.99 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.266 1.026 . . . . 2.79 113.147 165.882 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -62.71 -34.57 77.43 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.975 2.11 . . . . 3.4300000000000002 114.637 -178.245 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -99.11 22.21 10.7 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.061 1.134 . . . . 2.8100000000000001 114.061 -168.498 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.453 ' HZ2' ' CD ' ' A' ' 89' ' ' GLU . 52.8 mttp . . . . . 0 C--O 1.248 0.993 0 N-CA-C 115.623 1.712 . . . . 4.79 115.623 176.801 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 71.8 mtm . . . . . 0 N--CA 1.483 1.191 0 N-CA-C 108.777 -0.824 . . . . 6.4100000000000001 108.777 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -150.24 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 125.755 1.622 . . . . 5.0700000000000003 109.962 131.869 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 64.2 p -145.39 159.84 47.18 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 125.327 1.451 . . . . 3.1299999999999999 112.626 -168.681 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -67.32 -21.25 47.82 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.899 2.4 . . . . 2.0099999999999998 112.855 172.404 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -63.49 -45.79 89.14 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-N 118.877 0.762 . . . . 3.5099999999999998 110.487 166.219 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . 0.43 ' CD ' ' HZ3' ' B' ' 7' ' ' LYS . 0.4 OUTLIER -61.51 -48.19 82.18 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 118.594 0.634 . . . . 3.7599999999999998 110.579 173.233 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . 0.44 ' HE3' ' HA ' ' B' ' 7' ' ' LYS . 0.0 OUTLIER -58.09 -25.17 60.98 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 120.576 -1.327 . . . . 4.9800000000000004 114.508 175.026 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.57 -41.69 99.09 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.498 0.59 . . . . 2.1800000000000002 110.924 176.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 29.2 mt -57.78 -48.62 79.15 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.251 1.02 . . . . 2.75 111.324 172.963 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.1 -48.27 79.03 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.919 0.888 . . . . 1.9299999999999999 111.018 177.622 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -72.54 -32.54 66.17 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.163 -0.922 . . . . 3.77 111.932 -177.817 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 7.6 mtp -64.42 -41.5 96.57 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.486 1.114 . . . . 3.6899999999999999 112.328 171.796 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.78 -36.89 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 119.629 1.104 . . . . 2.8700000000000001 111.422 169.328 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 88.7 m -63.77 -54.77 30.04 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 118.069 -0.967 . . . . 1.9099999999999999 110.89 -176.524 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.7 p -63.7 -44.64 93.09 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.056 0.942 . . . . 2.2200000000000002 110.03 176.949 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -65.17 -47.12 78.1 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.484 -0.486 . . . . 3.5699999999999998 110.886 -174.472 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -67.51 -44.81 77.53 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 120.796 -1.19 . . . . 2.5800000000000001 111.968 177.719 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -65.34 -20.81 66.56 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 120.78 -1.2 . . . . 5.4900000000000002 113.839 178.727 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -98.73 -1.18 41.18 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.625 0.972 . . . . 3.5499999999999998 113.625 164.814 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 41.8 m -87.26 -48.93 7.61 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 120.702 1.592 . . . . 2.2000000000000002 113.173 175.535 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.28 13.0 57.06 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.376 1.941 . . . . 1.78 112.693 174.478 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 8.8 ttm-85 -65.11 -59.33 4.23 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.033 1.333 . . . . 3.6099999999999999 109.507 169.451 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -156.35 -172.43 4.08 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 126.263 1.825 . . . . 3.6600000000000001 110.461 -169.506 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.59 -135.69 47.24 Favored Glycine 0 N--CA 1.472 1.092 0 O-C-N 120.962 -1.086 . . . . 3.2599999999999998 110.667 -178.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 6.6 t -82.19 158.89 23.41 Favored 'General case' 0 C--O 1.247 0.931 0 CA-C-O 123.329 1.538 . . . . 4.2699999999999996 111.2 154.723 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -84.52 155.75 22.0 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.993 1.317 . . . . 8.2599999999999998 110.33 170.899 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.5 tt 71.42 -21.59 0.21 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.516 1.927 . . . . 4.2599999999999998 112.868 -166.45 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.3 p -107.2 150.58 26.47 Favored 'General case' 0 C--O 1.253 1.237 0 C-N-CA 126.223 1.809 . . . . 1.8300000000000001 115.099 174.337 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -98.48 108.51 21.22 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 129.784 3.233 . . . . 3.3900000000000001 111.712 173.045 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 9.5 t -85.51 161.94 19.14 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.282 1.033 . . . . 2.8100000000000001 113.279 174.773 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 33.5 ttt85 -50.2 -19.53 0.8 Allowed 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 117.293 2.331 . . . . 4.4500000000000002 117.293 -174.964 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.21 -25.35 12.02 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.286 1.217 . . . . 5.0300000000000002 114.286 170.702 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -62.12 -51.91 66.0 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 108.362 -0.977 . . . . 2.0499999999999998 108.362 169.485 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 8.1 tp -60.31 -38.79 84.77 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 125.172 1.389 . . . . 2.9399999999999999 112.651 179.173 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -55.74 -41.75 74.37 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 122.098 -0.376 . . . . 3.96 110.851 175.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -65.34 -49.52 69.08 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 117.834 -1.079 . . . . 3.4100000000000001 113.293 169.631 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 tt -53.25 -48.9 67.85 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 120.155 1.343 . . . . 3.1800000000000002 111.671 -179.259 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 5.8 mt -65.35 -40.18 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 120.087 1.312 . . . . 2.1200000000000001 110.583 178.915 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -65.2 0.17 1.48 Allowed 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 114.572 1.323 . . . . 6.1900000000000004 114.572 171.566 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -119.78 -45.93 2.47 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.662 1.585 . . . . 4.21 112.971 177.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -72.72 -29.34 63.27 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-O 117.418 -1.277 . . . . 4.29 112.785 175.367 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -125.24 -81.7 0.63 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.909 1.684 . . . . 2.7400000000000002 110.469 -175.978 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.5 t 64.07 -44.24 0.27 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 129.01 2.924 . . . . 4.8899999999999997 115.745 -175.555 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 4.3 pp -61.92 -15.39 42.67 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 127.771 2.429 . . . . 4.1299999999999999 115.941 -167.707 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -79.92 13.17 26.32 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 124.346 0.974 . . . . 4.1399999999999997 114.148 171.757 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 61.43 56.07 2.69 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.205 2.202 . . . . 7.1799999999999997 111.811 -176.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.77 74.41 0.59 Allowed 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 115.624 1.712 . . . . 3.3100000000000001 115.624 -161.639 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -88.38 168.88 12.29 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 127.367 2.267 . . . . 6.2400000000000002 112.443 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -48.1 -53.61 15.96 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.789 1.236 . . . . 4.6200000000000001 113.146 -178.83 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 21.5 t -66.13 5.11 0.56 Allowed 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 115.652 1.723 . . . . 3.8999999999999999 115.652 -179.605 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 43.0 t -119.41 -40.63 2.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.17 1.388 . . . . 2.5099999999999998 111.765 166.732 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 26.0 mm -59.67 -33.93 53.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.612 1.565 . . . . 2.3700000000000001 112.507 174.307 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -70.67 -42.09 71.2 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.998 1.319 . . . . 4.1500000000000004 112.339 179.729 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -74.36 -42.23 59.69 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 124.362 1.065 . . . . 2.98 111.61 177.49 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 49.2 tp -58.73 -46.62 86.97 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.05 0.94 . . . . 3.3500000000000001 110.513 171.465 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 17.4 tpp -54.26 -49.18 70.13 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.059 0.943 . . . . 2.8999999999999999 110.773 174.334 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.65 -22.49 45.97 Favored 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 114.307 1.225 . . . . 5.0300000000000002 114.307 175.605 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.8 t -92.85 -28.25 16.64 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 120.744 -1.223 . . . . 3.0699999999999998 113.427 171.477 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.81 -42.44 27.75 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 127.924 2.49 . . . . 2.9300000000000002 112.724 -179.127 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -99.34 128.4 45.45 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 124.776 1.231 . . . . 1.9299999999999999 110.24 166.546 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -95.27 -11.34 28.09 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.741 -0.599 . . . . 4.4100000000000001 112.606 173.794 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -94.32 -32.98 13.38 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.515 1.302 . . . . 2.6200000000000001 114.515 -169.502 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 9.2 t 72.91 15.87 4.57 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.161 1.384 . . . . 3.7400000000000002 112.462 -156.048 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 53.9 p-10 -71.94 -18.45 62.01 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.382 1.073 . . . . 2.1000000000000001 109.802 169.741 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 61.08 21.23 11.64 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 128.98 2.912 . . . . 4.6500000000000004 111.853 -178.758 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -126.23 144.9 50.61 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 128.375 2.67 . . . . 2.1200000000000001 109.657 171.811 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 16.0 mt -128.3 130.26 69.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 125.791 1.637 . . . . 2.4700000000000002 109.428 -171.325 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.34 173.01 6.49 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.915 1.686 . . . . 2.9700000000000002 111.516 168.868 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -47.25 -40.77 17.26 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.235 1.414 . . . . 4.7800000000000002 114.811 176.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 24.2 mtmm -70.28 -43.93 69.42 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.526 -0.734 . . . . 4.1900000000000004 110.986 -176.651 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -61.34 -47.22 86.89 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.185 0.994 . . . . 2.2400000000000002 110.642 173.773 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -58.89 -22.0 58.59 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 128.499 2.719 . . . . 4.0599999999999996 113.647 177.448 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 9.4 t -53.31 -35.26 59.95 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 120.982 -1.074 . . . . 2.8799999999999999 111.714 168.491 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 65.0 t -66.14 -31.89 55.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 O-C-N 121.248 -0.907 . . . . 2.6299999999999999 112.15 -179.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -67.53 -56.98 7.34 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.431 1.092 . . . . 4.29 111.849 173.522 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 77.8 mt -55.43 -39.82 70.74 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.046 1.338 . . . . 2.8500000000000001 111.397 179.309 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 58.6 m -65.39 -52.19 55.16 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.141 1.376 . . . . 2.1000000000000001 111.815 176.538 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 16.7 ptp -65.63 -38.0 88.16 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.426 1.012 . . . . 3.6899999999999999 112.677 -177.412 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 92.3 mt -65.78 -47.01 76.58 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.269 0.628 . . . . 2.5 111.101 175.73 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 94.0 m -65.61 -32.58 74.23 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.462 -0.774 . . . . 2.8799999999999999 112.611 176.864 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 52.9 mtm -65.85 -37.04 85.12 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.923 1.238 . . . . 4.2699999999999996 112.715 172.238 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.28 -42.42 98.61 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.602 1.092 . . . . 2.0699999999999998 112.593 173.313 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -69.67 -32.9 71.8 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.533 0.938 . . . . 4.1399999999999997 113.533 172.682 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -58.8 -48.97 79.43 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.175 0.898 . . . . 3.7999999999999998 112.062 172.282 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -59.26 -48.66 80.79 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.163 1.385 . . . . 3.1800000000000002 111.44 177.78 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.09 -45.44 68.2 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.448 1.499 . . . . 3.5800000000000001 112.326 175.242 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -71.21 -28.18 64.03 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.31 1.444 . . . . 3.6299999999999999 112.861 -177.665 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 78.9 mt -77.74 -8.95 58.69 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.883 1.068 . . . . 2.7200000000000002 113.883 177.677 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -92.69 -3.38 54.96 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 119.298 0.954 . . . . 5.1200000000000001 113.333 167.564 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -99.7 -74.84 0.58 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.237 1.415 . . . . 4.96 110.203 166.926 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.32 -7.78 54.9 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 116.311 1.967 . . . . 6.5499999999999998 116.311 -167.159 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . 0.48 ' C ' ' HZ2' ' A' ' 26' ' ' LYS 0.26 4.0 tttp . . . . . 0 C--O 1.248 0.976 1 C-N-CA 131.827 4.051 . . . . 9.0399999999999991 116.897 -158.704 . . . . . . . . 3 2 . 1 . 021 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.3 ttp . . . . . 0 N--CA 1.479 0.996 0 N-CA-C 107.277 -1.379 . . . . 7.9299999999999997 107.277 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 -115.9 -61.21 1.77 Allowed 'General case' 0 C--N 1.327 -0.372 0 O-C-N 124.862 1.351 . . . . 3.3100000000000001 107.711 -159.435 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 66.4 p -135.96 162.39 57.03 Favored Pre-proline 0 C--O 1.238 0.474 0 C-N-CA 124.96 1.304 . . . . 2.3399999999999999 109.846 160.914 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -64.31 -22.78 66.22 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 121.826 1.684 . . . . 1.53 112.091 166.551 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -69.68 -52.01 29.55 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.532 1.133 . . . . 4.4500000000000002 111.649 177.071 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -52.28 -44.22 64.86 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.563 1.145 . . . . 4.0599999999999996 111.041 175.196 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.486 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -77.35 -34.35 55.18 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 115.317 1.599 . . . . 6.79 115.317 -178.936 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.39 -42.17 77.47 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 123.441 0.697 . . . . 2.1899999999999999 112.001 165.039 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 74.0 mt -70.39 -34.19 72.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.264 0.938 . . . . 2.7999999999999998 112.37 173.911 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 5.1 m -60.56 -46.51 89.94 Favored 'General case' 0 N--CA 1.479 0.981 0 O-C-N 121.063 -1.023 . . . . 2.5600000000000001 110.937 167.463 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.5 m -57.86 -41.36 82.28 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.868 1.667 . . . . 2.9900000000000002 111.221 -179.003 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 19.0 tpp -52.93 -56.78 13.41 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 117.953 -1.023 . . . . 4.4100000000000001 111.852 168.702 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -62.35 -32.8 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 CA-C-N 120.983 1.719 . . . . 3.3300000000000001 113.106 -176.425 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.4 m -60.83 -58.93 6.39 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.631 1.172 . . . . 2.1600000000000001 111.069 173.787 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 t -73.54 -30.03 62.82 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 117.332 -1.318 . . . . 3.5699999999999998 110.399 -171.141 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -53.82 -53.03 58.16 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 125.677 1.591 . . . . 3.9399999999999999 110.01 170.708 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -59.15 -29.04 67.13 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.123 1.157 . . . . 2.7200000000000002 114.123 175.141 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.9 tttp -64.67 -31.72 73.07 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 120.724 -1.235 . . . . 4.9900000000000002 112.57 176.258 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -94.84 -38.7 10.62 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.729 1.212 . . . . 3.3700000000000001 112.778 177.452 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.3 p -70.05 -25.97 63.8 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.109 1.322 . . . . 2.4500000000000002 113.343 174.304 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.24 40.74 2.94 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 126.807 2.146 . . . . 2.4100000000000001 113.871 171.729 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -96.27 -26.34 15.44 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 118.941 1.371 . . . . 5.7699999999999996 112.349 166.059 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.02 153.38 42.16 Favored 'General case' 0 C--O 1.245 0.856 0 C-N-CA 128.722 2.809 . . . . 5.4400000000000004 110.24 177.984 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 46.46 -108.52 0.27 Allowed Glycine 0 C--N 1.345 1.038 0 C-N-CA 127.255 2.36 . . . . 3.8300000000000001 114.996 147.396 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 m -59.9 102.82 0.17 Allowed 'General case' 0 C--O 1.241 0.635 0 N-CA-C 108.77 -0.826 . . . . 3.02 108.77 166.669 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.7 -15.47 56.41 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.04 0.755 . . . . 5.54 113.04 -176.381 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 10.7 mp -83.96 -49.23 9.17 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 126.012 1.725 . . . . 5.5 110.986 177.098 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.4 p -111.31 170.36 8.17 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.939 2.096 . . . . 3.04 113.331 -168.748 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 46.7 mt -116.55 103.73 10.7 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.456 1.502 . . . . 2.5600000000000001 113.04 -162.796 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.94 172.47 10.87 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 121.18 -0.95 . . . . 2.6899999999999999 112.114 165.804 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.53 -48.64 2.86 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.593 1.957 . . . . 4.9000000000000004 114.594 -177.667 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.485 ' HZ2' ' CD ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -69.91 -41.53 74.55 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.657 -0.652 . . . . 7.4199999999999999 112.239 -178.616 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 87.8 mt-10 -67.55 -44.38 78.41 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.369 -0.604 . . . . 1.96 109.369 -178.06 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.83 -52.31 66.0 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.728 1.211 . . . . 3.25 112.156 177.264 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 15.5 ptmt -63.75 -25.81 68.36 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 120.288 1.404 . . . . 4.3600000000000003 114.217 -176.204 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.485 ' CD ' ' HZ2' ' A' ' 32' ' ' LYS . 4.6 tt0 -81.84 -50.94 8.63 Favored 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 124.927 1.291 . . . . 3.27 110.634 -177.726 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.1 tt -46.68 -55.22 8.09 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 125.407 1.483 . . . . 2.98 110.209 177.245 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.0 mt -51.59 -55.55 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 118.701 0.682 . . . . 2.25 110.689 -178.903 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -68.8 -23.45 64.29 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.984 0.735 . . . . 4.9500000000000002 112.984 -172.768 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.78 -14.99 22.85 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 126.81 2.044 . . . . 6.75 113.258 -179.22 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -79.42 -54.82 5.55 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.977 1.311 . . . . 4.4800000000000004 109.487 161.374 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.0 mt -119.3 91.31 3.52 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.85 1.66 . . . . 3.8999999999999999 110.729 -179.167 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 4.6 t -84.74 71.18 10.86 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.282 -0.886 . . . . 3.7000000000000002 109.756 168.121 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 pp -171.41 -179.39 2.59 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 128.067 2.547 . . . . 4.5099999999999998 110.112 -172.222 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 65.12 13.4 57.59 Favored Glycine 0 N--CA 1.477 1.404 0 O-C-N 121.707 -0.621 . . . . 5.8899999999999997 112.339 -173.796 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 44.5 53.03 7.27 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 129.568 3.147 . . . . 6.0499999999999998 109.878 178.934 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.1 tpp -67.36 80.69 0.15 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.344 1.858 . . . . 2.4100000000000001 113.962 -157.425 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -74.11 129.67 38.29 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.956 2.503 . . . . 6.1900000000000004 109.467 178.602 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -64.87 -10.29 27.46 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 116.348 1.981 . . . . 4.5199999999999996 116.348 -159.757 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.8 t -60.21 -28.81 68.29 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.245 -1.535 . . . . 4.4500000000000002 113.555 166.329 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.0 p -90.53 1.12 57.01 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.929 1.241 . . . . 3.8399999999999999 113.194 172.251 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 19.8 mm -82.18 -40.45 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 119.121 0.873 . . . . 3.4900000000000002 110.924 167.534 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -67.73 -52.47 37.26 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 118.649 0.658 . . . . 4.9699999999999998 112.751 -171.024 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -72.69 -26.47 61.63 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.929 -0.482 . . . . 3.2200000000000002 112.025 -179.173 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.32 -51.27 70.22 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 117.669 -1.158 . . . . 3.6000000000000001 109.551 165.771 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ttt -52.76 -46.26 67.42 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 119.932 1.242 . . . . 2.5600000000000001 111.838 174.132 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -68.69 -26.24 65.19 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 120.952 1.705 . . . . 4.2699999999999996 113.442 177.651 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.1 t -71.69 -28.68 63.87 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 120.953 -1.092 . . . . 3.1899999999999999 111.741 172.239 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 11.8 mt -72.88 -58.82 3.05 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.915 -1.115 . . . . 2.7000000000000002 109.855 165.559 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -84.25 61.3 6.46 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.542 1.937 . . . . 1.5600000000000001 111.665 -177.253 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.0 mttp -52.01 -20.7 2.55 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 127.561 2.344 . . . . 4.0599999999999996 114.472 -171.253 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 35.1 p-10 -111.27 -0.85 16.28 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 129.074 2.95 . . . . 3.2200000000000002 114.125 -175.499 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.6 t 67.42 30.59 6.81 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.775 1.23 . . . . 2.9399999999999999 114.268 168.134 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -90.17 -9.13 49.32 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.42 1.488 . . . . 2.7400000000000002 112.826 -176.408 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.28 -9.64 1.43 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 129.69 3.196 . . . . 5.0700000000000003 116.9 178.088 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -106.51 142.0 36.89 Favored 'General case' 0 C--O 1.247 0.971 0 C-N-CA 125.701 1.6 . . . . 2.8300000000000001 112.205 173.738 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.5 mt -120.37 101.06 10.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-O 122.854 1.312 . . . . 3.02 111.867 -167.852 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.44 ' OD1' ' HE3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -74.27 158.45 34.04 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 129.053 2.941 . . . . 3.27 111.998 171.527 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.79 -25.8 67.41 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 120.636 -1.29 . . . . 3.6800000000000002 114.09 -174.425 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.44 ' HE3' ' OD1' ' A' ' 68' ' ' ASP . 2.5 mtmt -81.55 -33.47 31.68 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 120.548 1.522 . . . . 4.3499999999999996 111.872 173.535 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -54.94 -53.59 53.67 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.027 0.831 . . . . 2.1699999999999999 109.003 165.27 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -66.01 -33.73 76.47 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 127.196 2.199 . . . . 3.25 114.751 -175.943 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.33 -21.37 61.98 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 120.443 -1.411 . . . . 2.6000000000000001 113.304 -175.348 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 p -60.13 -26.98 38.03 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 O-C-N 121.315 -0.865 . . . . 3.4900000000000002 112.477 171.697 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -68.0 -51.59 45.41 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 126.679 1.992 . . . . 3.8700000000000001 111.361 178.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.75 -46.85 67.65 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.178 0.991 . . . . 3.3999999999999999 109.841 169.786 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 20.6 m -61.42 -55.53 30.33 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.974 0.909 . . . . 1.8200000000000001 111.238 -176.675 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 21.1 ptm -66.53 -36.33 82.43 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.814 0.672 . . . . 3.3700000000000001 112.814 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.4 mt -66.54 -41.56 88.51 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.177 -0.916 . . . . 2.2599999999999998 111.43 173.437 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.5 m -64.25 -36.73 85.05 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 120.051 1.296 . . . . 2.71 112.731 175.57 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 38.1 mmm -61.17 -44.82 96.71 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.054 0.542 . . . . 2.5499999999999998 111.202 174.063 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.27 -38.5 81.8 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.772 0.829 . . . . 1.77 112.236 -178.608 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -65.93 -27.46 68.2 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.319 0.859 . . . . 3.75 113.319 175.036 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.14 -36.66 74.93 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 119.254 0.934 . . . . 3.3500000000000001 112.15 173.809 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -67.14 -43.58 82.0 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.885 0.874 . . . . 3.4500000000000002 110.847 175.926 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -52.6 -44.73 66.18 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.719 1.608 . . . . 4.3799999999999999 112.358 173.361 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -62.61 -27.23 69.06 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.069 1.748 . . . . 3.9399999999999999 112.541 178.892 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 45.3 mt -83.07 -18.6 39.06 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.403 1.081 . . . . 3.0899999999999999 112.84 177.156 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.509 ' CD ' ' HZ3' ' A' ' 92' ' ' LYS . 69.4 mm-40 -90.26 -10.32 44.68 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.718 1.377 . . . . 3.2200000000000002 114.718 171.854 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -84.16 -46.02 12.35 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.034 1.734 . . . . 3.0600000000000001 112.591 169.011 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -79.1 51.03 1.11 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.973 2.109 . . . . 3.48 113.204 -168.295 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.509 ' HZ3' ' CD ' ' A' ' 89' ' ' GLU . 46.6 mmtt . . . . . 0 C--O 1.251 1.169 0 C-N-CA 128.064 2.546 . . . . 5.6900000000000004 115.422 176.397 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.0 mmt . . . . . 0 N--CA 1.482 1.139 0 CA-C-O 117.359 -1.305 . . . . 8.0899999999999999 108.621 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.09 -177.59 4.02 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 124.062 0.851 . . . . 8.0600000000000005 110.929 163.633 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 9.6 t -45.32 143.16 2.8 Favored Pre-proline 0 CA--C 1.535 0.395 0 C-N-CA 128.105 2.562 . . . . 4.2599999999999998 112.256 174.48 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -66.95 -9.11 23.74 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.181 1.921 . . . . 2.6600000000000001 113.081 172.691 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.56 -37.7 77.11 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 117.098 -1.43 . . . . 3.7400000000000002 112.6 176.931 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 13.4 tm-20 -54.34 -42.04 69.78 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 121.427 1.921 . . . . 5.0 110.137 179.118 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 38.5 mtmt -55.05 -23.72 21.4 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.603 0.964 . . . . 8.5099999999999998 113.603 175.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.82 -49.03 61.87 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 120.731 -1.231 . . . . 1.79 111.007 176.274 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -57.42 -48.91 77.88 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 119.393 0.997 . . . . 4.3499999999999996 109.886 178.858 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 13.9 p -64.15 -44.22 92.79 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.394 1.078 . . . . 3.1499999999999999 112.684 177.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 26.9 m -70.2 -32.16 69.94 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.64 1.109 . . . . 2.79 110.813 178.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -70.78 -50.26 37.7 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.12 0.968 . . . . 4.4800000000000004 111.045 176.682 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 6.3 p -59.83 -27.3 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-N 120.509 1.504 . . . . 3.29 112.104 175.122 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 60.7 m -64.81 -57.8 7.93 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 116.921 -1.514 . . . . 1.76 111.593 175.159 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.9 p -61.61 -41.48 97.53 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.147 1.34 . . . . 2.25 109.07 175.317 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -64.45 -49.56 70.95 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 120.515 -0.474 . . . . 3.3100000000000001 111.604 -170.369 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 12.0 t60 -69.23 -44.69 71.5 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.774 -0.579 . . . . 2.7999999999999998 111.225 178.532 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -66.78 -39.47 87.83 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.015 -1.053 . . . . 5.0199999999999996 112.91 -175.289 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -80.18 -27.31 38.96 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.62 0.768 . . . . 3.5 112.424 173.016 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 57.0 m -68.91 -22.92 64.13 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.169 1.349 . . . . 2.7000000000000002 112.716 168.292 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.08 11.33 72.48 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 125.656 1.598 . . . . 1.77 115.45 178.127 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . 0.481 HH11 ' HG3' ' B' ' 22' ' ' ARG . 7.9 mmt85 -80.77 -23.38 39.38 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.196 1.398 . . . . 5.3799999999999999 114.181 177.994 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -164.01 149.64 10.86 Favored 'General case' 0 C--O 1.25 1.088 0 C-N-CA 126.481 1.913 . . . . 3.2999999999999998 108.738 -171.215 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.78 -142.32 16.6 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-O 121.702 0.612 . . . . 2.7599999999999998 111.855 -174.301 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 58.9 m -75.17 151.51 38.51 Favored 'General case' 0 C--O 1.242 0.661 0 O-C-N 121.331 -1.099 . . . . 4.6399999999999997 112.55 178.714 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -71.84 56.55 0.3 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.759 2.024 . . . . 6.5700000000000003 111.915 167.038 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 59.5 tp -160.2 -42.81 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.116 1.366 . . . . 4.8700000000000001 110.0 -170.556 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.4 p -101.45 140.25 35.99 Favored 'General case' 0 C--O 1.251 1.15 0 C-N-CA 125.066 1.346 . . . . 2.79 110.297 173.842 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . 0.263 1.8 pt? -98.58 94.72 6.83 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 122.334 1.064 . . . . 4.3600000000000003 109.493 158.042 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 5.6 m -65.33 165.24 12.07 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 126.729 2.012 . . . . 3.7000000000000002 112.532 -176.004 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . 0.507 HH22 ' CG ' ' B' ' 53' ' ' ASP . 0.9 OUTLIER -30.07 -39.07 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 128.394 2.678 . . . . 6.25 117.14 -178.191 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.4 -37.9 11.22 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.793 1.405 . . . . 4.9699999999999998 114.793 174.115 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -53.44 -41.54 66.2 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.71 1.204 . . . . 2.0699999999999998 109.579 174.305 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 24.7 tp -71.41 -40.89 70.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.108 0.963 . . . . 2.7200000000000002 113.473 179.7 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 24.1 ttmt -62.84 -45.09 94.21 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 120.837 -1.165 . . . . 3.9199999999999999 111.949 176.003 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.408 ' CD ' ' HZ3' ' B' ' 40' ' ' LYS . 14.4 tp10 -52.81 -56.83 12.86 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.378 1.471 . . . . 3.2200000000000002 111.993 167.006 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -60.05 -47.82 84.28 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.707 1.603 . . . . 4.04 112.846 -174.71 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.8 mt -59.24 -48.27 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 CA-C-N 120.254 1.388 . . . . 1.8600000000000001 109.547 175.485 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -62.53 -22.86 66.62 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.107 0.78 . . . . 4.8799999999999999 113.107 -179.489 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . 0.408 ' HZ3' ' CD ' ' B' ' 36' ' ' GLU . 39.9 mmtm -82.06 -53.62 5.96 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 117.353 -1.308 . . . . 4.4900000000000002 113.383 168.806 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -67.45 -35.97 80.27 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.632 1.173 . . . . 4.2300000000000004 112.527 -172.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -92.03 -73.89 0.53 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.924 1.29 . . . . 3.1600000000000001 110.263 174.178 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 11.9 t 66.13 -40.76 0.35 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 127.908 2.483 . . . . 4.1399999999999997 113.616 -168.858 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 pp -62.5 174.31 1.02 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 128.063 2.545 . . . . 4.3200000000000003 113.787 172.087 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.04 -142.04 23.88 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 115.456 -0.793 . . . . 4.2199999999999998 111.836 167.131 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -119.32 57.47 0.89 Allowed 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 122.399 1.095 . . . . 5.1900000000000004 109.564 178.206 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.76 47.53 1.4 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 124.234 1.969 . . . . 2.7599999999999998 113.401 -175.059 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 37.5 mttp -81.42 152.56 27.35 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.121 2.168 . . . . 4.8899999999999997 112.169 172.192 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -47.44 -54.04 12.45 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.49 1.293 . . . . 3.3399999999999999 114.49 -163.155 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 9.0 t -61.25 -23.7 65.84 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 120.184 1.356 . . . . 3.6499999999999999 113.945 -176.292 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 9.8 t -86.71 -9.37 56.08 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.978 0.808 . . . . 2.75 112.94 174.95 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 22.3 mt -97.52 -40.05 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 125.9 1.68 . . . . 2.1699999999999999 110.833 172.32 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.507 ' CG ' HH22 ' B' ' 31' ' ' ARG . 0.9 OUTLIER -67.52 -39.2 85.08 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 126.076 1.75 . . . . 4.0099999999999998 110.08 176.567 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -69.8 -44.92 69.07 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 118.559 0.618 . . . . 2.96 112.337 166.102 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 7.4 tt -57.85 -44.37 86.48 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.466 1.03 . . . . 3.2999999999999998 111.186 -177.893 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.9 ppp? -67.06 -38.8 86.43 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.453 1.024 . . . . 2.6200000000000001 111.959 176.972 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 1.4 tmpt? -62.74 -23.39 67.16 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.905 1.282 . . . . 4.6900000000000004 112.812 169.317 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 22.1 m -92.31 -22.45 19.72 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.639 1.576 . . . . 3.1000000000000001 112.95 178.218 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 19.2 mt -67.09 -47.67 70.51 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 118.643 0.656 . . . . 2.9700000000000002 109.731 163.403 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -78.08 141.66 38.66 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.949 1.3 . . . . 2.5899999999999999 113.832 -173.266 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -115.5 3.31 14.04 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.018 1.327 . . . . 4.2699999999999996 112.2 178.523 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -117.37 -28.94 5.99 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.612 1.565 . . . . 2.7799999999999998 112.933 -162.378 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 46.0 m 67.83 29.37 6.74 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 129.227 3.011 . . . . 3.73 112.52 -161.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 37.2 p30 -85.31 -14.32 46.88 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 120.695 -1.253 . . . . 2.4700000000000002 112.383 -170.92 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 58.99 4.63 0.43 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 129.901 3.28 . . . . 5.0800000000000001 115.236 -168.2 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -105.22 122.34 45.73 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 127.472 2.309 . . . . 2.8399999999999999 110.589 176.535 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 32.1 mm -101.87 107.03 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 114.646 -1.161 . . . . 2.7200000000000002 109.823 175.391 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.48 158.29 32.22 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.829 2.051 . . . . 4.1900000000000004 112.516 173.243 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -50.39 -25.57 4.03 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.278 1.431 . . . . 4.5499999999999998 113.219 163.114 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm -91.72 -16.96 26.15 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 115.623 1.712 . . . . 6.2199999999999998 115.623 176.283 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -89.89 -44.18 10.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.586 1.154 . . . . 1.8899999999999999 109.725 172.703 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -54.42 -22.12 11.64 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.518 1.927 . . . . 2.8399999999999999 114.297 179.17 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 41.0 p -55.76 -29.57 59.82 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 119.869 -1.769 . . . . 3.0899999999999999 113.068 168.393 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 88.2 t -61.12 -34.83 61.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 CA-C-N 119.412 1.005 . . . . 2.5499999999999998 111.034 173.497 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -66.56 -54.63 21.52 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.038 0.835 . . . . 3.9900000000000002 110.968 177.476 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 76.2 mt -56.86 -36.33 69.92 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.329 0.652 . . . . 2.23 112.269 177.463 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 60.8 m -61.63 -46.63 88.99 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.185 0.994 . . . . 2.2400000000000002 111.072 177.087 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.2 mtm -61.26 -43.53 98.72 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 118.845 0.748 . . . . 2.73 112.252 178.32 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -57.6 -54.59 45.16 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 118.714 0.688 . . . . 3.6800000000000002 110.883 173.733 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 89.7 m -66.85 -30.43 70.61 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.298 1.221 . . . . 2.5800000000000001 114.298 -176.676 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 81' ' ' MET . . . . . 0.418 ' SD ' ' HE2' ' A' ' 70' ' ' LYS . 14.3 mtp -75.09 -33.56 61.65 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.777 1.171 . . . . 3.04 112.562 171.514 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.21 -50.21 66.73 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 119.333 0.97 . . . . 2.1299999999999999 111.376 172.158 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -60.67 -24.45 65.6 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.403 0.89 . . . . 4.4500000000000002 113.403 175.917 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -66.64 -46.92 74.23 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 117.955 -1.022 . . . . 3.7799999999999998 112.484 170.394 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -65.14 -30.16 71.07 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 120.429 1.468 . . . . 3.2799999999999998 112.108 177.626 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.94 -46.64 83.82 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 127.407 2.283 . . . . 4.6100000000000003 111.953 175.15 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -81.13 4.24 20.71 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 119.704 -1.873 . . . . 3.4900000000000002 113.253 171.092 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 81.8 mt -109.57 -0.9 18.51 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 114.376 1.25 . . . . 2.46 114.376 165.696 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.461 ' HB3' ' HZ2' ' B' ' 92' ' ' LYS . 21.4 pt-20 -97.23 -27.3 14.59 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.59 1.541 . . . . 5.6200000000000001 113.601 170.869 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -46.33 -42.51 14.87 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.519 1.128 . . . . 5.9299999999999997 111.273 149.015 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -85.14 -0.95 56.21 Favored 'General case' 0 CA--C 1.559 1.306 0 N-CA-C 116.258 1.947 . . . . 5.3300000000000001 116.258 177.303 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . 0.461 ' HZ2' ' HB3' ' B' ' 89' ' ' GLU . 19.0 mttp . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 116.279 -1.82 . . . . 6.8700000000000001 115.468 -172.301 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 31.0 mtt . . . . . 0 N--CA 1.478 0.956 0 N-CA-C 107.206 -1.405 . . . . 6.6200000000000001 107.206 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.3 mp0 -128.5 143.03 50.91 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 124.29 0.994 . . . . 4.04 108.758 -165.403 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -55.24 157.05 6.85 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 127.583 2.353 . . . . 2.54 112.852 172.454 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -65.21 -28.96 55.75 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.41 2.073 . . . . 2.2799999999999998 113.5 -168.174 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 27.9 tp -66.57 -47.79 71.67 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 120.042 1.292 . . . . 4.9500000000000002 110.974 174.321 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -60.15 -34.13 73.14 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.794 -0.566 . . . . 4.9400000000000004 110.819 174.192 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.487 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 5.4 mmpt? -72.84 -33.16 65.98 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 120.152 -1.592 . . . . 5.4100000000000001 113.988 173.478 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.64 -45.73 85.54 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 118.808 0.731 . . . . 2.4399999999999999 110.729 170.432 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 55.8 mt -67.02 -35.19 79.38 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.945 -1.097 . . . . 2.9300000000000002 112.872 174.328 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 84.8 m -55.54 -46.75 77.05 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.479 1.112 . . . . 2.7799999999999998 110.709 169.165 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 81.6 m -57.24 -48.53 78.6 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.746 0.818 . . . . 2.3700000000000001 109.678 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.1 tpp -51.3 -55.66 17.11 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.09 0.956 . . . . 4.1699999999999999 113.563 179.554 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.76 -29.15 46.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 123.689 0.795 . . . . 3.7200000000000002 112.489 -177.599 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.5 m -72.75 -46.28 54.3 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.184 1.394 . . . . 2.1800000000000002 110.578 -179.372 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.44 -37.27 77.7 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 118.634 -0.698 . . . . 2.9399999999999999 111.084 165.371 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -66.81 -60.19 2.88 Favored 'General case' 0 C--O 1.222 -0.343 0 O-C-N 123.532 0.52 . . . . 3.1200000000000001 110.845 -170.116 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.9 m170 -72.12 -1.94 16.76 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.892 1.441 . . . . 2.8199999999999998 114.892 -178.322 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -88.56 -62.58 1.46 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.413 1.085 . . . . 5.0999999999999996 112.535 164.957 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -72.64 -39.3 67.31 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.795 1.18 . . . . 3.8700000000000001 113.261 -179.215 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.0 t -62.29 -22.74 66.26 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.498 -0.751 . . . . 2.5899999999999999 111.818 -176.035 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -157.03 106.8 0.3 Allowed Glycine 0 C--N 1.343 0.924 0 N-CA-C 116.181 1.232 . . . . 2.71 116.181 164.479 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -79.86 -13.55 59.31 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 114.736 -0.732 . . . . 6.0 111.777 132.307 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -165.14 -167.94 1.3 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.0 2.12 . . . . 4.2199999999999998 109.022 -161.879 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 39.2 53.94 2.62 Favored Glycine 0 N--CA 1.474 1.184 0 C-N-CA 125.936 1.732 . . . . 3.4300000000000002 113.84 160.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.2 t 56.11 138.55 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.686 1.994 . . . . 3.29 114.186 -167.424 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.0 mmmt -70.32 -18.61 63.1 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 120.864 -1.147 . . . . 6.5199999999999996 113.983 172.751 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.5 mt -102.16 -6.61 23.04 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.518 1.127 . . . . 4.5800000000000001 113.076 -171.338 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.2 p -136.98 139.45 41.47 Favored 'General case' 0 C--O 1.247 0.962 0 C-N-CA 126.231 1.812 . . . . 1.8799999999999999 109.771 -174.478 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -94.61 103.31 15.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.064 0.946 . . . . 2.9300000000000002 110.136 170.408 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -74.15 161.31 30.12 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 119.973 -1.704 . . . . 2.9700000000000002 111.113 165.7 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -39.57 -46.77 1.82 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.285 1.834 . . . . 5.0 114.481 -167.605 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.422 ' HD3' ' H ' ' A' ' 32' ' ' LYS . 0.6 OUTLIER -69.36 -42.27 75.46 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.927 1.084 . . . . 5.0499999999999998 113.927 -179.108 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -60.56 -48.7 80.6 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.846 1.658 . . . . 1.5900000000000001 108.641 176.426 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.1 tp -61.4 -43.39 98.95 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.654 0.782 . . . . 3.1099999999999999 111.502 178.253 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.457 ' HZ1' ' CG ' ' A' ' 53' ' ' ASP . 24.7 ttmm -66.48 -37.91 86.15 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 118.363 -0.827 . . . . 4.4299999999999997 112.732 -173.049 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -56.86 -54.44 46.46 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 117.792 -1.099 . . . . 3.9100000000000001 112.543 166.376 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.6 tt -53.42 -60.81 2.82 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.907 0.883 . . . . 3.1299999999999999 110.514 -179.214 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.9 mt -56.96 -51.65 65.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 N-CA-C 108.831 -0.803 . . . . 1.73 108.831 -175.801 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -61.96 -35.79 79.5 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.172 0.896 . . . . 4.7599999999999998 113.115 -175.328 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 60.8 mttm -66.28 -34.87 78.97 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.503 1.047 . . . . 3.6699999999999999 112.956 172.116 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -72.47 -51.61 19.42 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.454 1.102 . . . . 4.6600000000000001 111.793 179.521 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -82.12 25.82 0.56 Allowed 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 126.45 1.9 . . . . 3.7599999999999998 113.025 -176.453 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.0 m -60.87 6.6 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 126.544 1.938 . . . . 3.77 115.766 177.866 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.0 mp -60.67 -21.51 62.9 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.417 1.887 . . . . 4.2699999999999996 112.8 162.333 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 119.26 14.87 5.75 Favored Glycine 0 N--CA 1.473 1.163 0 C-N-CA 126.335 1.921 . . . . 3.5899999999999999 114.552 175.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -88.06 -174.28 4.61 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.291 0.848 . . . . 5.75 113.291 -174.069 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 77.07 -8.05 1.75 Allowed 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.994 1.85 . . . . 3.1000000000000001 115.994 154.575 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.2 mptt -8.82 114.51 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 130.075 3.35 . . . . 6.79 114.92 178.405 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -9.91 -56.12 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 130.656 3.582 . . . . 4.4500000000000002 119.891 -149.007 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.1 t -77.57 -17.35 57.95 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.855 1.057 . . . . 3.0699999999999998 113.855 -178.036 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.9 t -75.41 -10.65 59.64 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.0 1.273 . . . . 2.8999999999999999 112.08 173.554 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 70.3 mt -73.98 -27.41 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.693 1.197 . . . . 2.1600000000000001 111.483 161.095 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.457 ' CG ' ' HZ1' ' A' ' 35' ' ' LYS . 69.8 m-20 -91.98 -30.29 16.17 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.672 0.789 . . . . 3.6800000000000002 112.339 -174.384 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -68.44 -37.82 80.59 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.436 -0.79 . . . . 2.29 111.507 161.739 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 58.8 tp -57.49 -46.72 83.41 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 116.747 -1.596 . . . . 2.8900000000000001 110.574 168.706 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.8 mtp -51.35 -48.5 62.45 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 121.239 1.836 . . . . 2.8799999999999999 112.248 173.596 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.68 -21.26 62.64 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.413 1.485 . . . . 4.7199999999999998 113.005 175.975 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -82.22 -39.14 23.51 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 120.51 -1.369 . . . . 2.4700000000000002 113.476 167.326 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 84.4 mt -83.77 -37.43 22.63 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.4 1.48 . . . . 3.0299999999999998 114.771 -172.808 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.435 ' C ' ' HE2' ' A' ' 61' ' ' LYS . 7.2 t70 -79.1 129.04 34.03 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.605 0.717 . . . . 2.54 110.419 177.568 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.435 ' HE2' ' C ' ' A' ' 60' ' ' ASP . 0.8 OUTLIER -101.69 -17.52 16.26 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.6 0.76 . . . . 4.3099999999999996 112.741 178.125 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.7 m120 -95.27 -26.03 16.1 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 115.097 1.518 . . . . 3.25 115.097 -170.745 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.6 m 61.61 36.42 16.73 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.735 1.614 . . . . 3.1299999999999999 111.48 -163.334 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 48.4 p30 -92.34 -11.93 33.73 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 127.134 2.174 . . . . 2.4100000000000001 111.828 178.039 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 65.4 18.46 11.33 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 128.758 2.823 . . . . 5.8700000000000001 113.053 -177.153 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -139.18 139.43 37.55 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 122.703 1.239 . . . . 3.2999999999999998 112.377 170.26 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 1.9 mt -98.19 97.82 6.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 124.074 0.95 . . . . 2.9900000000000002 109.644 -171.531 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -47.64 143.56 3.74 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 127.814 2.445 . . . . 2.3900000000000001 110.665 162.393 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -47.08 -36.99 8.88 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 122.196 0.998 . . . . 4.0800000000000001 112.337 172.619 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -69.79 -29.59 66.93 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.088 1.755 . . . . 3.75 114.346 175.965 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -74.13 -54.73 7.19 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 108.324 -0.991 . . . . 1.8999999999999999 108.324 166.418 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -53.99 -25.61 21.86 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 127.063 2.145 . . . . 3.1600000000000001 114.627 -178.552 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.3 t -62.07 -31.9 72.38 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.767 -1.208 . . . . 2.46 111.714 173.027 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 p -74.61 -23.83 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-N 119.635 1.107 . . . . 3.3300000000000001 112.123 -177.483 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -63.65 -50.74 68.08 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.131 0.972 . . . . 3.5099999999999998 110.115 169.466 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 44.7 mt -59.38 -41.47 89.44 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.394 1.078 . . . . 2.73 111.161 177.24 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 88.0 m -58.96 -52.51 65.47 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.314 1.046 . . . . 2.0499999999999998 111.72 171.726 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 36.1 mtp -56.53 -45.94 80.88 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.839 0.855 . . . . 2.46 112.281 179.275 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 92.7 mt -62.63 -47.07 85.34 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 123.338 0.655 . . . . 2.4199999999999999 111.488 177.179 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 79.1 m -64.45 -34.88 79.22 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.543 0.942 . . . . 3.2799999999999998 113.543 178.564 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.5 mmm -65.67 -42.51 91.24 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 118.009 0.368 . . . . 3.5 111.065 174.598 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.24 -35.8 78.48 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.761 -0.638 . . . . 2.1800000000000002 112.308 179.769 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -76.98 -30.23 55.86 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.187 1.18 . . . . 3.6299999999999999 114.187 177.683 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -58.55 -49.44 77.42 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.987 0.812 . . . . 2.7999999999999998 110.926 167.936 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.44 -33.13 75.02 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.107 1.363 . . . . 4.5999999999999996 111.84 178.292 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -59.98 -45.51 92.47 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.86 1.264 . . . . 3.4500000000000002 112.625 174.468 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -63.26 -34.13 77.0 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.867 1.267 . . . . 3.96 111.922 177.058 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 71.2 mt -74.68 -7.84 54.51 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.222 1.409 . . . . 2.6299999999999999 113.477 178.166 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.494 ' CD ' ' HZ2' ' A' ' 92' ' ' LYS . 25.0 mm-40 -101.38 -1.09 34.22 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.217 1.407 . . . . 3.5699999999999998 114.139 170.518 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -121.03 -65.02 1.18 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.844 1.658 . . . . 3.5699999999999998 111.977 179.13 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -79.72 48.12 0.91 Allowed 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 126.768 2.027 . . . . 3.6499999999999999 111.047 172.316 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.494 ' HZ2' ' CD ' ' A' ' 89' ' ' GLU . 9.6 ptmt . . . . . 0 C--O 1.249 1.035 0 C-N-CA 128.402 2.681 . . . . 6.1600000000000001 115.237 -170.279 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mmt . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 107.813 -1.18 . . . . 7.2199999999999998 107.813 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 20.3 mp0 -115.69 -90.63 0.54 Allowed 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 107.57 -1.27 . . . . 4.8200000000000003 107.57 -153.875 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 3' ' ' THR . . . . . 0.538 HG22 ' H ' ' B' ' 6' ' ' GLU . 4.7 t -163.17 152.98 13.08 Favored Pre-proline 0 C--O 1.236 0.362 0 C-N-CA 126.732 2.013 . . . . 3.73 108.01 -179.68 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -63.74 -16.68 56.18 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 121.726 1.618 . . . . 1.9099999999999999 112.22 167.58 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 24.8 tp -68.38 -50.65 51.48 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.64 1.109 . . . . 3.8799999999999999 112.204 -177.111 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . 0.538 ' H ' HG22 ' B' ' 3' ' ' THR . 2.6 tm-20 -47.95 -54.58 12.33 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.055 1.342 . . . . 4.0300000000000002 110.63 167.303 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -70.34 -26.33 63.7 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.496 -0.752 . . . . 5.7800000000000002 112.278 -171.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.61 -38.93 74.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.894 1.278 . . . . 2.1600000000000001 111.933 170.623 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.93 -44.24 81.18 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.897 1.226 . . . . 3.0 110.388 171.906 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 59.1 m -55.6 -43.46 76.05 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.616 1.566 . . . . 2.0 111.991 172.232 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.15 -32.12 58.93 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 121.036 -1.04 . . . . 2.9700000000000002 113.17 175.949 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -55.98 -49.07 74.62 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.959 1.254 . . . . 4.0499999999999998 110.218 167.755 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 29.9 t -59.21 -30.6 44.26 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 C-N-CA 124.938 1.295 . . . . 3.21 112.906 172.152 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 29.8 m -71.39 -45.49 62.66 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 120.881 -1.137 . . . . 1.98 111.785 175.483 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.22 -32.29 64.29 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.923 0.783 . . . . 2.3700000000000001 110.248 167.604 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -64.06 -58.24 7.25 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 118.473 -0.775 . . . . 3.27 110.563 179.632 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 47.2 m-70 -57.23 -43.94 83.35 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 120.589 1.54 . . . . 5.3300000000000001 112.184 178.494 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -56.71 -36.8 70.08 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.086 1.354 . . . . 6.1699999999999999 113.961 -177.794 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -108.87 -34.11 6.75 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.725 1.009 . . . . 3.6600000000000001 113.725 -179.308 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -67.96 -27.5 66.65 Favored 'General case' 0 C--O 1.249 1.067 0 C-N-CA 125.251 1.42 . . . . 2.4100000000000001 111.774 175.463 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.81 4.51 60.8 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 128.119 2.771 . . . . 1.8100000000000001 115.222 177.551 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 17.9 mtp180 -78.83 -113.1 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.117 1.459 . . . . 5.1799999999999997 110.575 172.496 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.51 -178.16 1.7 Allowed 'General case' 0 C--O 1.248 0.979 0 C-N-CA 124.954 1.302 . . . . 3.9199999999999999 113.018 178.144 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 62.97 -145.73 50.17 Favored Glycine 0 C--N 1.34 0.783 0 C-N-CA 125.036 1.303 . . . . 2.8399999999999999 111.531 171.412 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.6 m -66.51 153.37 43.09 Favored 'General case' 0 C--O 1.248 0.984 0 CA-C-O 123.723 1.725 . . . . 4.0899999999999999 110.31 155.28 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -82.71 -4.05 57.29 Favored 'General case' 0 CA--C 1.552 1.048 0 O-C-N 120.364 -1.46 . . . . 7.8600000000000003 113.555 175.593 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 4.9 mp -103.04 0.39 31.97 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 128.175 2.59 . . . . 4.4800000000000004 112.592 171.924 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 28' ' ' THR . . . . . 0.401 ' HG1' ' CD ' ' B' ' 66' ' ' GLU . 81.9 p -132.13 157.57 43.89 Favored 'General case' 0 C--O 1.245 0.846 0 C-N-CA 125.356 1.462 . . . . 1.73 112.0 -178.562 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -95.29 128.45 42.14 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.395 1.478 . . . . 3.27 110.552 167.229 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 23.0 t -101.1 171.99 7.28 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.27 1.428 . . . . 2.5899999999999999 112.062 162.754 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 48.6 ttm-85 -58.87 -20.29 49.85 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.986 1.714 . . . . 4.6500000000000004 114.96 -165.143 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -95.74 -39.8 9.68 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.46 1.482 . . . . 6.7599999999999998 113.791 169.704 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -46.48 -44.87 17.92 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.224 1.01 . . . . 1.73 111.806 168.679 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 8.6 tp -77.67 -44.65 27.38 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 119.44 -0.314 . . . . 3.29 111.687 -175.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 52.3 mttm -54.87 -46.38 74.71 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 118.858 0.754 . . . . 4.0099999999999998 111.662 172.837 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -56.54 -53.92 51.95 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 123.852 0.72 . . . . 2.9300000000000002 111.469 174.379 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 64.0 tp -56.6 -57.67 11.36 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 125.26 1.424 . . . . 3.5800000000000001 112.375 -177.109 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 34.5 mt -56.95 -39.24 64.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.87 0.868 . . . . 2.4700000000000002 110.268 179.225 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -68.62 -9.25 48.68 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 120.689 -1.257 . . . . 4.9100000000000001 113.768 -176.387 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -104.8 -60.72 1.56 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.067 0.947 . . . . 4.4299999999999997 109.219 164.107 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -82.6 67.3 8.6 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 127.473 2.309 . . . . 5.6600000000000001 110.543 -176.578 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -173.73 29.58 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 127.861 2.465 . . . . 3.7799999999999998 111.075 166.878 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 33.5 t -50.96 -16.25 0.41 Allowed 'General case' 0 CA--C 1.557 1.246 0 N-CA-C 117.71 2.485 . . . . 3.71 117.71 -159.688 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -96.93 -7.4 33.32 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 116.226 1.936 . . . . 4.1799999999999997 116.226 174.459 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -110.35 105.96 2.04 Favored Glycine 0 N--CA 1.469 0.882 0 C-N-CA 125.148 1.356 . . . . 4.5599999999999996 112.547 -175.751 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -75.4 84.95 2.53 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-O 122.247 1.023 . . . . 6.3099999999999996 111.218 179.17 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 8.0 mmt -84.93 117.87 24.19 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 126.378 1.871 . . . . 3.3199999999999998 113.093 -178.289 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -70.71 140.94 51.55 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.892 1.277 . . . . 4.0199999999999996 110.126 171.431 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -53.21 -47.94 68.54 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 114.333 1.235 . . . . 3.8700000000000001 114.333 -168.147 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 15.4 t -70.83 -19.31 62.67 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.025 1.12 . . . . 4.5499999999999998 114.025 178.835 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 38.0 m -76.12 -18.92 58.93 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 120.884 -1.135 . . . . 4.6900000000000004 111.884 172.35 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 11.9 mm -66.28 -34.22 68.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 118.828 0.74 . . . . 2.5800000000000001 110.908 167.531 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -78.31 -21.88 48.99 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.044 0.838 . . . . 3.75 113.13 -177.83 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.555 ' HA ' ' HE3' ' B' ' 57' ' ' LYS . 9.8 t70 -77.78 -41.19 38.28 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 118.438 0.563 . . . . 2.71 111.357 166.23 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 50.7 tp -59.98 -48.31 82.21 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-O 118.411 -0.804 . . . . 3.6899999999999999 111.227 173.143 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 2.5 ppp? -59.93 -40.46 89.0 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.203 0.91 . . . . 2.8799999999999999 110.187 -179.493 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . 0.555 ' HE3' ' HA ' ' B' ' 54' ' ' ASP . 11.7 ttpp -61.51 -36.06 79.47 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.099 1.76 . . . . 4.0 113.227 172.6 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 5.6 t -75.16 -34.06 61.55 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.844 -1.16 . . . . 2.1299999999999999 111.581 176.417 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 70.9 mt -69.09 -34.26 74.83 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 117.437 -1.268 . . . . 2.7599999999999998 111.389 170.568 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -96.8 90.34 5.22 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.474 1.51 . . . . 1.99 113.919 -179.339 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 3.8 mptt -67.18 -19.8 65.63 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.904 1.281 . . . . 4.5599999999999996 113.28 -178.732 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -78.7 -31.76 46.67 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.161 0.892 . . . . 3.1499999999999999 112.886 173.065 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 12.5 t 63.51 24.03 13.89 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.951 1.3 . . . . 3.7400000000000002 113.637 -159.29 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 54.3 p-10 -81.57 -18.43 44.89 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.496 1.518 . . . . 2.5899999999999999 112.52 176.477 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 76.88 1.53 3.23 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 131.504 3.921 . . . . 4.3600000000000003 113.186 179.066 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . 0.401 ' CD ' ' HG1' ' B' ' 28' ' ' THR . 12.2 mm-40 -92.77 112.8 24.88 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 125.465 1.506 . . . . 2.4199999999999999 107.109 164.503 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 2.7 mt -97.65 107.46 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 O-C-N 121.045 -1.035 . . . . 2.6099999999999999 109.816 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -56.71 154.04 9.64 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.487 1.115 . . . . 3.7400000000000002 110.272 173.691 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -49.4 -46.11 47.0 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 120.727 -1.233 . . . . 3.7400000000000002 110.842 163.176 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -53.28 -31.18 42.54 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 127.958 2.503 . . . . 4.7800000000000002 115.319 173.054 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -87.19 -53.69 4.71 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.476 1.511 . . . . 1.75 109.371 176.84 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -58.42 -31.28 67.57 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 129.12 2.968 . . . . 3.3700000000000001 113.982 -177.54 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 23.3 t -56.74 -23.16 40.72 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 120.703 1.592 . . . . 3.0 112.837 178.786 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 78.2 t -64.79 -25.71 38.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 124.051 0.94 . . . . 2.6600000000000001 112.011 176.423 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -57.2 -53.16 61.29 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.489 1.516 . . . . 3.9300000000000002 110.803 169.206 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 25.7 mt -57.93 -43.48 86.32 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.18 1.392 . . . . 2.2000000000000002 109.985 179.387 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 65.3 m -58.26 -53.08 62.36 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 117.807 -1.092 . . . . 1.99 111.478 176.654 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.6 mtm -57.1 -47.76 80.28 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.602 1.092 . . . . 2.3300000000000001 112.019 -179.536 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 84.0 mt -68.68 -39.45 80.58 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.786 0.834 . . . . 2.71 112.677 -178.174 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.8 t -73.16 -31.83 64.49 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.645 -0.659 . . . . 2.8100000000000001 111.877 177.66 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 47.6 mtt -63.77 -43.74 95.48 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.787 0.721 . . . . 3.9399999999999999 110.994 169.637 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.2 -37.53 85.68 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.412 0.523 . . . . 1.5900000000000001 112.412 176.349 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -70.07 -35.77 74.47 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.612 0.967 . . . . 3.6200000000000001 113.612 172.645 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -65.88 -37.4 86.03 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 119.306 0.957 . . . . 2.6200000000000001 112.28 175.199 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -68.19 -42.37 80.01 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.337 1.055 . . . . 2.6499999999999999 111.983 173.028 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -52.51 -43.97 65.42 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.912 1.285 . . . . 3.29 112.185 175.758 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -63.08 -25.74 68.51 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.809 1.643 . . . . 3.8199999999999998 112.438 179.023 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 39.4 mt -85.3 -12.33 52.6 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.638 1.175 . . . . 2.6600000000000001 113.072 178.158 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.554 ' CD ' ' HZ1' ' B' ' 92' ' ' LYS . 14.3 mm-40 -93.19 -8.11 43.35 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.277 1.831 . . . . 3.6000000000000001 114.234 169.307 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -89.44 -46.93 8.34 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.836 2.055 . . . . 4.1299999999999999 111.425 169.801 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -71.17 0.27 8.17 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.433 1.493 . . . . 3.8100000000000001 114.848 -172.003 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . 0.554 ' HZ1' ' CD ' ' B' ' 89' ' ' GLU . 16.7 pttm . . . . . 0 C--O 1.249 1.033 0 N-CA-C 117.186 2.291 . . . . 5.2000000000000002 117.186 -168.464 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.6 mtm . . . . . 0 N--CA 1.475 0.789 0 N-CA-C 107.829 -1.175 . . . . 6.8899999999999997 107.829 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -110.1 -98.34 0.4 Allowed 'General case' 0 CA--C 1.536 0.415 0 O-C-N 125.467 1.729 . . . . 3.52 109.541 -153.218 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 67.1 p -133.96 157.86 76.74 Favored Pre-proline 0 N--CA 1.471 0.619 0 C-N-CA 124.463 1.105 . . . . 2.46 111.1 -169.571 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.99 -21.54 32.27 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 122.305 2.004 . . . . 1.5800000000000001 112.216 176.7 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.24 -44.56 52.56 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.479 1.111 . . . . 3.21 110.886 176.45 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -67.15 -33.63 75.84 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.451 -0.781 . . . . 4.0 111.7 170.134 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.428 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -62.97 -35.9 81.72 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 119.957 -1.714 . . . . 6.9100000000000001 112.037 168.765 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.59 -56.17 17.98 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 120.405 1.457 . . . . 2.04 110.954 176.451 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 70.2 mt -57.58 -39.97 77.97 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.567 1.147 . . . . 2.2599999999999998 112.847 -178.384 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 19.7 p -67.3 -39.17 85.9 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 117.83 -1.081 . . . . 3.71 112.097 174.089 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.0 m -65.48 -32.51 74.17 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.375 0.989 . . . . 2.2799999999999998 111.562 179.921 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -55.34 -57.12 13.13 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 118.227 0.467 . . . . 4.4100000000000001 110.016 168.91 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 74.9 t -60.93 -37.79 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.024 0.53 . . . . 3.1000000000000001 111.797 -176.573 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.7 m -56.26 -57.92 10.18 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.216 1.006 . . . . 2.21 111.424 175.974 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.74 -28.45 55.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 118.688 -0.672 . . . . 3.5299999999999998 110.885 -170.749 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -63.05 -41.55 99.52 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.855 1.662 . . . . 2.8900000000000001 112.596 173.892 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 18.7 m170 -66.14 -20.93 66.3 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.756 1.021 . . . . 3.1299999999999999 113.756 175.873 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -65.34 -36.76 85.0 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.77 1.168 . . . . 6.0700000000000003 111.906 172.545 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -102.81 -38.46 7.41 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 114.176 1.176 . . . . 3.5499999999999998 114.176 -170.292 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.3 t -59.02 -32.87 70.12 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 120.106 1.321 . . . . 2.6600000000000001 112.686 179.61 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -93.56 34.16 4.76 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 126.845 2.164 . . . . 1.54 113.95 179.705 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.402 ' HE ' ' CD ' ' A' ' 36' ' ' GLU . 0.9 OUTLIER -72.41 52.76 0.28 Allowed 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.202 1.501 . . . . 4.71 110.089 162.912 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . 0.254 6.3 tp10 -6.53 -92.99 0.0 OUTLIER 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.854 1.057 . . . . 9.5399999999999991 113.854 -114.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 43.24 63.47 2.06 Favored Glycine 0 C--N 1.34 0.798 0 C-N-CA 124.71 1.148 . . . . 3.71 110.979 172.255 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.9 t 66.25 141.08 0.03 OUTLIER 'General case' 0 C--O 1.25 1.125 0 C-N-CA 125.745 1.618 . . . . 3.3300000000000001 113.361 -175.309 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.4 tttp -127.59 117.5 22.15 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.133 1.373 . . . . 5.3099999999999996 110.608 -154.556 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 97.45 -17.27 0.06 Allowed 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 130.419 3.488 . . . . 5.0099999999999998 110.513 -163.27 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 47.3 p -109.74 156.63 20.06 Favored 'General case' 0 C--O 1.245 0.86 0 C-N-CA 125.939 1.695 . . . . 2.02 112.348 176.564 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -109.58 105.42 14.72 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 125.764 1.625 . . . . 3.5699999999999998 109.651 169.85 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.4 t -64.77 159.59 22.03 Favored 'General case' 0 C--N 1.318 -0.763 0 O-C-N 121.955 -0.465 . . . . 2.7000000000000002 111.304 168.749 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.4 ttp85 -45.34 -40.09 7.46 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.56 1.544 . . . . 4.9500000000000002 115.014 -175.305 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 24.6 tptp -52.7 -57.92 8.54 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 119.203 -2.186 . . . . 5.7800000000000002 115.217 163.791 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -61.76 -41.33 97.54 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.558 1.543 . . . . 1.8400000000000001 109.715 -167.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.37 -43.03 95.79 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.717 1.207 . . . . 3.3399999999999999 111.668 177.443 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -63.57 -44.33 94.42 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.539 -1.351 . . . . 5.9400000000000004 111.61 176.989 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.402 ' CD ' ' HE ' ' A' ' 22' ' ' ARG . 80.5 tt0 -59.17 -44.5 92.15 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.668 0.787 . . . . 4.3899999999999997 112.504 176.352 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.3 tt -58.16 -54.31 48.44 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.226 1.41 . . . . 2.8599999999999999 111.324 176.566 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 27.6 mt -58.78 -46.17 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 119.0 0.818 . . . . 2.3599999999999999 109.87 -175.45 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -72.93 -3.33 25.16 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.987 1.106 . . . . 5.0 113.987 -174.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 56.6 mmtt -99.22 -49.89 4.32 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.346 1.858 . . . . 4.0199999999999996 111.534 168.392 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -75.04 -48.44 23.99 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.162 0.985 . . . . 5.4500000000000002 112.244 -173.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -89.59 -48.46 7.28 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.966 1.306 . . . . 3.6000000000000001 110.202 176.329 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 9.7 t 75.66 -40.59 0.42 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 128.1 2.56 . . . . 4.4500000000000002 113.673 -175.314 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -38.97 135.19 0.92 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.183 1.793 . . . . 5.6600000000000001 114.598 -169.71 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -81.85 -23.04 58.54 Favored Glycine 0 N--CA 1.477 1.384 0 C-N-CA 125.273 1.416 . . . . 5.4100000000000001 111.514 169.432 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -57.04 -16.65 7.64 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 127.923 2.489 . . . . 6.1200000000000001 112.563 169.041 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 9.9 tpt -66.57 -28.04 68.21 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.642 1.577 . . . . 4.96 113.377 169.683 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.42 109.51 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 130.078 3.351 . . . . 9.1799999999999997 112.382 -171.139 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -50.04 -52.32 35.28 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.985 1.714 . . . . 5.3099999999999996 114.147 -170.948 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.9 t -73.11 -15.35 61.48 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 120.098 -1.626 . . . . 3.46 114.005 177.643 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 20.1 t -75.5 -10.48 59.49 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.661 1.118 . . . . 4.0300000000000002 112.393 169.391 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 82.2 mt -70.92 -29.49 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-N 119.103 0.865 . . . . 2.6200000000000001 111.278 172.795 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.25 -32.51 70.06 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 118.775 0.716 . . . . 3.2000000000000002 111.38 174.537 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -81.38 -40.07 24.05 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.862 1.265 . . . . 2.6099999999999999 112.862 176.366 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.4 tt -66.26 -42.57 88.3 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 117.767 -1.111 . . . . 3.1000000000000001 111.503 176.493 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ppp? -65.04 -40.42 94.77 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.592 1.087 . . . . 3.0600000000000001 110.084 177.013 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.48 -38.97 82.21 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.068 0.947 . . . . 4.4699999999999998 112.375 172.173 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.3 t -57.98 -27.09 63.15 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.773 1.17 . . . . 2.7999999999999998 113.963 176.139 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 12.5 mt -74.27 -24.84 59.33 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.339 -0.85 . . . . 2.8500000000000001 112.372 178.584 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -102.31 115.64 30.98 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.58 1.552 . . . . 2.3700000000000001 111.685 -154.702 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -81.5 -14.04 57.42 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.133 1.16 . . . . 5.0300000000000002 114.133 -169.585 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 36.9 p-10 -124.49 -10.56 7.4 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.519 1.528 . . . . 2.5099999999999998 113.963 -178.097 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.3 m 58.57 42.27 21.01 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.516 1.527 . . . . 4.2400000000000002 111.861 -173.577 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.4 p30 -72.98 -29.24 62.9 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.073 1.749 . . . . 2.3599999999999999 111.347 -175.896 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 114.76 -6.2 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.456 1 C-N-CA 135.225 5.41 . . . . 4.7599999999999998 113.431 175.795 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -132.54 129.36 38.96 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.021 1.728 . . . . 4.1299999999999999 110.812 -168.506 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 10.6 mm -92.46 99.9 10.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 126.076 1.75 . . . . 2.1299999999999999 108.979 -173.02 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.415 ' OD2' ' HE3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -59.92 161.91 6.07 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.727 2.011 . . . . 3.1600000000000001 111.467 165.624 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.78 -43.0 76.35 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.658 -1.276 . . . . 3.3399999999999999 113.318 -177.537 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.533 ' HE2' ' SD ' ' B' ' 81' ' ' MET . 3.4 mtmt -73.3 -19.23 61.09 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 120.502 -1.374 . . . . 4.29 112.964 176.415 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -69.25 -56.46 7.51 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 107.85 -1.167 . . . . 2.1000000000000001 107.85 166.074 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -58.03 -28.94 64.93 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 127.915 2.486 . . . . 3.29 114.844 -177.976 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 53.1 m -53.04 -30.15 33.97 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 120.456 -1.402 . . . . 2.25 113.048 168.122 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 97.8 t -65.58 -31.89 55.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 CA-C-N 120.251 1.387 . . . . 3.1099999999999999 111.559 179.094 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -67.28 -51.56 51.4 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.122 0.969 . . . . 2.9700000000000002 109.473 176.396 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 59.9 mt -57.62 -37.1 72.7 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.859 1.264 . . . . 2.71 111.647 174.253 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 28.0 m -66.48 -48.83 68.62 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.758 0.823 . . . . 1.9099999999999999 111.023 176.082 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 19.4 ttp -62.93 -47.08 84.78 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.969 0.907 . . . . 3.77 111.656 -177.038 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 97.4 mt -65.73 -43.41 89.13 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.318 0.647 . . . . 2.29 112.203 177.385 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 7.7 t -65.21 -32.83 74.7 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 119.689 1.131 . . . . 2.6099999999999999 112.691 177.158 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 27.5 mtp -68.18 -34.62 76.63 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 118.689 -0.672 . . . . 2.8500000000000001 112.546 170.864 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.63 -40.65 88.85 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.627 1.103 . . . . 2.0 112.42 173.244 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -61.78 -24.6 66.94 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 113.56 0.948 . . . . 3.2200000000000002 113.56 172.002 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -72.95 -41.21 64.68 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.537 1.062 . . . . 2.7200000000000002 112.682 172.3 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -66.66 -37.57 85.07 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 118.569 0.622 . . . . 2.79 111.084 179.23 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.96 -55.43 23.55 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.968 1.307 . . . . 3.2599999999999998 111.322 167.8 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -58.02 -26.73 62.8 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.263 1.425 . . . . 3.6699999999999999 113.127 -176.898 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 76.0 mt -75.64 -20.56 58.42 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.625 1.17 . . . . 2.5099999999999998 113.657 175.454 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -91.52 -37.14 13.32 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.967 0.907 . . . . 3.52 113.359 169.067 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -62.75 -28.82 70.23 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.278 1.431 . . . . 3.5099999999999998 114.197 -175.845 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -88.91 -3.53 58.71 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.366 1.066 . . . . 2.9700000000000002 113.469 -176.596 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . 0.285 0.0 OUTLIER . . . . . 0 C--O 1.246 0.899 0 CA-C-O 116.055 -1.926 . . . . 4.3399999999999999 112.171 -155.709 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.911 0 N-CA-C 108.332 -0.988 . . . . 6.2999999999999998 108.332 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -138.61 148.15 43.76 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 126.957 2.103 . . . . 4.21 106.008 -164.735 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 72.4 p -59.04 162.92 6.4 Favored Pre-proline 0 N--CA 1.474 0.738 0 C-N-CA 123.708 0.803 . . . . 3.23 111.999 170.889 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -71.69 -17.18 29.77 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 121.944 1.762 . . . . 1.6599999999999999 113.371 -178.43 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tt -65.02 -39.04 92.81 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.402 1.001 . . . . 4.1299999999999999 111.57 176.081 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -60.24 -42.73 95.87 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.694 0.759 . . . . 4.9199999999999999 111.424 174.178 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -67.15 -29.88 69.71 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.065 -1.022 . . . . 5.3200000000000003 112.626 175.631 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.33 -42.99 82.67 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.734 1.214 . . . . 1.6000000000000001 110.744 171.837 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.83 -38.45 90.8 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.267 -0.895 . . . . 2.3399999999999999 112.026 173.92 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.15 -43.46 95.72 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.075 -1.016 . . . . 2.1499999999999999 111.286 171.187 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 93.8 m -57.62 -38.78 75.55 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.783 1.233 . . . . 2.2400000000000002 111.425 -178.702 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -59.75 -38.83 82.86 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.758 1.022 . . . . 4.8899999999999997 113.758 172.87 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 21.1 t -69.88 -31.81 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 CA-C-N 119.627 1.103 . . . . 3.2400000000000002 111.259 175.559 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 44.6 m -77.85 -30.28 50.9 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 126.947 2.099 . . . . 1.8200000000000001 113.327 -174.807 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 12.7 p -78.13 -29.58 48.92 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.164 0.893 . . . . 2.1499999999999999 110.612 162.502 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.77 -57.29 13.3 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 118.261 0.482 . . . . 3.52 110.59 -175.872 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 14.0 m80 -68.7 -8.62 44.3 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.673 1.36 . . . . 2.7599999999999998 114.673 174.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -75.42 -49.97 17.28 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 120.903 -1.123 . . . . 5.0999999999999996 111.332 169.55 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -93.77 -23.99 17.97 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.185 0.994 . . . . 3.21 113.67 -174.104 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 97.6 p -65.59 -11.65 46.13 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 115.865 1.802 . . . . 3.29 115.865 -175.578 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.79 -0.2 83.98 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-O 117.457 -1.746 . . . . 2.7999999999999998 114.344 171.769 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -62.43 -31.36 72.05 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 120.496 2.148 . . . . 4.3300000000000001 112.66 178.733 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -177.51 -148.84 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 128.71 2.804 . . . . 4.7599999999999998 108.939 165.385 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 26.29 87.43 0.01 OUTLIER Glycine 0 N--CA 1.477 1.376 0 C-N-CA 128.459 2.933 . . . . 4.3499999999999996 113.551 167.464 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 6.0 m 43.58 150.17 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 129.331 3.052 . . . . 4.0199999999999996 117.104 -172.001 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 71.8 tttt -80.32 -12.38 59.61 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 119.503 -1.998 . . . . 7.4000000000000004 113.579 179.53 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 62.7 tp -71.85 -54.56 9.71 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 119.265 0.939 . . . . 4.1900000000000004 109.828 164.058 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 35.8 p -93.94 162.43 13.9 Favored 'General case' 0 C--O 1.254 1.301 0 C-N-CA 125.503 1.521 . . . . 2.2200000000000002 114.832 -159.059 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 24.6 mt -105.87 86.59 2.41 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.422 2.289 . . . . 2.7000000000000002 111.024 173.401 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 7.9 t -71.72 -178.41 2.25 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 119.768 -1.832 . . . . 3.8500000000000001 112.288 170.353 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -41.06 -60.2 1.28 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.634 1.574 . . . . 5.5499999999999998 114.758 -163.794 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.69 -32.7 58.06 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 120.12 1.327 . . . . 5.2000000000000002 112.147 -174.398 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -52.5 -52.2 55.65 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.558 1.543 . . . . 1.8600000000000001 111.539 172.458 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.65 -48.21 80.32 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.919 1.288 . . . . 3.3599999999999999 111.748 -178.663 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -57.25 -46.14 83.3 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 121.018 -1.051 . . . . 5.6399999999999997 112.892 177.842 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -57.41 -47.57 81.38 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 118.074 -0.965 . . . . 3.0699999999999998 113.03 175.287 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.47 -53.09 40.86 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.619 1.168 . . . . 3.0499999999999998 111.654 175.227 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 38.6 mt -55.78 -52.49 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 CA-C-N 118.949 0.795 . . . . 2.21 109.18 177.581 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -66.94 -10.57 50.49 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 114.043 1.127 . . . . 5.6799999999999997 114.043 -174.917 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 34.6 mmtm -95.68 -39.22 10.0 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.584 1.954 . . . . 4.5300000000000002 113.392 176.649 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -118.71 -35.2 3.76 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 118.163 -0.922 . . . . 5.5099999999999998 113.066 -166.34 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -109.19 57.76 0.61 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.528 1.931 . . . . 2.8100000000000001 108.975 171.243 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 76.8 m -54.59 -56.46 18.7 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.061 -0.971 . . . . 4.1299999999999999 113.523 -167.169 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 95.7 mt 59.09 -23.89 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 129.256 3.023 . . . . 5.8700000000000001 118.973 164.437 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.44 -55.92 4.67 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 125.679 1.609 . . . . 4.4900000000000002 112.28 177.914 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -66.83 1.04 2.04 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.989 1.107 . . . . 5.6799999999999997 113.989 171.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.08 57.02 1.72 Allowed 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 125.008 2.337 . . . . 2.54 112.593 172.248 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -87.39 162.62 17.22 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 129.997 3.319 . . . . 5.25 110.652 174.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -56.94 -36.46 70.27 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 120.761 -1.212 . . . . 4.0999999999999996 113.5 -173.389 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 7.0 m -72.08 -5.56 36.14 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 116.245 1.943 . . . . 3.3799999999999999 116.245 175.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 62.0 p -107.8 -39.69 5.49 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 120.426 1.466 . . . . 2.8900000000000001 111.516 165.982 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 11.8 mm -56.88 -49.3 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 126.678 1.991 . . . . 2.8100000000000001 113.245 176.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -76.31 -22.96 54.35 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.282 0.845 . . . . 3.1800000000000002 113.282 -166.891 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.467 ' CG ' ' HZ3' ' B' ' 57' ' ' LYS . 8.1 t70 -77.77 -39.66 43.38 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.124 0.569 . . . . 3.7999999999999998 111.494 167.285 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.92 -42.83 90.63 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 122.994 0.518 . . . . 3.27 110.537 174.707 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 7.2 tpt -57.77 -53.01 63.06 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.76 2.424 . . . . 2.4399999999999999 112.137 169.171 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . 0.467 ' HZ3' ' CG ' ' B' ' 54' ' ' ASP . 8.1 tttm -54.76 -43.81 73.08 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 120.675 -1.266 . . . . 5.6799999999999997 112.646 174.444 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 73.4 m -82.46 -24.63 34.17 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.923 1.289 . . . . 2.4399999999999999 112.35 -171.067 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 mt -60.77 -57.79 11.21 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 126.445 1.898 . . . . 3.6000000000000001 110.942 157.192 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -89.92 65.75 6.73 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.645 1.578 . . . . 1.53 111.508 -168.721 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 55.7 mttm -58.08 -31.91 67.54 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 115.177 1.547 . . . . 3.8399999999999999 115.177 -160.772 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -88.86 -5.49 57.99 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.288 1.218 . . . . 2.7799999999999998 114.288 176.394 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 11.2 t 61.22 25.64 15.6 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.544 1.938 . . . . 3.0099999999999998 114.065 178.838 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 55.7 p-10 -72.48 -16.15 61.8 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.838 1.255 . . . . 2.98 111.572 178.675 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 63.97 7.53 3.39 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 130.904 3.682 . . . . 4.4900000000000002 114.815 -177.485 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -89.92 127.73 36.07 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 107.053 -1.462 . . . . 3.4700000000000002 107.053 158.454 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 97.5 mt -111.81 110.35 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 N-CA-C 108.8 -0.815 . . . . 2.54 108.8 169.68 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -87.58 164.31 16.16 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 128.577 2.751 . . . . 4.1799999999999997 110.54 166.514 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -43.73 -38.81 3.36 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.704 1.601 . . . . 3.75 114.746 171.076 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 tpmt? -65.91 -28.42 68.92 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.04 0.936 . . . . 7.2000000000000002 112.938 179.834 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -85.27 -53.13 5.43 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.83 1.252 . . . . 2.02 109.858 167.517 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -47.63 -38.26 14.34 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 126.802 2.041 . . . . 4.0 114.603 -175.487 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 1.1 t -62.27 -17.13 57.7 Favored 'General case' 0 CA--C 1.549 0.904 0 O-C-N 120.342 -1.474 . . . . 3.1600000000000001 114.345 176.824 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 76.0 t -59.33 -45.1 93.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 O-C-N 120.269 -1.519 . . . . 2.4399999999999999 110.991 169.75 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -60.29 -51.45 69.49 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.551 0.74 . . . . 2.6600000000000001 110.249 175.893 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 31.9 mt -55.96 -39.28 71.52 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.745 0.818 . . . . 2.2000000000000002 112.383 176.576 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 95.0 m -60.61 -53.53 56.37 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.759 1.223 . . . . 1.78 111.87 176.715 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 33.1 mtm -63.78 -36.33 83.52 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 118.727 0.694 . . . . 2.3599999999999999 112.399 -177.134 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 82.1 mt -67.77 -45.82 73.81 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.91 0.884 . . . . 2.3100000000000001 111.947 176.814 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 61.7 m -59.79 -37.63 79.67 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 118.083 -0.96 . . . . 2.6899999999999999 112.719 173.744 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 81' ' ' MET . . . . . 0.533 ' SD ' ' HE2' ' A' ' 70' ' ' LYS . 21.9 mtp -66.44 -36.25 82.33 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.476 1.034 . . . . 3.5600000000000001 113.204 174.817 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.04 -47.65 73.67 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.856 0.753 . . . . 1.9299999999999999 111.635 173.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -65.01 -30.46 71.44 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.429 0.9 . . . . 4.1399999999999997 113.429 176.354 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -61.84 -52.59 63.54 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 118.983 0.811 . . . . 4.3200000000000003 112.268 174.322 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -61.74 -47.22 86.21 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.229 1.411 . . . . 3.0 111.935 -179.774 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.27 -46.97 69.49 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.517 1.527 . . . . 4.9699999999999998 111.717 177.346 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -61.57 -29.93 70.33 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.347 1.059 . . . . 4.1799999999999997 112.931 178.133 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 68.4 mt -77.19 -11.88 59.88 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.043 0.937 . . . . 2.9100000000000001 113.24 179.657 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.448 ' O ' ' HE2' ' B' ' 92' ' ' LYS . 24.4 mm-40 -106.13 0.84 25.75 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.54 1.536 . . . . 5.1500000000000004 114.72 170.992 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -110.64 -50.91 2.91 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.235 1.814 . . . . 2.9700000000000002 112.46 -178.406 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -90.38 14.74 12.1 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 125.358 1.463 . . . . 3.8999999999999999 113.623 -177.136 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . 0.448 ' HE2' ' O ' ' B' ' 89' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 115.814 -2.041 . . . . 5.0700000000000003 115.974 -177.246 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.16 0 CA-C-O 117.606 -1.188 . . . . 9.3499999999999996 109.213 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.67 171.68 14.31 Favored 'General case' 0 C--O 1.239 0.525 0 O-C-N 124.031 0.832 . . . . 5.9400000000000004 109.332 156.365 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.5 t -55.58 146.91 42.39 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.425 1.49 . . . . 3.5800000000000001 112.751 178.465 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -62.35 -14.75 40.65 Favored 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 122.084 1.856 . . . . 1.9399999999999999 112.69 169.345 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tt -76.99 -34.64 57.52 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.387 0.994 . . . . 3.52 111.705 173.313 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -59.77 -47.08 87.13 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.618 1.099 . . . . 4.7999999999999998 108.835 166.375 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.406 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -59.03 -27.26 65.3 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.916 -1.115 . . . . 4.8099999999999996 112.685 175.176 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -75.1 -48.56 23.21 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.798 1.239 . . . . 2.0299999999999998 112.589 172.992 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.4 mt -57.99 -42.67 85.62 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.693 1.133 . . . . 2.6200000000000001 111.538 172.479 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 8.2 m -57.36 -51.54 69.0 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.346 1.858 . . . . 3.02 111.137 170.555 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.7 m -58.78 -44.22 90.64 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.272 1.396 . . . . 2.4199999999999999 111.731 178.112 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 5.8 tmm? -55.95 -58.82 6.29 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.615 0.766 . . . . 4.5599999999999996 110.538 172.609 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.1 p -66.78 -26.6 37.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 CA-C-N 119.769 1.168 . . . . 3.3799999999999999 112.931 -177.75 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 98.7 m -60.86 -61.27 2.7 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.399 1.079 . . . . 1.8799999999999999 109.71 175.878 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.78 -31.87 65.19 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-O 118.383 -0.817 . . . . 3.6200000000000001 109.954 -173.746 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -65.11 -50.43 66.12 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.115 0.87 . . . . 3.29 112.547 171.854 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -68.28 -19.69 64.72 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.061 0.846 . . . . 2.5899999999999999 111.887 -178.05 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.8 mtpp -68.93 -53.47 20.73 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 120.822 -1.174 . . . . 4.1500000000000004 111.928 163.48 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -73.53 -32.75 64.38 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.689 1.366 . . . . 3.8399999999999999 114.689 -175.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.5 p -67.41 -22.37 65.54 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 121.298 1.863 . . . . 3.1699999999999999 112.439 172.736 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.53 -2.68 82.05 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.169 1.366 . . . . 1.8300000000000001 114.959 171.425 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.477 ' HE ' ' CD ' ' A' ' 36' ' ' GLU . 49.6 tpt85 -64.0 -19.17 64.98 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.53 1.665 . . . . 5.0800000000000001 114.943 -172.222 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -155.68 -178.71 7.48 Favored 'General case' 0 C--O 1.247 0.938 0 C-N-CA 129.701 3.2 . . . . 3.8100000000000001 107.808 165.673 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 24.96 99.41 0.01 OUTLIER Glycine 0 C--N 1.346 1.133 0 C-N-CA 126.946 2.212 . . . . 2.8500000000000001 114.651 149.364 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t 60.28 136.78 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.822 1.649 . . . . 3.1400000000000001 112.819 -176.931 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -80.5 -9.72 59.76 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.933 1.086 . . . . 6.0300000000000002 113.933 171.244 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 73.9 mt -79.91 -40.0 29.17 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 118.986 0.812 . . . . 4.6799999999999997 110.597 174.523 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.7 p -121.94 150.18 42.37 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-O 122.877 1.322 . . . . 2.52 112.545 -161.645 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.51 120.85 43.05 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 114.041 -1.436 . . . . 3.8500000000000001 111.706 176.888 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.5 p -68.85 169.43 11.5 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.911 1.285 . . . . 3.77 113.202 167.636 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 46.2 ttt85 -50.35 -26.77 5.27 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 115.549 1.685 . . . . 5.3200000000000003 115.549 176.656 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.86 -28.71 14.59 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.575 1.324 . . . . 5.1500000000000004 114.575 174.455 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -58.37 -52.44 65.59 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.563 1.074 . . . . 1.6100000000000001 109.021 163.615 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.9 tt -57.01 -45.89 82.73 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 128.142 2.577 . . . . 4.7800000000000002 112.168 175.573 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.3 ttmt -70.38 -38.19 74.67 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 118.692 0.678 . . . . 4.4199999999999999 111.63 -178.871 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.477 ' CD ' ' HE ' ' A' ' 22' ' ' ARG . 25.2 tt0 -60.1 -47.63 85.09 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 118.265 -0.874 . . . . 4.7800000000000002 111.729 169.097 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 tt -56.17 -59.87 4.31 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.46 1.104 . . . . 3.4100000000000001 110.652 179.289 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.7 mt -63.63 -54.37 33.15 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.523 0 CA-C-O 118.626 -0.702 . . . . 2.5699999999999998 109.408 -177.843 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.1 ttpp -72.0 -8.24 53.4 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 120.978 1.717 . . . . 5.0700000000000003 114.097 -172.691 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -90.77 -54.28 4.04 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 120.288 1.404 . . . . 5.3600000000000003 112.874 165.365 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -71.91 -33.24 68.14 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.82 1.191 . . . . 5.1100000000000003 111.511 -177.362 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.4 mt -111.53 65.32 0.62 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.81 1.644 . . . . 4.04 109.42 163.401 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 15.2 t -75.33 36.12 0.12 Allowed 'General case' 0 CA--C 1.55 0.975 0 O-C-N 120.68 -1.263 . . . . 4.5700000000000003 112.798 172.619 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 31.3 mt -96.23 169.88 9.63 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.488 1.515 . . . . 5.7800000000000002 111.466 -175.398 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.43 -25.44 74.8 Favored Glycine 0 N--CA 1.475 1.278 0 C-N-CA 123.929 0.776 . . . . 4.5499999999999998 112.502 -179.481 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -59.09 -34.51 72.08 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.752 2.021 . . . . 5.2999999999999998 111.402 173.58 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.53 66.34 2.77 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 124.511 2.101 . . . . 2.6600000000000001 112.878 -172.376 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 ptpp? -72.78 161.95 30.09 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 112.315 -2.22 . . . . 5.2400000000000002 110.692 156.39 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -49.38 -44.91 45.32 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 118.916 0.78 . . . . 5.4000000000000004 112.518 -179.253 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.2 m -61.33 -19.31 61.66 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.797 1.406 . . . . 3.27 114.797 178.558 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.8 m -83.85 -27.18 28.89 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.555 1.071 . . . . 3.6099999999999999 112.675 170.219 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 88.4 mt -80.91 -32.94 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 126.195 1.798 . . . . 3.1099999999999999 111.113 -178.88 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -61.93 -55.84 25.4 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.555 1.142 . . . . 3.8100000000000001 112.028 176.875 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -66.67 -26.16 66.91 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.764 0.653 . . . . 3.3599999999999999 112.764 177.163 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.1 tt -69.95 -38.92 76.28 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.354 -0.841 . . . . 4.0899999999999999 110.657 172.261 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.4 ttt -59.72 -49.59 77.14 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-O 117.85 -1.071 . . . . 3.2799999999999998 111.83 165.515 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -66.08 -22.97 66.43 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 121.171 1.805 . . . . 6.0499999999999998 113.124 179.041 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 29.0 t -81.15 -38.9 26.41 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.035 1.334 . . . . 2.8199999999999998 112.043 176.545 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 84.3 mt -81.8 -44.98 16.23 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 119.065 0.848 . . . . 2.9199999999999999 112.153 175.593 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -77.51 63.72 2.71 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.96 1.304 . . . . 2.73 111.327 -177.379 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -58.73 -22.31 57.33 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 125.813 1.645 . . . . 5.5099999999999998 113.936 -172.923 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -106.87 0.83 24.22 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 114.703 1.371 . . . . 2.9100000000000001 114.703 173.569 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.5 t 62.0 27.61 16.73 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.868 1.432 . . . . 3.9900000000000002 114.868 169.201 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.3 p-10 -86.69 2.6 48.01 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.171 1.788 . . . . 2.2400000000000002 111.914 -174.742 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.69 1.34 3.96 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 129.813 3.245 . . . . 4.5899999999999999 113.565 -173.802 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -119.59 131.99 55.62 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 123.691 1.71 . . . . 3.25 111.251 -179.392 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 3.6 mp -110.01 106.55 20.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 N-CA-C 107.653 -1.24 . . . . 3.5600000000000001 107.653 171.536 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -79.75 166.06 22.16 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.404 1.481 . . . . 3.4500000000000002 110.923 168.471 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -45.29 -38.26 5.49 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.556 1.142 . . . . 3.2999999999999998 112.817 171.77 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.87 -26.98 68.56 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 115.287 1.588 . . . . 6.4000000000000004 115.287 177.012 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -90.74 -47.06 7.86 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.488 1.915 . . . . 2.5600000000000001 109.414 170.789 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -57.97 -34.35 69.86 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 126.825 2.05 . . . . 3.7599999999999998 114.399 -173.84 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.6 t -59.21 -18.74 39.43 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.878 1.217 . . . . 2.96 112.884 -178.163 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 84.9 t -65.49 -25.35 36.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.804 0.841 . . . . 3.0299999999999998 112.024 172.135 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -63.21 -52.66 61.35 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.071 1.348 . . . . 4.0599999999999996 110.226 173.093 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.1 mt -58.28 -39.7 79.94 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.423 1.089 . . . . 3.4199999999999999 110.06 177.34 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.6 m -62.82 -52.44 63.14 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 117.707 -1.14 . . . . 2.2400000000000002 112.045 174.254 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 70.2 mtm -55.66 -45.43 77.71 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.876 1.216 . . . . 2.8100000000000001 111.754 -179.553 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 47.4 mt -76.68 -40.57 48.44 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.806 0.842 . . . . 2.48 112.444 -177.098 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 42.4 t -62.54 -36.66 83.33 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.53 1.059 . . . . 3.1200000000000001 111.943 171.469 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 83.2 mtp -64.27 -39.46 93.98 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.223 0.92 . . . . 3.0499999999999998 112.149 170.408 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.11 -45.98 82.9 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 119.293 0.951 . . . . 2.04 112.164 177.351 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -64.52 -36.12 83.18 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.248 0.833 . . . . 3.8900000000000001 113.248 175.136 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.83 -46.33 89.94 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.016 0.825 . . . . 2.98 112.079 174.542 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -67.33 -37.32 83.12 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.953 -0.467 . . . . 2.8500000000000001 111.163 -177.943 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.93 -54.98 26.96 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.027 1.331 . . . . 3.0899999999999999 111.053 169.727 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -60.84 -30.66 70.24 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.318 1.047 . . . . 3.7000000000000002 112.612 -175.852 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 69.6 mt -74.56 -15.36 60.85 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.042 0.937 . . . . 3.0 113.243 176.052 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -97.8 -23.99 15.64 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.295 1.221 . . . . 3.29 114.295 167.633 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -72.47 -30.54 64.64 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.446 1.499 . . . . 4.0099999999999998 113.79 179.966 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -100.65 34.51 2.41 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.89 1.276 . . . . 3.2999999999999998 113.212 -169.559 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt . . . . . 0 C--O 1.252 1.23 0 C-N-CA 127.815 2.446 . . . . 4.4400000000000004 115.809 -173.366 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 15.1 mmt . . . . . 0 N--CA 1.476 0.847 0 N-CA-C 109.042 -0.725 . . . . 9.1300000000000008 109.042 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -90.68 158.54 16.85 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 127.45 2.3 . . . . 6.5800000000000001 109.876 179.975 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.07 154.75 13.95 Favored Pre-proline 0 N--CA 1.471 0.617 0 C-N-CA 129.445 3.098 . . . . 3.0699999999999998 111.559 166.156 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -69.39 -31.59 21.85 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.489 2.126 . . . . 3.1400000000000001 115.237 -156.337 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 8.5 tt -68.67 -54.38 16.61 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 120.351 1.432 . . . . 5.04 111.378 171.856 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -57.66 -43.6 85.08 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.718 0.807 . . . . 6.1799999999999997 111.241 -178.545 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.36 -38.03 40.2 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 125.449 1.5 . . . . 5.0099999999999998 112.926 175.371 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.08 -43.58 61.64 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.604 0.761 . . . . 2.0800000000000001 110.409 179.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 73.2 mt -60.54 -36.39 78.34 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 123.513 0.725 . . . . 3.21 112.088 174.051 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.4 m -55.19 -45.31 75.82 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 118.61 0.641 . . . . 2.3300000000000001 112.074 170.338 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.4 t -72.35 -29.82 64.16 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.084 -0.96 . . . . 3.4300000000000002 112.612 179.352 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 43.3 mtp -61.32 -51.61 68.12 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 118.151 -0.928 . . . . 4.1799999999999997 111.529 176.02 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 26.3 m -62.65 -33.28 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 CA-C-N 119.037 0.835 . . . . 3.4399999999999999 112.15 176.592 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 54.0 m -67.93 -37.94 82.24 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.19 1.396 . . . . 2.2000000000000002 113.049 -178.224 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.59 -38.35 74.0 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 118.798 0.726 . . . . 2.3900000000000001 111.277 165.408 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -65.88 -49.68 67.21 Favored 'General case' 0 N--CA 1.462 0.139 0 O-C-N 123.929 0.768 . . . . 3.4300000000000002 111.439 -167.422 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -64.73 -23.49 67.27 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.903 0.774 . . . . 4.6100000000000003 112.44 -179.095 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -78.81 -52.04 8.91 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.659 -0.651 . . . . 5.4100000000000001 111.45 178.187 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -66.86 -43.0 84.74 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.069 -1.019 . . . . 3.2999999999999998 112.137 178.181 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 83.8 p -74.9 -16.7 60.65 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.137 1.162 . . . . 2.6400000000000001 114.137 176.491 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.65 -23.56 49.74 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-O 117.683 -1.621 . . . . 1.54 113.748 170.881 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.92 -19.18 60.77 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 119.939 1.87 . . . . 5.54 114.037 -165.442 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -124.49 122.67 38.26 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 119.096 0.862 . . . . 3.77 108.875 169.805 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.11 -1.23 2.87 Favored Glycine 0 N--CA 1.477 1.428 0 C-N-CA 127.968 2.699 . . . . 4.2199999999999998 117.793 -144.718 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 52.8 p -56.66 75.74 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.973 0 CA-C-O 121.463 0.649 . . . . 6.2000000000000002 109.885 141.986 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -75.87 118.98 19.23 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 119.657 -1.902 . . . . 6.96 111.208 -173.0 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 86.3 mt 96.37 -8.2 0.08 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 130.376 3.47 . . . . 5.6699999999999999 112.751 -179.361 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 45.2 p -108.19 144.09 36.1 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 124.904 1.282 . . . . 2.79 111.635 168.047 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 29.1 mt -97.73 114.21 26.16 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.388 1.875 . . . . 2.8500000000000001 112.527 177.361 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 20.3 p -68.86 167.86 14.72 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.533 1.533 . . . . 4.4199999999999999 113.798 165.292 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -58.58 -0.62 0.11 Allowed 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 115.958 1.836 . . . . 4.6900000000000004 115.958 172.554 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.0 -44.79 3.24 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.577 1.551 . . . . 4.4299999999999997 112.819 169.693 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -54.08 -44.97 71.63 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.478 1.036 . . . . 1.9299999999999999 109.538 171.819 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 56.1 tp -67.6 -44.08 78.95 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.599 1.559 . . . . 3.4900000000000002 112.448 179.449 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -55.39 -43.7 75.44 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.856 -0.592 . . . . 4.0899999999999999 111.147 172.537 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -60.73 -52.92 63.07 Favored 'General case' 0 C--O 1.224 -0.279 0 O-C-N 123.824 0.702 . . . . 2.8399999999999999 110.761 178.085 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.6 tt -59.14 -58.89 6.65 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.668 1.187 . . . . 3.0800000000000001 110.565 -178.534 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 25.7 mt -54.56 -46.47 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 119.304 0.956 . . . . 1.6899999999999999 110.073 179.159 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -74.32 -17.91 60.78 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 115.111 1.522 . . . . 7.1799999999999997 115.111 -177.354 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -93.15 -14.32 27.34 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.358 1.863 . . . . 4.1500000000000004 112.66 171.811 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -96.54 -37.09 10.53 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.13 1.772 . . . . 5.21 111.537 176.497 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -127.33 120.86 29.52 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.637 1.575 . . . . 2.7400000000000002 109.446 174.152 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 4.7 t -131.58 -9.42 3.62 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 115.255 1.576 . . . . 3.7999999999999998 115.255 174.088 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -47.46 -16.19 0.06 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 128.654 2.782 . . . . 3.9700000000000002 118.432 175.878 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.88 169.05 12.62 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-N 120.106 1.321 . . . . 3.5699999999999998 114.711 178.295 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 26.0 tp10 62.98 -22.19 0.05 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 129.775 3.23 . . . . 5.5300000000000002 117.203 172.776 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 32.9 tpp -75.74 82.11 2.7 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.459 -1.401 . . . . 2.75 111.332 -179.621 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 41.9 mttt -89.45 173.98 8.04 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.668 2.387 . . . . 4.2699999999999996 110.771 179.753 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 44.8 tp10 -48.79 -52.72 22.44 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.856 0.862 . . . . 3.8700000000000001 111.202 171.574 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 2.8 m -64.67 -27.61 69.04 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.372 1.249 . . . . 3.6499999999999999 114.372 177.417 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 3.8 m -74.0 -31.72 63.07 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.399 -0.813 . . . . 3.7000000000000002 111.479 176.828 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 28.9 mm -68.72 -38.47 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.66 0.784 . . . . 2.4700000000000002 111.11 171.575 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -70.55 -43.68 69.03 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.654 0.983 . . . . 3.3599999999999999 113.654 -167.542 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.99 -27.43 26.45 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 113.474 0.916 . . . . 3.7799999999999998 113.474 175.748 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 60.6 tp -56.22 -48.42 76.49 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 118.661 -0.685 . . . . 3.1200000000000001 110.199 167.82 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.9 ppp? -62.03 -32.17 72.64 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.605 1.093 . . . . 3.1800000000000002 113.681 -177.154 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 44.9 mttp -65.59 -25.25 67.32 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.041 0.837 . . . . 6.9199999999999999 112.685 174.494 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.1 t -92.17 -32.29 15.15 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.928 1.291 . . . . 2.27 113.896 177.007 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 69.3 mt -74.43 -25.44 59.45 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.947 0.899 . . . . 3.2000000000000002 112.81 175.143 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -80.81 121.5 26.02 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 122.457 1.122 . . . . 1.45 111.013 174.32 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -85.57 -13.77 47.83 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.059 1.133 . . . . 6.8300000000000001 114.059 -156.533 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 45.5 p-10 -141.95 -6.46 0.97 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.385 2.274 . . . . 3.23 115.324 -169.566 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 68.73 43.59 1.26 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.927 1.291 . . . . 3.0699999999999998 113.098 -175.086 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 40.0 p30 -87.96 -16.86 32.62 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.941 1.297 . . . . 2.1899999999999999 112.004 165.027 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 70.47 14.78 7.33 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 130.258 3.423 . . . . 6.6900000000000004 114.819 179.099 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -124.26 143.79 50.34 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.362 1.065 . . . . 3.6099999999999999 110.665 161.36 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 6.3 mm -97.34 105.38 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 O-C-N 121.33 -0.856 . . . . 2.52 110.143 179.135 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.02 155.69 39.93 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.998 1.319 . . . . 2.8999999999999999 111.437 166.355 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -46.44 -47.2 19.1 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.711 1.374 . . . . 4.8700000000000001 114.711 177.224 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . 0.301 0.3 OUTLIER -85.38 -1.15 56.7 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 120.329 -1.482 . . . . 5.3200000000000003 114.598 177.688 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -77.03 -53.85 7.29 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 108.866 -0.79 . . . . 2.2400000000000002 108.866 152.15 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -52.82 -29.84 30.0 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 127.579 2.352 . . . . 3.7799999999999998 115.272 -173.827 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 26.8 t -57.14 -21.63 34.04 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 120.588 -1.32 . . . . 2.5299999999999998 113.679 170.589 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 87.5 t -66.83 -45.88 86.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 120.109 1.322 . . . . 3.1299999999999999 110.666 174.991 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -56.38 -46.39 80.12 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.146 0.978 . . . . 2.6299999999999999 111.512 172.532 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 33.7 mt -61.19 -41.88 97.59 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.426 -0.797 . . . . 2.6000000000000001 111.533 178.231 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 93.7 m -56.53 -49.9 73.41 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.307 0.958 . . . . 2.3199999999999998 111.883 171.333 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 76.7 mtp -60.35 -46.4 90.05 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.838 0.744 . . . . 2.6400000000000001 111.922 -177.895 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 82.3 mt -62.35 -50.67 70.65 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.064 0.546 . . . . 3.1400000000000001 110.884 175.172 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 88.2 m -59.11 -33.02 70.36 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.151 0.887 . . . . 3.7200000000000002 113.279 179.942 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 63.8 mtt -74.45 -34.67 63.23 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.043 0.937 . . . . 5.0700000000000003 113.468 172.78 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.79 -41.35 71.76 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.737 1.153 . . . . 2.2799999999999998 111.662 176.446 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -57.52 -23.22 49.0 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.781 1.232 . . . . 4.0700000000000003 112.636 172.912 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -67.75 -42.72 81.36 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.178 -0.952 . . . . 2.8599999999999999 111.782 173.629 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -80.94 -32.63 34.51 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.291 1.036 . . . . 2.6400000000000001 111.563 -177.816 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -54.91 -37.28 66.16 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.255 1.822 . . . . 3.79 111.644 166.56 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -74.27 -16.68 60.94 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.838 1.255 . . . . 3.21 113.042 174.946 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 6.7 mp -79.29 -25.94 42.36 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 120.489 -1.382 . . . . 4.2800000000000002 113.107 168.906 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -62.55 -22.03 66.03 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 113.187 0.81 . . . . 7.3300000000000001 113.187 169.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -85.33 -56.6 3.45 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.174 1.79 . . . . 4.1399999999999997 111.285 171.575 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.15 -8.24 29.58 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 115.472 1.656 . . . . 3.6099999999999999 115.472 -173.002 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.971 0 C-N-CA 126.608 1.963 . . . . 6.5700000000000003 115.691 -179.43 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.2 mmt . . . . . 0 N--CA 1.475 0.818 0 N-CA-C 109.732 -0.47 . . . . 7.0099999999999998 109.732 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -154.59 155.11 34.16 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 129.077 2.951 . . . . 6.0700000000000003 103.958 -166.233 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.41 162.71 13.57 Favored Pre-proline 0 N--CA 1.475 0.823 0 O-C-N 121.68 -0.638 . . . . 2.4500000000000002 110.345 169.376 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.75 -21.22 21.88 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 121.447 1.431 . . . . 1.48 111.569 173.731 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -77.08 -43.27 34.95 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.903 1.681 . . . . 4.0800000000000001 112.386 176.442 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -51.05 -49.36 60.72 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.887 0.875 . . . . 3.7400000000000002 109.249 168.015 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -64.44 -38.1 89.84 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 120.889 -1.132 . . . . 4.7400000000000002 113.781 174.952 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.04 -52.19 64.93 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.605 1.093 . . . . 1.8400000000000001 112.306 178.986 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.0 mt -66.64 -31.98 73.01 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.156 0.582 . . . . 3.0699999999999998 111.895 176.873 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.2 m -58.71 -52.05 67.36 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 117.899 -1.048 . . . . 2.6600000000000001 111.378 166.969 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 49.9 m -55.84 -41.27 74.05 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.918 1.235 . . . . 2.3199999999999998 111.632 179.868 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 75.4 mmm -58.09 -54.43 47.08 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 122.951 0.501 . . . . 4.75 111.495 174.521 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.4 t -63.96 -31.97 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 CA-C-N 119.019 0.827 . . . . 3.1899999999999999 112.083 179.03 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.7 m -64.0 -57.67 9.0 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.358 1.463 . . . . 1.8200000000000001 111.244 -179.395 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 t -67.07 -36.1 81.26 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 118.854 -0.593 . . . . 4.0199999999999996 109.601 178.363 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -56.39 -48.07 77.64 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-O 117.746 -1.121 . . . . 2.8700000000000001 110.935 175.632 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.1 m80 -60.99 -43.65 98.56 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 120.816 1.643 . . . . 2.6499999999999999 112.584 173.283 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -62.69 -23.1 66.96 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.145 1.378 . . . . 4.9400000000000004 114.311 -176.069 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.4 ' HH ' ' HG2' ' A' ' 40' ' ' LYS . 94.2 m-85 -95.38 -47.73 6.17 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.537 1.062 . . . . 3.9700000000000002 111.191 161.891 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.7 t -54.38 -39.25 67.03 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.461 1.904 . . . . 2.4500000000000002 115.286 -168.689 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.86 7.37 42.95 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 125.43 1.491 . . . . 2.48 115.472 179.747 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 -118.57 96.66 5.38 Favored 'General case' 0 C--O 1.221 -0.424 0 N-CA-C 106.854 -1.535 . . . . 5.1500000000000004 106.854 174.994 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.401 ' CD ' ' HZ1' ' A' ' 32' ' ' LYS . 28.2 mt-10 88.26 148.67 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 127.897 2.479 . . . . 3.6499999999999999 111.623 -168.896 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.9 -145.44 49.76 Favored Glycine 0 CA--C 1.526 0.741 0 C-N-CA 124.182 0.896 . . . . 3.1800000000000002 112.168 177.155 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.4 m -88.35 164.53 15.5 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 122.085 -0.656 . . . . 3.6000000000000001 112.466 170.199 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -16.13 63.24 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 114.499 1.296 . . . . 8.8599999999999994 114.499 179.42 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -117.13 10.95 14.02 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.496 1.919 . . . . 4.2599999999999998 112.497 179.209 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.463 ' HG1' ' CD ' ' A' ' 66' ' ' GLU . 43.2 p -122.53 134.43 54.55 Favored 'General case' 0 C--O 1.249 1.043 0 N-CA-C 114.421 1.267 . . . . 1.97 114.421 171.97 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 69.8 mt -95.62 104.27 16.18 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.413 1.085 . . . . 2.7799999999999998 109.821 167.488 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.0 t -58.71 150.49 23.38 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.421 -0.799 . . . . 2.4500000000000002 109.965 161.284 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 34.3 ttp85 -45.47 -30.31 1.37 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 115.831 1.789 . . . . 3.8500000000000001 115.831 -172.56 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.401 ' HZ1' ' CD ' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -79.31 -36.9 38.87 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.029 1.122 . . . . 4.7400000000000002 114.029 176.012 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -59.34 -50.63 73.22 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.827 0.851 . . . . 1.54 109.351 169.685 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.3 tp -57.84 -46.61 84.51 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.405 1.082 . . . . 3.0800000000000001 111.902 178.032 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.533 ' HZ1' ' CG ' ' A' ' 53' ' ' ASP . 12.8 tppt? -49.34 -50.88 37.76 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.395 1.078 . . . . 4.8600000000000003 112.92 -178.373 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -89.6 -11.96 41.12 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 115.25 1.574 . . . . 4.54 115.25 -178.678 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.4 tt -63.81 -60.93 2.67 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 120.063 1.301 . . . . 3.0699999999999998 109.432 160.285 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.3 mt -58.03 -43.18 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 N-CA-C 110.215 -0.291 . . . . 2.27 110.215 -175.353 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.8 mtpt -64.25 -12.15 38.37 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 114.15 1.166 . . . . 5.5700000000000003 114.15 -179.492 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.4 ' HG2' ' HH ' ' A' ' 19' ' ' TYR . 0.3 OUTLIER -109.15 -24.02 11.35 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.186 1.794 . . . . 5.1600000000000001 112.335 -178.392 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 72.4 mt-10 -65.93 -48.07 72.63 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.793 1.178 . . . . 3.9900000000000002 111.372 163.056 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 77.3 mt -124.68 149.74 46.86 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.629 1.572 . . . . 3.25 111.419 -163.516 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 1.7 t -156.01 11.86 0.3 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.149 1.38 . . . . 3.9199999999999999 112.713 179.184 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.97 28.79 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 126.382 1.873 . . . . 4.4500000000000002 116.005 178.034 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.5 -49.86 3.69 Favored Glycine 0 N--CA 1.474 1.201 0 C-N-CA 125.924 1.726 . . . . 3.5600000000000001 115.033 170.17 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.59 -35.3 80.56 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.841 1.257 . . . . 7.6600000000000001 112.7 -177.62 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 45.2 tpp -83.86 68.82 10.1 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 123.053 1.406 . . . . 2.8500000000000001 112.597 -179.025 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -66.14 163.27 17.98 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.227 1.411 . . . . 6.5700000000000003 112.726 174.59 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.59 -46.64 14.43 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.832 0.853 . . . . 4.7599999999999998 111.452 160.768 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.1 t -70.45 -37.71 74.38 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 114.852 1.427 . . . . 2.75 114.852 175.077 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.0 m -62.91 -32.53 73.83 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 121.148 1.794 . . . . 2.7200000000000002 111.636 176.871 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.3 mt -63.85 -30.53 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 124.795 1.238 . . . . 2.4700000000000002 113.765 179.917 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.533 ' CG ' ' HZ1' ' A' ' 35' ' ' LYS . 67.5 m-20 -81.08 -24.45 37.77 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.813 1.188 . . . . 3.3900000000000001 112.64 -179.739 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -73.84 -42.15 61.25 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.406 -0.809 . . . . 3.0699999999999998 111.0 168.165 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 43.3 tp -57.75 -45.37 85.97 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.886 1.274 . . . . 3.0600000000000001 110.758 168.581 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -56.75 -47.2 80.59 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 125.543 1.537 . . . . 2.5299999999999998 110.886 175.315 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -26.34 64.75 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 121.205 -0.934 . . . . 4.5999999999999996 113.405 174.113 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 t -88.68 -32.8 17.81 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 120.714 -1.242 . . . . 2.6299999999999999 113.468 176.917 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.1 mt -58.42 -50.59 73.16 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.815 1.246 . . . . 3.8300000000000001 110.938 165.06 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -102.57 76.47 1.53 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.375 1.87 . . . . 1.8899999999999999 112.791 -161.78 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -60.42 -21.33 62.12 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 113.67 0.989 . . . . 3.75 113.67 -167.689 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 51.6 p30 -100.5 -8.29 23.28 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.662 1.585 . . . . 2.6000000000000001 114.351 177.657 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 73.4 m 54.89 33.64 20.38 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.201 1.4 . . . . 3.27 114.069 -174.687 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.4 p30 -71.02 -15.54 62.56 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.547 1.539 . . . . 2.1400000000000001 111.872 176.35 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 66.04 4.53 3.1 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 131.558 3.943 . . . . 4.6699999999999999 116.131 -174.9 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.463 ' CD ' ' HG1' ' A' ' 28' ' ' THR . 2.4 mm-40 -103.99 126.86 51.43 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 127.193 2.197 . . . . 2.52 109.056 167.527 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 1.6 mm -104.3 100.74 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 O-C-N 120.953 -1.092 . . . . 2.0899999999999999 111.024 -175.041 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -75.28 156.86 35.2 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 127.421 2.289 . . . . 2.54 111.275 170.561 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -45.41 -41.36 9.14 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.125 1.528 . . . . 5.21 115.125 -179.994 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.6 pttm -80.14 -10.22 59.75 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 113.912 1.078 . . . . 3.9500000000000002 113.912 -178.595 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -80.93 -53.67 6.24 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 108.043 -1.095 . . . . 1.79 108.043 158.278 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -54.48 -36.38 64.07 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.343 2.257 . . . . 4.29 116.178 -170.891 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.6 p -67.69 -23.12 65.26 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 120.725 -1.234 . . . . 2.6499999999999999 112.79 -170.77 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 p -60.74 -28.13 42.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 CA-C-N 118.56 0.618 . . . . 3.4500000000000002 112.586 176.517 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -74.72 -58.9 3.0 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.921 0.889 . . . . 3.8599999999999999 110.469 -175.752 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.429 ' H ' HD22 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -61.83 -24.53 66.94 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 118.045 -0.978 . . . . 3.2400000000000002 113.126 172.452 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 53.7 m -58.59 -53.72 55.21 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.874 0.87 . . . . 2.04 110.946 165.411 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 61.8 mtm -60.95 -40.18 92.31 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.822 0.737 . . . . 2.1600000000000001 112.356 178.451 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 60.7 mt -60.09 -51.42 69.69 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.784 0.72 . . . . 2.5 110.729 174.698 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 82.0 m -63.84 -35.07 79.41 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.098 0.777 . . . . 3.1400000000000001 113.098 178.024 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 75.3 mtp -62.81 -44.35 96.38 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.892 1.224 . . . . 3.23 111.325 171.57 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.44 -47.82 82.39 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.932 -0.556 . . . . 1.79 111.452 177.249 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -62.85 -32.16 73.33 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.941 0.792 . . . . 4.6200000000000001 113.085 177.005 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -67.74 -39.98 84.17 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 119.88 1.218 . . . . 2.3500000000000001 111.358 177.133 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -72.69 -39.47 67.0 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.001 0.819 . . . . 2.98 110.965 178.465 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -53.62 -42.34 67.63 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.008 1.723 . . . . 3.52 111.464 170.653 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -58.92 -29.31 66.99 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.23 1.012 . . . . 3.6499999999999999 112.886 -179.448 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.9 mp -74.7 -23.55 58.62 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.57 0.748 . . . . 3.6099999999999999 112.916 174.494 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -91.82 -14.58 29.53 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.809 1.644 . . . . 2.6499999999999999 114.359 175.858 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -98.98 -30.08 12.55 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 128.045 2.538 . . . . 3.71 113.067 -170.475 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -98.54 20.5 12.7 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.316 1.446 . . . . 3.3199999999999998 112.125 179.412 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 81.6 tttt . . . . . 0 C--O 1.25 1.11 0 C-N-CA 129.563 3.145 . . . . 4.21 115.873 -161.845 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.497 ' H1 ' ' CD ' ' B' ' 2' ' ' GLU . 7.7 ttp . . . . . 0 N--CA 1.483 1.196 0 CA-C-O 119.893 -0.098 . . . . 8.4000000000000004 111.235 . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.497 ' CD ' ' H1 ' ' B' ' 1' ' ' MET . 2.4 mp0 46.38 -90.81 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 128.062 2.545 . . . . 6.79 117.6 154.631 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 17.2 p -102.06 155.87 35.92 Favored Pre-proline 0 N--CA 1.469 0.476 0 C-N-CA 124.253 1.021 . . . . 2.4399999999999999 113.037 -153.002 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -62.75 -18.93 66.87 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.701 2.267 . . . . 2.7400000000000002 112.257 166.713 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 9.7 tt -68.39 -51.99 37.94 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-O 118.482 -0.771 . . . . 3.9500000000000002 110.387 166.477 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.05 -30.62 71.74 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.755 1.161 . . . . 3.79 111.974 176.973 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -33.54 68.18 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 119.523 -1.986 . . . . 6.0 111.963 172.494 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.03 -40.03 94.23 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 119.691 1.132 . . . . 3.1699999999999999 112.648 169.76 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 68.2 mt -64.77 -35.55 81.45 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.287 0.949 . . . . 3.3100000000000001 111.872 171.018 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 36.5 m -60.96 -52.01 66.83 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 118.061 -0.971 . . . . 1.98 110.182 170.416 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 93.1 m -50.93 -38.75 52.23 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.069 1.348 . . . . 2.73 111.802 175.776 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 5.1 ttp -53.45 -51.52 62.41 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.585 0.754 . . . . 4.0999999999999996 112.022 174.229 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 34.5 m -74.66 -27.84 21.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 N-CA-C 113.251 0.834 . . . . 3.23 113.251 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 17.9 m -59.22 -54.84 42.37 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.656 1.182 . . . . 2.27 110.745 176.446 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.93 -32.12 51.41 Favored 'General case' 0 C--O 1.224 -0.252 0 O-C-N 123.62 0.575 . . . . 4.2000000000000002 110.463 -175.989 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -54.49 -44.52 72.72 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.312 0.505 . . . . 3.1600000000000001 110.718 172.418 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.21 -27.32 63.79 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.821 1.415 . . . . 2.4300000000000002 114.821 179.04 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -63.71 -45.6 89.26 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 120.833 -1.167 . . . . 5.7999999999999998 111.537 172.541 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -87.7 -10.27 51.7 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.428 1.091 . . . . 3.1800000000000002 113.098 -178.383 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 68.2 m -58.05 -56.52 20.96 Favored 'General case' 0 C--O 1.241 0.624 0 O-C-N 120.883 -1.136 . . . . 2.7599999999999998 112.009 164.018 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.12 -20.31 53.24 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-O 117.407 -1.774 . . . . 2.52 114.77 -168.439 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -47.85 -46.51 31.2 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.402 1.481 . . . . 4.5999999999999996 113.118 -169.572 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 57.0 mp0 -130.74 153.53 48.92 Favored 'General case' 0 C--O 1.248 0.981 0 CA-C-O 124.014 1.864 . . . . 3.5899999999999999 111.912 167.744 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.92 -8.15 2.65 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.32 1.438 . . . . 2.4100000000000001 113.903 -172.309 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 15.1 m 57.1 -142.83 0.73 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.485 1.114 . . . . 7.4100000000000001 109.781 -159.782 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 24.1 mttt 68.25 -172.48 0.19 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.274 1.83 . . . . 12.25 112.541 172.522 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 mp -82.91 -0.8 50.1 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.829 1.251 . . . . 4.79 112.843 173.683 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 21.8 p -113.57 152.47 30.25 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 115.765 1.765 . . . . 2.0699999999999998 115.765 -155.578 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -101.43 108.39 19.97 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 127.205 2.202 . . . . 3.23 113.022 -172.215 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 12.9 t -84.1 162.46 20.29 Favored 'General case' 0 C--N 1.315 -0.896 0 O-C-N 120.247 -1.533 . . . . 2.8700000000000001 112.16 176.835 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 24.0 ttt85 -45.14 -41.11 7.69 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.603 1.561 . . . . 4.7300000000000004 114.426 -178.17 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.411 ' HZ3' ' CD ' ' B' ' 36' ' ' GLU . 0.0 OUTLIER -78.82 -36.36 42.71 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.898 -1.126 . . . . 7.3300000000000001 113.277 174.279 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -60.5 -46.11 91.32 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 120.041 1.291 . . . . 1.8 110.393 176.349 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 8.2 tp -65.69 -36.78 84.61 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.008 1.723 . . . . 2.9100000000000001 113.076 178.7 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -64.91 -28.03 69.26 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.362 1.065 . . . . 6.0 112.363 174.506 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.411 ' CD ' ' HZ3' ' B' ' 32' ' ' LYS . 0.2 OUTLIER -68.03 -77.19 0.08 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.061 -0.971 . . . . 3.2400000000000002 108.541 158.822 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 23.3 tp -48.69 -43.2 36.79 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.276 1.83 . . . . 3.1200000000000001 114.502 -163.684 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 58.6 mt -57.15 -64.51 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 120.191 1.36 . . . . 2.23 107.49 174.474 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 25.4 mtpt -62.09 -26.37 68.25 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.398 0.888 . . . . 5.4299999999999997 113.398 -174.803 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.73 -36.48 50.8 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.113 1.765 . . . . 6.6900000000000004 113.308 -179.534 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -122.17 -29.48 4.19 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.145 1.165 . . . . 6.04 114.145 -170.189 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -118.36 79.44 1.38 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.168 1.787 . . . . 4.9800000000000004 107.098 169.446 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 93.4 m -68.53 -47.81 65.96 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.36 -0.836 . . . . 4.4299999999999997 112.448 -155.722 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 6.7 mp 61.84 -34.86 0.11 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 129.755 3.222 . . . . 6.2199999999999998 118.604 170.519 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.68 -51.22 4.39 Favored Glycine 0 N--CA 1.473 1.164 0 C-N-CA 126.598 2.047 . . . . 3.54 112.788 174.411 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -68.72 -4.36 15.58 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.497 1.119 . . . . 5.2599999999999998 112.217 168.322 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.55 63.84 0.42 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 124.542 2.115 . . . . 2.7400000000000002 111.063 163.698 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -76.46 147.89 37.59 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 127.269 2.228 . . . . 4.3300000000000001 109.147 174.457 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.16 -37.1 66.56 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.674 1.361 . . . . 4.8300000000000001 114.674 -157.348 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 8.5 t -74.74 -24.17 58.68 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.884 1.439 . . . . 3.1000000000000001 114.884 174.389 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 4.8 m -63.55 -18.23 63.63 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 120.06 1.3 . . . . 3.0600000000000001 111.957 173.895 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 42.7 mm -67.62 -25.7 33.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 C-N-CA 124.805 1.242 . . . . 2.8100000000000001 111.834 174.299 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -70.75 -34.45 71.85 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.958 0.799 . . . . 5.0599999999999996 111.944 173.391 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.61 -32.95 47.73 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.203 1.001 . . . . 3.54 111.732 174.821 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.87 -44.38 93.25 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 118.414 -0.803 . . . . 3.46 111.211 167.453 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 14.0 mtp -57.64 -49.35 76.76 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.86 1.209 . . . . 2.6699999999999999 110.71 171.453 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -60.87 -29.32 69.47 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.303 1.441 . . . . 4.3099999999999996 113.142 -178.607 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 33.2 t -76.09 -22.03 56.05 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 115.086 1.513 . . . . 4.1100000000000003 115.086 172.021 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mp -109.21 -45.91 3.66 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.736 1.614 . . . . 4.2800000000000002 114.775 -172.401 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -85.11 88.49 7.47 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.485 1.514 . . . . 1.6000000000000001 111.26 -163.587 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -62.82 -29.36 70.66 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.614 1.565 . . . . 5.8600000000000003 114.634 -173.431 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -85.04 -16.31 41.15 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 117.83 -1.081 . . . . 2.3100000000000001 112.711 169.059 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 20.6 m 49.64 66.1 1.22 Allowed 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 126.261 1.825 . . . . 4.7699999999999996 112.28 176.224 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -136.69 -102.12 0.2 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.377 0.671 . . . . 3.29 110.804 -148.851 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -145.19 -10.17 0.57 Allowed 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 115.592 1.701 . . . . 6.1500000000000004 115.592 167.17 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -137.87 146.12 43.0 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 125.357 1.463 . . . . 2.4199999999999999 112.961 175.541 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 2.6 mt -100.02 109.3 24.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 C-N-CA 127.89 2.476 . . . . 2.7400000000000002 107.284 173.321 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . 0.463 ' CG ' ' HZ1' ' B' ' 70' ' ' LYS . 0.0 OUTLIER -76.07 160.2 30.02 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.752 1.621 . . . . 2.4900000000000002 111.181 168.334 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -56.46 -31.26 63.81 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 121.078 -1.014 . . . . 3.7999999999999998 112.999 -174.463 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.463 ' HZ1' ' CG ' ' B' ' 68' ' ' ASP . 0.0 OUTLIER -89.6 -11.06 43.74 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.304 1.841 . . . . 4.5199999999999996 112.81 -179.465 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -75.02 -57.18 4.06 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 108.468 -0.938 . . . . 1.6899999999999999 108.468 153.494 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -54.84 -24.88 25.15 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.653 2.381 . . . . 2.8900000000000001 115.663 -174.607 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 1.8 m -49.54 -31.08 9.61 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 120.754 -1.216 . . . . 2.8700000000000001 112.689 170.121 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 95.4 t -74.21 -25.46 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.159 0.583 . . . . 2.71 111.959 -179.777 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -61.31 -56.98 14.29 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-N 119.199 0.908 . . . . 4.3200000000000003 111.037 171.039 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -56.75 -45.57 81.95 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.51 0.724 . . . . 4.5199999999999996 110.772 179.242 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 76.4 m -53.19 -54.5 35.02 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.118 1.367 . . . . 2.1899999999999999 112.154 176.707 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 12.7 tmm? -65.73 -43.99 87.39 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.948 1.299 . . . . 3.6600000000000001 112.412 -176.293 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -55.27 -50.4 69.62 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.631 0.772 . . . . 3.46 110.978 170.149 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 9.6 t -61.71 -36.11 79.98 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.117 0.784 . . . . 4.0199999999999996 113.117 -179.254 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 94.0 mtp -67.79 -35.95 79.59 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.244 1.017 . . . . 3.6899999999999999 113.004 173.926 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.91 -30.27 50.53 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 119.453 1.024 . . . . 2.25 112.969 175.623 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -74.75 -18.39 60.5 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.668 -1.27 . . . . 4.1600000000000001 111.719 -177.537 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -55.9 -32.97 64.21 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.527 1.531 . . . . 3.25 114.055 161.262 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -105.9 -28.94 10.3 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 127.408 2.283 . . . . 3.04 112.126 -167.752 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.67 -41.14 61.16 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.382 1.073 . . . . 4.2000000000000002 110.369 159.336 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -65.94 -24.23 66.77 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.288 1.835 . . . . 3.71 113.218 173.099 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 75.1 mt -90.05 -3.68 57.81 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.453 1.501 . . . . 3.2599999999999998 113.935 178.306 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.482 ' CD ' ' HZ2' ' B' ' 92' ' ' LYS . 72.4 mm-40 -90.45 -4.72 56.8 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.085 0.954 . . . . 3.8900000000000001 112.685 162.014 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -119.02 -66.96 1.02 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.335 1.454 . . . . 3.0499999999999998 111.268 -174.798 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -81.75 47.83 1.13 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.401 1.481 . . . . 3.3300000000000001 111.372 169.544 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . 0.482 ' HZ2' ' CD ' ' B' ' 89' ' ' GLU . 22.2 tttp . . . . . 0 C--O 1.251 1.148 0 C-N-CA 129.748 3.219 . . . . 5.3600000000000003 115.839 -173.316 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.9 ttp . . . . . 0 N--CA 1.485 1.302 0 N-CA-C 111.498 0.184 . . . . 6.71 111.498 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 57.63 -71.17 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 118.412 2.745 . . . . 7.0099999999999998 118.412 148.998 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 76.4 p -147.91 161.0 36.45 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 118.603 0.638 . . . . 3.0699999999999998 112.146 -154.88 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -62.36 -23.86 75.4 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 121.933 1.755 . . . . 1.73 111.836 165.384 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -69.87 -48.38 58.97 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.994 1.318 . . . . 3.3799999999999999 111.083 177.411 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -63.77 -44.01 94.69 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 122.522 1.153 . . . . 3.3900000000000001 110.611 177.363 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -66.04 -19.98 66.03 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.686 -1.259 . . . . 5.0599999999999996 112.282 175.105 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -81.94 -45.12 15.84 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.167 1.387 . . . . 2.29 112.379 171.54 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.4 pp -63.37 -30.14 71.32 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 121.999 2.182 . . . . 4.4699999999999998 112.157 171.588 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 30.0 m -53.09 -56.75 13.8 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.223 1.009 . . . . 2.2799999999999998 109.371 164.622 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.76 -34.72 73.35 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.926 1.291 . . . . 2.71 114.008 179.503 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -56.88 -44.46 82.28 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.335 1.054 . . . . 4.29 112.444 170.193 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.2 t -71.66 -32.03 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 CA-C-O 118.597 -0.716 . . . . 3.02 112.178 173.235 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 54.3 m -57.34 -56.61 19.62 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 119.758 1.163 . . . . 2.0 111.641 175.476 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -57.93 -43.12 86.12 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 123.344 0.657 . . . . 2.7599999999999998 110.068 173.537 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -64.5 -45.2 88.3 Favored 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 120.677 -0.409 . . . . 2.98 111.99 -173.265 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.32 -45.59 92.56 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 120.379 -1.451 . . . . 2.3399999999999999 112.061 176.336 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.17 -41.36 67.15 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.948 0.721 . . . . 6.9100000000000001 112.948 -176.513 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -72.74 -43.4 62.98 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.083 0.856 . . . . 3.4900000000000002 112.99 173.096 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.2 m -72.45 -26.2 61.74 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 120.307 1.412 . . . . 3.1600000000000001 111.964 -179.407 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.02 -35.44 89.33 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 124.689 1.138 . . . . 2.04 113.164 173.891 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.3 ttt85 -45.55 -50.1 13.31 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 128.073 2.549 . . . . 5.9199999999999999 115.609 -168.775 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -138.6 161.95 35.83 Favored 'General case' 0 C--O 1.25 1.127 0 C-N-CA 126.167 1.787 . . . . 4.7199999999999998 111.465 -177.255 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.52 -87.81 0.27 Allowed Glycine 0 C--N 1.346 1.123 0 C-N-CA 127.234 2.349 . . . . 2.3500000000000001 109.62 179.678 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -146.36 -179.54 6.82 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 121.559 -0.965 . . . . 5.6600000000000001 110.04 142.75 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.51 ' H ' ' HD3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -37.73 156.35 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.489 1.916 . . . . 7.4800000000000004 113.011 147.106 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.0 mt 78.85 -50.7 0.45 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 128.185 2.594 . . . . 3.9199999999999999 110.712 -169.857 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.6 p -86.18 136.6 33.13 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 113.243 0.831 . . . . 3.1400000000000001 113.243 -176.326 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 28.3 mt -90.7 107.4 19.15 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.56 -0.904 . . . . 2.46 108.56 149.394 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.0 t -71.01 161.22 31.52 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 120.646 -1.284 . . . . 2.2599999999999998 111.177 163.425 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.423 HH21 ' CG ' ' A' ' 53' ' ' ASP . 22.4 ttt180 -42.2 -35.34 0.93 Allowed 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.757 1.623 . . . . 4.1900000000000004 114.209 179.819 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 mmmm -71.38 -55.74 7.35 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 116.071 1.878 . . . . 5.7400000000000002 116.071 173.507 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -49.9 -35.65 24.46 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.2 1.4 . . . . 2.0600000000000001 110.002 171.606 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.7 tp -81.57 -49.07 10.98 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.968 0.907 . . . . 3.0600000000000001 110.902 -174.814 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -55.34 -38.22 68.48 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.06 0.846 . . . . 7.3200000000000003 111.384 175.885 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -79.19 -8.61 59.14 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.83 1.419 . . . . 3.7599999999999998 114.83 -174.73 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 50.8 tp -92.27 -55.28 3.48 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.855 1.262 . . . . 4.0899999999999999 111.212 169.611 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 23.0 mt -57.86 -49.07 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 O-C-N 121.668 -0.645 . . . . 2.0899999999999999 110.08 -174.133 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.09 -3.94 15.23 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 113.475 0.917 . . . . 5.04 113.475 -178.008 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.6 mmtp -95.37 -45.82 6.97 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.948 1.299 . . . . 3.8799999999999999 110.88 167.942 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -64.82 -53.0 53.69 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.227 1.411 . . . . 5.2800000000000002 111.81 -177.131 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -82.47 41.5 0.71 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.029 1.332 . . . . 3.6000000000000001 112.245 -175.621 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 53.4 t -58.04 -33.52 69.09 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.17 1.388 . . . . 3.7799999999999998 112.646 177.916 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -71.42 -6.34 39.57 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.896 1.443 . . . . 5.0499999999999998 114.896 174.332 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -133.67 -8.96 2.09 Favored Glycine 0 N--CA 1.472 1.045 0 CA-C-O 118.195 -1.336 . . . . 4.75 115.881 -178.173 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 52.32 41.38 30.47 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.157 1.783 . . . . 7.9100000000000001 113.509 -179.436 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.4 tpt -39.33 104.97 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.609 1.564 . . . . 2.4500000000000002 112.102 -173.509 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -73.53 158.79 34.22 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.393 0.516 . . . . 6.9100000000000001 112.393 -160.641 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.54 -47.02 73.68 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 119.761 1.164 . . . . 5.6299999999999999 111.822 175.447 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.8 t -65.34 -3.67 4.45 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 115.183 1.549 . . . . 3.0899999999999999 115.183 173.782 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -114.1 -18.46 11.67 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.833 1.253 . . . . 3.46 113.086 170.317 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 24.8 mt -76.71 -31.15 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 125.908 1.683 . . . . 2.1099999999999999 110.527 172.029 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.423 ' CG ' HH21 ' A' ' 31' ' ' ARG . 43.8 m-20 -70.2 -41.22 73.96 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 118.127 -0.94 . . . . 2.8500000000000001 113.197 177.166 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -65.92 -44.59 84.7 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 120.385 1.448 . . . . 2.8700000000000001 110.348 168.316 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 49.1 tp -54.67 -48.45 72.35 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.109 -0.948 . . . . 3.1099999999999999 110.403 179.847 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.6 ttt -55.9 -50.39 70.82 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.192 1.36 . . . . 2.3300000000000001 112.144 172.249 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.56 -18.56 30.72 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.549 1.54 . . . . 5.7400000000000002 113.322 175.345 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.5 m -101.17 -22.85 14.57 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 127.077 2.151 . . . . 2.8500000000000001 113.763 179.067 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.7 mp -72.9 -46.17 54.16 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.573 -1.33 . . . . 3.8300000000000001 110.79 162.328 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -78.48 63.13 3.25 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.826 2.05 . . . . 1.9399999999999999 112.577 -166.295 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -51.06 -39.62 56.41 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 125.804 1.642 . . . . 4.2400000000000002 113.962 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -82.02 -8.02 59.64 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.777 1.399 . . . . 3.27 114.777 176.004 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.4 t 63.36 39.55 9.27 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.871 1.268 . . . . 2.9700000000000002 114.202 166.855 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 42.3 p-10 -109.45 1.96 20.23 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 127.946 2.499 . . . . 2.6000000000000001 112.976 -175.074 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 78.66 -7.35 1.8 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 128.157 2.583 . . . . 4.1200000000000001 115.639 -178.385 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -116.0 141.94 47.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.049 1.34 . . . . 3.8500000000000001 109.895 -179.659 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 22.4 mm -100.22 103.82 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 O-C-N 120.514 -1.366 . . . . 2.29 111.569 175.994 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.48 162.22 29.52 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 125.139 1.376 . . . . 2.3999999999999999 112.132 164.057 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.32 -40.72 74.86 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 120.544 -1.348 . . . . 3.2000000000000002 113.16 -174.818 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.63 -14.65 62.94 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 120.977 -1.077 . . . . 4.3399999999999999 112.744 174.855 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -84.88 -51.93 6.37 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.34 -0.85 . . . . 2.0699999999999998 110.789 168.682 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -52.97 -45.0 67.58 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 127.195 2.198 . . . . 3.5600000000000001 114.513 -171.571 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.0 t -54.09 -27.28 31.85 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.225 1.194 . . . . 2.4700000000000002 114.225 -171.214 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.3 m -68.24 -22.97 27.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 O-C-N 120.759 -1.213 . . . . 3.4199999999999999 113.48 -179.556 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -60.54 -62.83 1.58 Allowed 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 123.704 0.802 . . . . 3.0299999999999998 110.542 171.712 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.8 mp -60.91 -30.93 70.47 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.347 1.059 . . . . 3.6699999999999999 111.404 179.71 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.5 m -59.73 -58.93 6.42 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.958 0.903 . . . . 1.75 111.318 172.167 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 13.6 ptp -65.32 -34.0 77.31 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 118.405 0.548 . . . . 2.9100000000000001 112.228 -178.493 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -54.18 46.42 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.489 1.116 . . . . 4.1500000000000004 110.794 173.557 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 7.6 t -64.3 -33.76 76.57 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.024 0.53 . . . . 2.2999999999999998 112.08 179.741 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.8 mtp -61.46 -44.18 97.55 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 118.957 0.798 . . . . 3.4700000000000002 112.954 168.616 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.45 -40.84 89.65 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.176 0.898 . . . . 2.4500000000000002 111.293 178.66 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -64.27 -22.39 66.93 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 118.77 -0.633 . . . . 3.9100000000000001 112.705 175.098 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -67.44 -40.9 85.47 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 120.146 1.339 . . . . 2.7599999999999998 111.682 174.013 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -71.91 -40.54 68.76 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.976 0.911 . . . . 2.6899999999999999 110.463 178.806 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -52.89 -48.3 67.26 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.142 1.377 . . . . 4.4400000000000004 111.871 170.068 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -58.37 -24.38 59.71 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.992 1.717 . . . . 3.9500000000000002 113.618 179.355 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.2 mp -72.27 -17.79 61.86 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.41 1.005 . . . . 3.5800000000000001 113.37 171.998 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -112.58 6.26 18.31 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 126.889 2.076 . . . . 3.77 114.892 173.985 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -88.61 -46.44 9.06 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 120.262 -1.524 . . . . 4.4400000000000004 112.169 162.362 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.96 16.06 0.59 Allowed 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 117.123 2.268 . . . . 5.1399999999999997 117.123 -173.071 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.258 1.534 0 N-CA-C 118.953 2.945 . . . . 5.8600000000000003 118.953 -129.041 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.43 ' SD ' ' HE3' ' B' ' 7' ' ' LYS . 30.2 mmt . . . . . 0 N--CA 1.474 0.77 0 N-CA-C 107.421 -1.326 . . . . 5.7999999999999998 107.421 . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 17.9 mp0 -109.01 -94.4 0.41 Allowed 'General case' 0 CA--C 1.54 0.559 0 O-C-N 125.493 1.746 . . . . 4.8399999999999999 108.633 -150.813 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 71.8 p -135.99 159.38 71.3 Favored Pre-proline 0 N--CA 1.472 0.659 0 C-N-CA 124.626 1.171 . . . . 2.6099999999999999 110.938 173.224 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.01 -13.07 35.85 Favored 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 122.43 2.086 . . . . 1.6000000000000001 112.757 167.053 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -82.01 -44.14 17.05 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.638 1.175 . . . . 3.6400000000000001 112.986 -179.58 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -57.56 -40.88 79.92 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 122.343 1.068 . . . . 4.3200000000000003 110.045 168.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . 0.43 ' HE3' ' SD ' ' B' ' 1' ' ' MET . 49.9 mttm -76.79 -27.84 55.4 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 121.125 -0.985 . . . . 5.3099999999999996 112.259 179.599 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.81 -43.08 80.5 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.876 0.762 . . . . 1.78 111.532 169.257 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 42.9 mt -58.22 -39.02 77.96 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.576 1.15 . . . . 2.5499999999999998 111.12 169.557 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 71.1 m -65.19 -42.59 93.45 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.006 0.922 . . . . 2.1299999999999999 112.131 171.977 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 63.2 m -58.48 -46.45 86.64 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 120.328 1.422 . . . . 2.1000000000000001 111.047 171.152 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 82.3 mtp -57.24 -49.37 76.25 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.531 1.532 . . . . 3.6400000000000001 111.756 173.754 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.73 -27.36 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.188 0.904 . . . . 2.9700000000000002 112.647 177.279 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 94.1 m -67.96 -54.75 16.21 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.127 1.371 . . . . 1.73 110.458 174.012 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.2 p -59.28 -35.95 74.66 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.346 0.975 . . . . 2.4700000000000002 110.702 173.538 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -67.79 -45.72 74.01 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 118.729 -0.653 . . . . 3.5600000000000001 110.96 179.801 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -69.75 -46.78 65.1 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 120.432 1.469 . . . . 2.3700000000000001 111.345 176.42 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -58.69 -44.78 90.37 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.22 1.408 . . . . 6.6600000000000001 113.71 179.306 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -81.14 -19.9 42.48 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 120.641 -1.287 . . . . 3.7599999999999998 112.094 171.235 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 26.9 m -67.79 -22.33 65.19 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 121.112 1.778 . . . . 2.25 112.94 170.207 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.15 7.58 81.78 Favored Glycine 0 CA--C 1.53 1.02 0 C-N-CA 126.467 1.984 . . . . 1.77 114.73 176.216 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 5.0 mmm-85 -76.46 -14.22 60.06 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.477 1.638 . . . . 5.46 113.868 178.897 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 171.28 -174.16 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 129.713 3.205 . . . . 3.2799999999999998 110.852 -176.572 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 62.72 -139.1 44.94 Favored Glycine 0 N--CA 1.472 1.096 0 O-C-N 120.731 -1.231 . . . . 2.4900000000000002 110.651 -179.624 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 8.1 t -82.28 158.89 23.3 Favored 'General case' 0 C--O 1.245 0.819 0 CA-C-N 118.054 0.927 . . . . 5.0300000000000002 110.418 157.012 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.6 51.23 1.44 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.89 1.676 . . . . 7.6299999999999999 111.421 172.476 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 63.3 tp -168.07 -35.05 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 126.878 2.071 . . . . 4.0199999999999996 110.678 -170.431 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 25.6 p -102.98 152.75 20.97 Favored 'General case' 0 C--O 1.248 1.001 0 C-N-CA 126.794 2.038 . . . . 2.6000000000000001 111.622 173.801 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -122.4 78.48 1.51 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.919 1.287 . . . . 3.4199999999999999 110.214 -163.807 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.96 150.51 10.09 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.536 1.935 . . . . 2.8399999999999999 112.967 177.738 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 23.5 ttp85 -40.34 -55.23 2.26 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.547 0.943 . . . . 3.8900000000000001 113.547 178.144 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.22 -27.35 61.93 Favored 'General case' 0 CA--C 1.554 1.116 0 N-CA-C 117.15 2.278 . . . . 4.8600000000000003 117.15 177.655 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -76.6 -52.95 8.72 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.181 1.792 . . . . 1.76 108.022 175.284 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.07 -31.59 69.26 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.095 0.558 . . . . 4.3200000000000003 112.314 -173.192 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . 0.448 ' HZ1' ' CD ' ' B' ' 36' ' ' GLU . 0.0 OUTLIER -68.58 -15.06 63.41 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.154 1.168 . . . . 6.6200000000000001 114.154 175.777 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.448 ' CD ' ' HZ1' ' B' ' 35' ' ' LYS . 0.6 OUTLIER -71.57 -61.95 1.59 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 118.22 -0.895 . . . . 4.0800000000000001 112.555 156.625 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 tt -45.18 -54.0 7.47 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.449 1.499 . . . . 3.0800000000000001 111.577 -174.115 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 11.8 mt -58.6 -68.14 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 119.075 0.852 . . . . 2.3500000000000001 110.448 -173.742 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -12.57 42.94 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 113.546 0.943 . . . . 5.0199999999999996 113.546 -176.513 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.12 -53.77 6.1 Favored 'General case' 0 N--CA 1.444 -0.763 0 O-C-N 120.479 -1.388 . . . . 7.7599999999999998 111.3 165.84 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -75.8 -32.33 59.81 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 120.461 1.482 . . . . 3.73 112.104 -172.998 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -126.1 110.99 14.15 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.985 2.114 . . . . 3.0499999999999998 110.106 168.578 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 29.4 p -99.26 2.43 45.58 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 121.375 -0.828 . . . . 4.8300000000000001 112.706 164.821 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 7.2 mp -77.01 155.3 32.67 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.081 0.953 . . . . 4.6200000000000001 112.263 -160.825 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.52 -73.8 1.13 Allowed Glycine 0 N--CA 1.469 0.875 0 C-N-CA 124.709 1.147 . . . . 6.7300000000000004 110.774 -175.073 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -154.71 7.37 0.29 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.164 1.386 . . . . 5.5700000000000003 113.458 165.289 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 5.7 tpt -50.07 117.65 2.46 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.287 1.435 . . . . 3.6099999999999999 114.075 -156.231 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 ttmp? -164.09 162.56 23.04 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.344 1.457 . . . . 4.7800000000000002 110.162 -161.45 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.77 3.51 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 116.653 2.094 . . . . 4.9800000000000004 116.653 170.5 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 2.6 p -73.75 -42.9 60.45 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 119.834 -1.791 . . . . 6.79 113.666 159.25 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 2.8 p -103.92 -16.28 15.4 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.299 1.839 . . . . 3.2599999999999998 113.572 -176.284 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 30.1 mt -71.81 -34.17 50.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 N-CA-C 114.621 1.341 . . . . 2.8399999999999999 114.621 -176.588 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.09 -29.99 65.97 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 120.464 1.484 . . . . 2.8599999999999999 112.301 -174.204 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -71.24 -45.16 63.87 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.421 1.489 . . . . 2.4700000000000002 112.142 169.829 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 53.4 tp -56.87 -51.09 70.4 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 124.251 1.02 . . . . 3.3199999999999998 109.977 173.093 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 8.6 tpt -52.66 -48.74 66.26 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 127.095 2.158 . . . . 2.2400000000000002 111.861 175.868 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.39 -27.28 62.19 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.741 0.816 . . . . 4.5099999999999998 113.186 172.206 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 58' ' ' SER . . . . . 0.413 ' O ' ' HE3' ' B' ' 61' ' ' LYS . 9.3 t -87.8 -30.3 20.34 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.242 1.417 . . . . 2.5600000000000001 113.396 176.74 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 30.5 mt -67.94 -49.15 63.48 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 121.223 -0.923 . . . . 3.0800000000000001 110.605 171.555 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -81.51 81.05 7.74 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 122.895 1.331 . . . . 1.54 112.562 -173.523 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . 0.413 ' HE3' ' O ' ' B' ' 58' ' ' SER . 1.6 mptm? -61.36 -17.04 52.09 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 114.257 1.206 . . . . 3.9100000000000001 114.257 178.607 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -78.3 -33.27 49.46 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.097 0.862 . . . . 2.9199999999999999 112.915 171.105 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 57.8 m 54.35 56.78 6.5 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.437 1.495 . . . . 3.3599999999999999 111.526 -159.662 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 9.3 p30 -101.21 -72.58 0.67 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.572 1.149 . . . . 2.3599999999999999 109.656 -172.042 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 167.62 -25.71 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.831 1 C-N-CA 133.386 4.674 . . . . 6.4299999999999997 113.854 -177.886 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -125.31 133.76 52.5 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 126.624 1.97 . . . . 2.5800000000000001 110.458 -171.091 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 34.1 mt -87.88 112.14 23.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 122.118 0.961 . . . . 2.4100000000000001 109.572 173.876 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.75 163.09 27.91 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.535 1.934 . . . . 2.5600000000000001 111.085 166.527 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -57.1 -37.76 72.4 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 120.866 -1.147 . . . . 3.6000000000000001 113.803 -176.871 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 5.0 mtmp? -77.9 -29.68 50.27 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 120.476 -1.39 . . . . 3.9500000000000002 112.343 177.257 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -60.86 -52.05 66.7 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-N 119.911 1.232 . . . . 1.8600000000000001 108.866 163.229 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -58.0 -29.36 65.22 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 119.61 -1.931 . . . . 3.27 114.186 -179.436 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 32.7 p -58.27 -26.14 62.61 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.397 -1.439 . . . . 3.48 113.802 171.851 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 47.3 t -64.74 -44.98 96.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.042 0.937 . . . . 2.9900000000000002 109.953 172.939 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -58.12 -54.88 41.94 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 119.103 -0.475 . . . . 2.6200000000000001 111.115 176.805 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 91.4 mt -52.99 -45.74 67.99 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.169 0.987 . . . . 3.1499999999999999 111.791 -179.748 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 25.3 m -64.11 -51.1 65.58 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.107 0.563 . . . . 2.0099999999999998 112.286 -179.206 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 67.9 mtm -62.69 -39.69 94.79 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 118.245 0.475 . . . . 2.3500000000000001 111.729 -179.367 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.38 -48.45 67.38 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.353 0.661 . . . . 3.8799999999999999 111.719 179.381 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 84.6 m -65.91 -28.47 68.96 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.079 0.77 . . . . 2.7400000000000002 113.079 179.657 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 48.0 mtm -72.69 -31.46 65.04 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.034 1.124 . . . . 4.0199999999999996 114.034 169.205 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.67 -43.15 56.71 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.861 1.209 . . . . 1.97 112.033 173.738 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.89 -15.64 23.02 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.531 1.308 . . . . 3.6099999999999999 114.531 172.877 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -66.12 -38.12 87.42 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.514 0.726 . . . . 3.7400000000000002 112.099 172.228 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -90.09 -25.48 20.74 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.736 1.214 . . . . 3.5099999999999998 112.657 -179.12 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.97 -18.9 61.98 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 124.925 1.29 . . . . 4.6500000000000004 112.43 167.9 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -88.57 -16.49 32.44 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.387 1.875 . . . . 4.2400000000000002 112.801 168.903 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 87.7 mt -94.99 -32.15 13.29 Favored 'General case' 0 C--O 1.222 -0.395 0 CA-C-O 116.999 -1.477 . . . . 3.6200000000000001 112.792 -179.951 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -55.48 -25.31 36.19 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 120.297 1.408 . . . . 8.0899999999999999 114.022 168.158 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -81.38 -53.74 6.06 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 128.245 2.618 . . . . 3.3100000000000001 112.492 168.498 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -77.73 -16.9 58.12 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 116.701 2.112 . . . . 3.23 116.701 -170.444 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? . . . . . 0 N--CA 1.469 0.498 0 N-CA-C 119.818 3.266 . . . . 6.6900000000000004 119.818 -159.767 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 108.012 -1.107 . . . . 7.75 108.012 . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.427 ' HB2' ' H ' ' A' ' 3' ' ' THR . 0.2 OUTLIER -144.35 -99.62 0.11 Allowed 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 106.15 -1.796 . . . . 3.9900000000000002 106.15 -165.631 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.427 ' H ' ' HB2' ' A' ' 2' ' ' GLU . 72.9 p -152.19 169.77 9.02 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 128.264 2.626 . . . . 2.5800000000000001 108.829 -168.921 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.89 -37.46 3.67 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 CA-C-N 120.73 1.296 . . . . 1.96 111.372 167.612 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 26.4 mt -62.87 -49.68 73.9 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-O 117.729 -1.129 . . . . 4.4400000000000004 112.792 -174.916 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -38.34 66.76 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.955 1.252 . . . . 4.4500000000000002 111.057 -178.839 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -73.86 -42.79 60.28 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 120.361 -1.462 . . . . 4.3099999999999996 113.431 171.475 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -75.13 -30.81 60.92 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 114.717 1.377 . . . . 3.29 114.717 -174.782 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.3 mt -67.49 -35.57 79.41 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.908 1.683 . . . . 2.9700000000000002 110.066 166.958 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 56.9 m -67.96 -36.2 79.66 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 118.139 -0.934 . . . . 3.04 111.038 170.893 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.9 m -56.61 -41.4 76.98 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 120.004 1.274 . . . . 2.9900000000000002 111.3 167.38 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.5 tpt -63.34 -44.6 94.41 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.586 0.754 . . . . 5.3300000000000001 112.465 172.835 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 37.5 t -61.83 -33.65 58.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 O-C-N 120.478 -1.388 . . . . 3.3100000000000001 112.229 173.958 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.9 m -71.24 -41.63 69.88 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.828 1.651 . . . . 2.3599999999999999 112.183 -177.804 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.0 p -69.0 -37.61 78.79 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 117.966 -1.016 . . . . 3.1099999999999999 109.193 167.904 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -59.69 -57.16 14.12 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.462 0.574 . . . . 3.0899999999999999 111.147 -173.538 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -59.57 -50.0 75.57 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-O 122.274 1.035 . . . . 3.0699999999999998 111.594 178.097 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -57.8 -34.14 69.31 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.923 -1.111 . . . . 4.1699999999999999 113.683 -178.695 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -97.0 -19.81 18.5 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.992 1.317 . . . . 3.2000000000000002 112.472 177.137 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.4 p -71.11 -29.51 65.37 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-N 121.624 2.011 . . . . 3.2599999999999998 111.952 171.081 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.24 -8.99 80.7 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 126.854 2.168 . . . . 1.8700000000000001 115.217 173.657 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.3 ttm-85 -66.18 -23.38 66.45 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 119.194 1.497 . . . . 5.1399999999999997 113.574 -177.948 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -166.72 158.78 13.32 Favored 'General case' 0 C--O 1.247 0.95 0 C-N-CA 124.404 1.082 . . . . 4.9800000000000004 112.468 -174.672 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.71 -134.25 52.42 Favored Glycine 0 C--N 1.339 0.743 0 C-N-CA 125.268 1.413 . . . . 2.7799999999999998 111.234 172.201 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.9 m -62.52 139.71 58.61 Favored 'General case' 0 C--O 1.246 0.918 0 O-C-N 121.824 -0.81 . . . . 4.04 110.697 165.364 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -89.51 -20.12 24.22 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 115.332 1.605 . . . . 6.9800000000000004 115.332 -171.065 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -81.27 -18.76 44.82 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.285 1.034 . . . . 6.1900000000000004 112.793 168.091 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.84 157.1 34.92 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 125.262 1.425 . . . . 1.78 114.25 -169.553 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 88.3 mt -99.44 112.91 25.02 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.283 1.833 . . . . 2.8300000000000001 110.606 -177.085 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.35 168.55 16.52 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.983 1.313 . . . . 3.3799999999999999 112.526 170.611 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -51.46 -22.85 3.36 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 127.53 2.332 . . . . 5.1500000000000004 116.316 -175.442 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.68 -39.68 8.55 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 121.178 -0.951 . . . . 4.7000000000000002 112.96 173.972 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -48.29 -48.07 36.01 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.134 0.973 . . . . 1.6200000000000001 110.912 168.011 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.4 -48.38 67.53 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.91 1.284 . . . . 3.2200000000000002 112.444 178.306 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -51.96 -43.91 63.75 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.479 -1.388 . . . . 4.46 112.643 174.407 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -68.18 -43.28 78.49 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.706 1.203 . . . . 3.2799999999999998 111.719 177.705 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.6 mt -53.43 -53.68 47.84 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.783 1.174 . . . . 3.8500000000000001 112.926 175.17 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.2 mt -55.15 -48.97 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.137 0.88 . . . . 2.2200000000000002 110.686 -178.481 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -64.94 -27.31 68.76 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 112.586 0.588 . . . . 4.8600000000000003 112.586 -176.738 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -87.62 -48.66 7.72 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.922 1.689 . . . . 3.5099999999999998 112.518 -179.068 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -73.34 -50.59 21.2 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.482 1.513 . . . . 4.4800000000000004 111.946 -175.26 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -95.59 61.73 2.31 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.498 1.519 . . . . 3.75 109.313 -177.458 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.6 t -63.64 5.17 0.21 Allowed 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 126.05 1.74 . . . . 3.8300000000000001 115.552 -173.927 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.0 mp -69.87 -24.23 63.39 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.163 1.785 . . . . 5.3899999999999997 111.968 166.926 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.17 -108.39 3.67 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 125.013 1.292 . . . . 4.8700000000000001 112.211 171.706 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.417 ' CD ' ' HZ3' ' A' ' 48' ' ' LYS . 7.3 tp10 62.27 -75.65 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.843 2.057 . . . . 5.3700000000000001 112.17 -167.526 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.44 107.44 0.11 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 127.124 2.17 . . . . 2.71 115.318 -159.095 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.417 ' HZ3' ' CD ' ' A' ' 46' ' ' GLU . 1.2 mptt -67.48 151.31 47.59 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.12 0.968 . . . . 5.9000000000000004 109.811 168.752 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -60.69 -33.7 73.24 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 116.027 1.862 . . . . 3.73 116.027 -159.757 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.4 t -84.23 -16.72 42.24 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 114.145 1.165 . . . . 3.3100000000000001 114.145 171.941 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.4 t -76.2 -21.32 56.6 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.259 1.39 . . . . 3.2200000000000002 112.074 174.606 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 21.9 mm -55.92 -40.7 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 124.056 0.943 . . . . 2.8399999999999999 110.994 163.546 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -69.67 -39.55 76.93 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 123.423 0.689 . . . . 3.3999999999999999 110.609 -172.88 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.98 -33.86 68.47 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.167 0.987 . . . . 2.7200000000000002 113.331 171.935 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.9 -56.55 20.59 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-N 118.831 0.741 . . . . 3.6699999999999999 109.828 171.017 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.6 ptm -71.95 -25.52 61.91 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.918 1.081 . . . . 3.2999999999999998 113.918 -176.804 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.5 ttmp? -64.6 -24.96 67.76 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.316 1.046 . . . . 5.2400000000000002 111.939 168.657 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.3 t -78.29 -25.35 46.61 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.035 1.124 . . . . 2.8199999999999998 114.035 168.3 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.5 mp -73.95 -53.85 9.19 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.174 0.99 . . . . 3.6400000000000001 113.324 178.597 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -75.45 81.92 2.51 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 122.355 1.074 . . . . 1.8200000000000001 112.295 -169.881 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.7 tmtp? -62.19 -7.46 4.18 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 115.118 1.525 . . . . 6.4100000000000001 115.118 -171.141 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.13 -26.69 13.86 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.838 1.655 . . . . 3.2400000000000002 112.913 172.365 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.1 m 57.84 32.46 21.95 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.322 1.049 . . . . 4.1100000000000003 112.902 -160.9 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 p30 -75.55 -6.42 50.21 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.779 0.832 . . . . 3.4900000000000002 111.876 166.433 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.35 -3.9 2.46 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 129.505 3.122 . . . . 4.6900000000000004 113.425 171.977 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -106.85 121.4 44.33 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 123.484 1.612 . . . . 2.8100000000000001 110.123 166.565 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 49.9 mt -81.29 103.6 8.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 123.013 1.387 . . . . 2.6699999999999999 108.721 178.517 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.79 151.01 30.56 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 112.844 -1.98 . . . . 4.0300000000000002 109.45 178.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.19 -38.14 70.56 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 120.611 -1.306 . . . . 4.0499999999999998 113.375 -177.474 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -59.18 -22.22 60.63 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.335 2.254 . . . . 5.1699999999999999 115.787 172.256 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -94.83 -47.45 6.45 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.248 1.419 . . . . 3.46 109.81 173.091 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -51.36 -26.14 7.2 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 127.432 2.293 . . . . 3.5499999999999998 115.845 -170.853 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 47.3 p -64.18 -18.7 64.73 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 120.155 -1.591 . . . . 2.8500000000000001 113.295 175.839 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.5 m -63.95 -24.22 35.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 119.54 1.064 . . . . 3.6499999999999999 112.822 170.385 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -60.05 -57.23 13.74 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.633 1.173 . . . . 3.27 111.423 173.538 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.6 mp -55.59 -41.07 72.86 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 125.827 1.651 . . . . 4.2199999999999998 110.56 173.332 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 44.3 m -61.14 -50.9 71.31 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 117.172 -1.394 . . . . 1.79 111.742 178.826 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 2.5 mpp? -52.42 -45.89 66.12 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 120.865 1.666 . . . . 2.8300000000000001 111.562 174.735 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 46.5 mt -69.69 -49.25 55.23 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.624 0.77 . . . . 2.1200000000000001 111.444 -175.716 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 99.3 m -65.37 -30.21 71.01 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.614 0.968 . . . . 2.2599999999999998 113.614 176.654 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 69.3 mtp -70.17 -37.0 75.07 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 120.01 1.277 . . . . 2.5899999999999999 111.203 171.874 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.64 -37.05 84.01 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.181 0.901 . . . . 1.74 112.616 173.102 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.0 m-30 -68.25 -23.33 64.77 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.987 0.915 . . . . 3.5499999999999998 112.575 174.6 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -68.0 -48.5 65.58 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.438 0.695 . . . . 3.54 111.52 174.571 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -62.49 -43.11 99.62 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.968 1.707 . . . . 2.6600000000000001 111.643 178.673 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.43 -45.52 65.99 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.303 1.441 . . . . 3.4399999999999999 111.964 174.174 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -66.79 -27.76 67.83 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.803 1.241 . . . . 4.0700000000000003 112.533 178.69 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 84.4 mt -78.01 -17.65 56.85 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.581 1.152 . . . . 2.5899999999999999 113.511 175.829 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -101.35 1.44 38.54 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 114.485 1.291 . . . . 2.8199999999999998 114.485 173.725 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -97.82 -56.58 2.46 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.06 1.344 . . . . 4.1200000000000001 111.729 171.169 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -81.82 17.52 1.49 Allowed 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 115.127 1.529 . . . . 3.1000000000000001 115.127 -170.633 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.216 0 C-N-CA 127.5 2.32 . . . . 4.5099999999999998 115.871 -175.618 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.477 0.895 0 N-CA-C 107.331 -1.359 . . . . 6.8099999999999996 107.331 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -113.43 -96.13 0.45 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 106.443 -1.688 . . . . 4.3700000000000001 106.443 -156.796 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.4 p -122.86 159.88 51.65 Favored Pre-proline 0 C--O 1.238 0.486 0 C-N-CA 124.073 0.949 . . . . 2.9199999999999999 109.351 152.839 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -71.65 -13.71 29.95 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.877 2.385 . . . . 2.0499999999999998 111.886 163.88 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 8.8 tt -76.34 -42.95 43.15 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 123.916 0.887 . . . . 4.0700000000000003 111.322 177.501 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -60.52 -30.29 69.64 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 118.617 0.644 . . . . 4.1500000000000004 111.28 177.032 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.48 -25.75 38.66 Favored 'General case' 0 CA--C 1.548 0.869 0 O-C-N 120.786 -1.196 . . . . 4.5899999999999999 114.166 169.334 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.19 -42.58 99.42 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.012 -1.055 . . . . 2.6000000000000001 111.301 171.255 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 41.1 mt -69.71 -36.63 76.07 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.638 1.175 . . . . 2.6299999999999999 111.441 -175.02 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.79 -47.01 67.21 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.821 0.848 . . . . 2.5899999999999999 112.002 168.268 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.3 t -65.44 -25.06 67.35 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 120.093 1.315 . . . . 4.0499999999999998 111.966 -178.571 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 85.9 mtp -59.2 -60.11 4.38 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.143 0.977 . . . . 3.5899999999999999 110.869 169.479 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 28.1 m -61.78 -22.95 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 120.378 -1.451 . . . . 3.2400000000000002 113.112 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 90.5 m -75.48 -40.15 57.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 126.269 1.828 . . . . 1.8500000000000001 113.185 178.7 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 10.7 p -75.33 -35.29 61.22 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.112 1.323 . . . . 2.1499999999999999 109.923 169.25 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -54.28 -61.38 2.34 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.85 0.86 . . . . 3.4700000000000002 109.91 -179.273 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 42.4 m170 -71.15 -24.86 62.34 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 115.005 1.483 . . . . 3.5099999999999998 115.005 178.672 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -70.19 -33.92 72.32 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 122.026 2.194 . . . . 4.8300000000000001 113.657 174.199 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -92.0 -36.18 13.55 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.155 0.889 . . . . 3.2799999999999998 112.479 175.765 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 20' ' ' SER . . . . . 0.414 ' HG ' ' C ' ' B' ' 27' ' ' LEU . 26.5 t -64.83 -29.75 70.72 Favored 'General case' 0 C--O 1.247 0.963 0 N-CA-C 113.844 1.053 . . . . 2.2400000000000002 113.844 171.355 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.29 -12.24 84.77 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 126.583 2.04 . . . . 1.6699999999999999 114.675 178.893 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -76.88 -44.6 31.35 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 118.783 1.292 . . . . 4.2400000000000002 112.361 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -123.65 144.57 49.55 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 118.768 0.713 . . . . 3.2000000000000002 111.888 -171.35 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.77 -129.69 30.66 Favored Glycine 0 C--N 1.341 0.845 0 C-N-CA 125.628 1.585 . . . . 2.52 112.791 175.528 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 12.0 t -57.62 132.47 53.32 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.609 0.719 . . . . 4.2699999999999996 110.578 166.218 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -80.89 -12.75 59.36 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.575 1.15 . . . . 8.2400000000000002 113.938 177.729 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.414 ' C ' ' HG ' ' B' ' 20' ' ' SER . 57.5 tp -84.17 -39.98 18.72 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.62 1.168 . . . . 3.6499999999999999 111.116 171.011 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 3.1 p -108.0 148.77 29.26 Favored 'General case' 0 C--O 1.253 1.256 0 C-N-CA 125.495 1.518 . . . . 2.1200000000000001 113.421 -173.208 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 2.4 pp -122.56 112.04 17.52 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 113.104 -1.862 . . . . 3.1299999999999999 111.48 -174.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 79.9 p -97.12 -170.02 1.96 Allowed 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 122.144 0.973 . . . . 2.7799999999999998 113.392 -178.989 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 25.6 ttt-85 -56.08 -8.12 0.43 Allowed 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 117.948 2.573 . . . . 4.4199999999999999 117.948 -172.349 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.89 -50.73 3.75 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 113.734 1.012 . . . . 5.0 113.734 164.295 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -54.69 -34.06 61.77 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.771 1.228 . . . . 1.9199999999999999 112.029 178.015 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 54.6 tp -70.23 -49.4 50.43 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.28 1.032 . . . . 2.8399999999999999 112.335 174.548 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -78.83 -24.4 44.46 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.373 -1.454 . . . . 4.9800000000000004 114.65 -174.021 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -46.26 -71.68 0.07 Allowed 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 117.802 -1.094 . . . . 3.23 110.503 149.903 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.18 -57.75 6.18 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.612 1.165 . . . . 2.75 113.215 -175.726 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 22.8 mt -53.98 -44.98 63.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 119.269 0.94 . . . . 1.97 110.13 -176.558 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 22.9 mmmt -74.56 -5.61 43.82 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.559 1.318 . . . . 6.25 114.559 -179.847 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 8.7 mmtp -102.78 -22.11 13.95 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 120.749 1.613 . . . . 4.8700000000000001 113.699 168.351 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -91.02 -87.9 0.19 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.315 1.046 . . . . 3.8700000000000001 108.491 170.875 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -77.37 37.77 0.22 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.099 1.76 . . . . 3.0 112.842 -175.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 39.8 t -51.05 -27.64 8.51 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.645 1.978 . . . . 4.0800000000000001 113.488 178.604 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.483 ' H ' HD11 ' B' ' 44' ' ' LEU . 3.3 mp -60.16 -37.06 79.01 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.369 2.268 . . . . 5.4000000000000004 113.641 178.92 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -81.83 40.53 2.65 Favored Glycine 0 N--CA 1.473 1.131 0 C-N-CA 124.798 1.19 . . . . 4.5800000000000001 113.983 -169.107 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . 0.266 6.2 pt-20 46.08 -68.67 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 129.521 3.128 . . . . 4.96 114.928 -165.288 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 6.9 mmt 59.16 60.82 2.26 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 124.672 2.177 . . . . 3.0299999999999998 113.235 173.074 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.3 mppt? -65.51 159.46 24.44 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 111.604 -2.544 . . . . 4.2699999999999996 111.489 168.256 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.56 -41.85 6.83 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 128.275 2.63 . . . . 5.8600000000000003 115.66 -170.202 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 6.0 t -91.35 -32.97 15.47 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.456 1.102 . . . . 3.8300000000000001 113.151 177.405 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 35.9 t -62.74 -33.83 75.94 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 120.204 -1.56 . . . . 2.5499999999999998 111.398 174.074 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 3.7 mm -59.97 -38.42 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 126.974 2.11 . . . . 2.5499999999999998 112.878 166.815 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.85 -31.02 24.02 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 124.791 1.236 . . . . 2.7000000000000002 111.472 -168.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.513 ' CG ' ' HZ2' ' B' ' 57' ' ' LYS . 16.9 m-20 -81.67 -30.97 32.46 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.201 1.401 . . . . 4.6699999999999999 111.645 170.468 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 16.0 tp -57.74 -45.61 85.61 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.525 -0.75 . . . . 2.96 110.061 162.355 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 3.2 ttt -58.68 -41.91 87.3 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-O 118.069 -0.967 . . . . 2.9300000000000002 113.279 173.66 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . 0.513 ' HZ2' ' CG ' ' B' ' 54' ' ' ASP . 31.0 mttp -61.02 -29.48 69.74 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 120.358 1.435 . . . . 5.7199999999999998 112.134 176.455 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 2.2 p -79.21 -37.34 38.42 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.258 0.836 . . . . 3.3700000000000001 113.258 173.643 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.85 -53.15 29.01 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 125.828 1.651 . . . . 3.3900000000000001 110.603 179.733 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -76.85 68.08 3.0 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 123.671 1.7 . . . . 1.6299999999999999 111.19 -179.317 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . 0.436 ' HZ1' ' CG2' ' B' ' 74' ' ' VAL . 2.4 ttmp? -53.0 -26.51 15.6 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.905 2.482 . . . . 4.6299999999999999 114.03 178.827 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -73.5 -34.39 65.27 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 118.199 -0.905 . . . . 3.1499999999999999 112.873 171.744 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 65.8 m 53.54 65.49 1.5 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.609 1.164 . . . . 4.3099999999999996 111.388 -157.841 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -110.34 -74.2 0.66 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.78 1.232 . . . . 2.5800000000000001 109.893 -175.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 173.58 -25.23 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 131.362 3.865 . . . . 7.2599999999999998 112.765 -178.096 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -132.28 142.6 49.44 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 127.131 2.172 . . . . 3.5099999999999998 111.443 -169.342 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 46.5 mm -83.23 110.29 17.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 125.15 1.38 . . . . 2.2400000000000002 109.383 172.937 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -74.45 163.18 28.08 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.86 1.664 . . . . 3.0800000000000001 110.557 161.552 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.62 -36.31 78.31 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 120.16 -1.588 . . . . 4.1600000000000001 112.627 178.446 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -71.89 -15.78 62.12 Favored 'General case' 0 CA--C 1.556 1.194 0 O-C-N 120.631 -1.293 . . . . 7.3700000000000001 111.876 177.433 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -81.14 -58.8 2.9 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.293 1.437 . . . . 1.8700000000000001 108.898 164.172 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -45.93 -45.3 15.37 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.344 2.257 . . . . 3.0600000000000001 114.032 -175.532 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 56.3 m -53.76 -27.52 29.22 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.291 0.849 . . . . 2.5299999999999998 113.291 178.477 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . 0.436 ' CG2' ' HZ1' ' B' ' 61' ' ' LYS . 87.5 t -62.16 -36.53 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 119.995 1.271 . . . . 2.7400000000000002 111.211 178.959 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -51.45 -62.08 1.84 Allowed 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.446 0.698 . . . . 2.6800000000000002 111.062 174.135 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 77.9 mt -72.61 -22.72 60.92 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.993 0.917 . . . . 3.0899999999999999 112.328 -175.483 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.7 m -60.62 -56.16 24.69 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.631 1.173 . . . . 1.79 110.197 169.378 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 58.1 mtm -55.58 -42.32 74.61 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 118.299 0.5 . . . . 2.5299999999999998 112.099 -179.507 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 31.1 mt -71.18 -40.01 71.49 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.688 0.795 . . . . 2.29 112.366 -177.145 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 14.7 t -64.42 -34.12 77.44 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.88 0.696 . . . . 3.2400000000000002 112.88 177.458 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 2.9 mtm -70.96 -36.59 72.63 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.596 -0.69 . . . . 4.4900000000000002 112.012 170.161 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.68 -34.66 78.36 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.76 1.164 . . . . 1.98 112.755 175.383 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -68.43 -35.6 77.84 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 119.182 0.901 . . . . 3.8100000000000001 112.343 171.922 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -64.93 -41.58 95.4 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.179 0.992 . . . . 2.5299999999999998 112.633 173.95 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -72.47 -29.78 63.96 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.043 0.937 . . . . 3.5600000000000001 111.347 179.054 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -58.75 -52.16 66.91 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.201 1.0 . . . . 3.3999999999999999 111.094 167.731 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -58.24 -32.62 68.51 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.161 1.385 . . . . 4.0300000000000002 112.13 -179.869 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 42.4 mt -72.34 -16.24 61.87 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.468 1.285 . . . . 2.73 114.468 175.972 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.521 ' CD ' ' HZ3' ' B' ' 92' ' ' LYS . 72.8 mm-40 -97.95 -18.23 18.76 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.743 1.217 . . . . 4.5 113.839 172.915 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -101.17 -40.79 7.01 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.21 1.804 . . . . 2.9300000000000002 113.268 -169.282 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -89.34 24.23 2.28 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 124.598 1.159 . . . . 2.8500000000000001 112.989 177.65 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . 0.521 ' HZ3' ' CD ' ' B' ' 89' ' ' GLU . 38.4 mttp . . . . . 0 C--O 1.246 0.916 0 C-N-CA 126.828 2.051 . . . . 4.7000000000000002 115.14 174.496 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.8 mmt . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 107.713 -1.217 . . . . 6.96 107.713 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 -112.08 -95.7 0.43 Allowed 'General case' 0 CA--C 1.535 0.388 0 O-C-N 125.467 1.73 . . . . 4.3899999999999997 109.215 -152.102 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.4 p -136.05 153.24 76.71 Favored Pre-proline 0 N--CA 1.468 0.461 0 C-N-CA 124.814 1.246 . . . . 2.7400000000000002 108.145 169.912 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.18 -17.75 59.45 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.221 1.947 . . . . 1.53 112.486 176.333 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 17.1 tp -85.74 -44.64 12.35 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 118.044 -0.979 . . . . 4.0899999999999999 112.524 -179.09 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -58.2 -49.47 76.95 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.84 1.2 . . . . 4.0499999999999998 109.48 165.615 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -29.9 67.19 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.473 -0.767 . . . . 5.3499999999999996 112.213 178.767 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.8 -51.2 58.5 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 117.449 -1.262 . . . . 1.8500000000000001 112.112 172.369 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.7 mt -55.85 -48.3 75.76 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 120.208 1.367 . . . . 2.29 111.01 174.94 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 36.9 m -52.81 -49.93 64.67 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 125.175 1.39 . . . . 2.2000000000000002 110.405 173.292 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 86.4 m -61.38 -45.8 92.85 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 120.077 1.308 . . . . 2.48 112.494 177.858 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 79.0 mtp -54.24 -48.45 71.1 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.427 1.091 . . . . 3.8100000000000001 111.711 175.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 78.0 t -78.53 -33.81 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.484 0.714 . . . . 3.8199999999999998 112.059 -176.405 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.1 m -56.37 -55.84 28.53 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.458 1.103 . . . . 2.3300000000000001 110.322 170.28 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.8 t -67.84 -33.35 74.6 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 117.376 -1.297 . . . . 3.1099999999999999 110.15 -172.822 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -55.17 -48.88 73.15 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.702 0.683 . . . . 2.8799999999999999 111.504 172.962 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 23.1 m170 -64.68 -34.95 79.52 Favored 'General case' 0 CA--C 1.549 0.925 0 O-C-N 120.863 -1.148 . . . . 3.9900000000000002 112.736 178.291 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.4 tmtm? -61.12 -25.22 66.83 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.692 1.197 . . . . 6.7000000000000002 113.503 173.468 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -88.27 -30.51 19.6 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 120.677 -1.264 . . . . 4.5599999999999996 112.084 168.924 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.5 p -60.26 -19.5 55.03 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 117.425 2.38 . . . . 4.21 117.425 -172.092 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.61 -7.67 53.33 Favored Glycine 0 CA--C 1.537 1.412 0 CA-C-O 118.394 -1.226 . . . . 1.75 115.721 -178.893 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 88.5 mtt-85 -77.54 53.07 1.03 Allowed 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 120.278 2.039 . . . . 6.1100000000000003 112.785 176.197 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.468 ' CD ' ' HZ2' ' A' ' 32' ' ' LYS . 19.1 tt0 121.2 175.33 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 131.221 3.808 . . . . 4.1100000000000003 108.945 -176.031 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 9.68 113.18 0.0 OUTLIER Glycine 0 N--CA 1.481 1.66 0 C-N-CA 128.615 3.007 . . . . 2.6699999999999999 117.964 178.187 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.3 m 69.86 155.51 0.13 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.59 1.156 . . . . 3.5600000000000001 113.69 166.153 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -101.05 52.26 0.85 Allowed 'General case' 0 N--CA 1.483 1.194 0 O-C-N 120.541 -1.35 . . . . 6.21 111.136 171.883 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 tt -161.03 -58.3 0.05 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.345 1.058 . . . . 4.1500000000000004 112.338 -172.515 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.451 ' HG1' ' CD ' ' A' ' 66' ' ' GLU . 20.9 p -84.64 156.07 21.7 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 127.453 2.301 . . . . 2.3500000000000001 113.284 -173.883 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 18.6 mt -92.07 94.77 9.41 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 114.704 -1.134 . . . . 2.5499999999999998 109.303 161.05 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.0 m -74.37 133.55 42.49 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 125.231 1.413 . . . . 3.9199999999999999 109.304 170.486 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -0.12 -70.34 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 127.687 2.395 . . . . 5.1799999999999997 117.107 -173.476 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.468 ' HZ2' ' CD ' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -62.56 -36.68 83.43 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 119.481 -2.012 . . . . 4.9400000000000004 114.539 -175.583 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -57.74 -41.63 82.23 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.846 1.659 . . . . 2.77 110.563 175.518 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -66.05 -40.67 91.15 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.755 1.222 . . . . 3.71 110.711 178.944 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.1 mtpt -65.3 -41.55 93.99 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 120.712 -1.242 . . . . 4.0999999999999996 113.154 175.327 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -56.23 -51.46 68.01 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-O 117.995 -1.002 . . . . 5.0800000000000001 112.543 170.075 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -52.61 -57.64 9.36 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.078 0.854 . . . . 3.9100000000000001 111.154 -178.506 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 46.0 mt -54.43 -46.35 70.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 118.367 0.531 . . . . 1.9099999999999999 110.784 -178.807 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.42 ' HZ2' ' CD ' ' A' ' 49' ' ' GLU . 98.2 mttt -70.08 -9.6 55.96 Favored 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 113.767 1.025 . . . . 5.3799999999999999 113.767 -176.624 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.38 -13.34 9.79 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.527 1.931 . . . . 5.1799999999999997 113.15 -178.089 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -71.45 -51.91 21.32 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.801 1.641 . . . . 4.5599999999999996 108.776 158.062 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -115.81 124.18 50.08 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.471 2.309 . . . . 3.7599999999999998 108.439 179.779 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 62.0 m -107.27 -8.86 16.24 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.767 1.025 . . . . 4.7699999999999996 113.767 -178.68 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -60.99 154.77 21.67 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 119.559 1.072 . . . . 4.7400000000000002 113.409 172.172 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -72.85 11.88 4.2 Favored Glycine 0 CA--C 1.537 1.423 0 N-CA-C 116.281 1.273 . . . . 4.6200000000000001 116.281 -169.315 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -85.45 -27.03 25.98 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.964 2.105 . . . . 5.6900000000000004 112.08 178.366 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.69 86.92 7.34 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 123.2 1.476 . . . . 2.71 112.151 -178.518 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 72.7 mttt -132.14 170.63 14.72 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 127.662 2.385 . . . . 5.9299999999999997 111.245 -177.552 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.42 ' CD ' ' HZ2' ' A' ' 39' ' ' LYS . 0.5 OUTLIER -53.96 -46.8 71.71 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.293 -0.88 . . . . 4.2000000000000002 113.039 -164.81 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.8 m -63.04 -25.49 68.4 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.366 1.617 . . . . 3.1200000000000001 115.366 176.403 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.6 p -94.56 6.78 47.8 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.513 1.125 . . . . 3.52 112.735 171.554 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 28.2 mt -125.32 -35.48 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.885 1.274 . . . . 2.3399999999999999 113.448 -173.546 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -82.55 -29.47 30.31 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.478 1.035 . . . . 3.9700000000000002 112.244 179.27 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -66.62 -45.09 80.23 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 118.513 0.597 . . . . 2.46 110.052 158.683 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.5 tp -59.75 -39.38 84.57 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 118.552 -0.737 . . . . 2.75 110.636 -177.806 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.1 tpt -51.75 -59.5 4.23 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 119.241 0.928 . . . . 2.6499999999999999 109.996 165.853 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.19 -19.16 19.04 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 125.808 1.643 . . . . 4.8700000000000001 115.008 176.367 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.8 m -98.98 -29.42 12.93 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.723 2.009 . . . . 3.7799999999999998 113.515 -178.006 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 97.5 mt -83.27 -42.81 16.76 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.494 1.518 . . . . 2.9199999999999999 111.814 170.873 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -73.76 81.28 1.59 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.418 2.287 . . . . 2.0099999999999998 111.663 -175.694 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -51.7 -32.45 30.06 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 115.247 1.573 . . . . 4.2400000000000002 115.247 -173.014 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -81.88 -11.96 58.67 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.973 1.101 . . . . 2.6600000000000001 113.973 178.793 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.8 t 55.4 45.53 25.16 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.558 1.143 . . . . 3.1400000000000001 111.72 -169.387 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -102.33 -131.89 0.27 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.575 1.95 . . . . 2.96 107.796 178.876 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -142.47 1.06 1.34 Allowed 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 120.337 1.426 . . . . 4.4100000000000001 114.741 164.326 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.451 ' CD ' ' HG1' ' A' ' 28' ' ' THR . 5.5 mm-40 -103.07 134.17 46.95 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 126.485 1.914 . . . . 2.3500000000000001 109.324 173.548 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.7 mm -96.47 114.06 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 126.581 1.952 . . . . 2.6000000000000001 109.914 171.965 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -88.77 157.2 18.57 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.879 1.271 . . . . 2.6899999999999999 108.759 163.401 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -49.85 -42.17 46.82 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.326 -1.484 . . . . 3.8399999999999999 114.44 -177.394 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -11.43 60.85 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 114.524 1.305 . . . . 3.9399999999999999 114.524 176.791 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -84.84 -56.06 3.77 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 124.929 1.292 . . . . 1.8 108.004 162.157 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -50.02 -45.14 51.71 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.192 1.797 . . . . 3.75 115.771 -176.209 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.9 m -65.03 -8.61 16.84 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 120.793 -1.192 . . . . 2.3500000000000001 113.468 -177.313 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 99.7 t -62.24 -37.02 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 119.585 1.084 . . . . 3.1899999999999999 110.939 167.32 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -65.66 -52.35 52.35 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.18 0.992 . . . . 3.2599999999999998 110.036 178.083 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -55.67 -44.51 77.33 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.627 1.171 . . . . 3.4199999999999999 110.783 176.844 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.3 m -58.53 -52.32 66.15 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.764 0.826 . . . . 2.0099999999999998 111.855 173.831 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 73.3 mtm -61.92 -35.58 78.82 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.229 0.922 . . . . 2.3999999999999999 112.404 -179.476 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.75 -50.5 42.74 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 123.857 0.863 . . . . 4.0499999999999998 111.623 175.715 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 28.1 m -60.66 -33.79 73.33 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 118.42 -0.8 . . . . 2.0499999999999998 112.737 174.428 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 62.6 mtp -70.58 -37.36 73.94 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.008 0.822 . . . . 3.29 111.795 172.554 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.51 -41.63 92.97 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 119.571 1.078 . . . . 1.76 111.047 173.5 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -70.85 -32.7 69.8 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.702 1.137 . . . . 3.73 113.614 175.406 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -58.41 -52.28 66.28 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.407 1.083 . . . . 3.5499999999999998 110.718 168.189 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -67.95 -41.59 82.25 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.558 1.143 . . . . 4.1600000000000001 112.643 -177.262 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.63 -48.93 79.73 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.909 1.684 . . . . 3.75 110.576 173.055 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -58.59 -36.96 74.82 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 123.974 0.91 . . . . 4.79 111.991 -179.89 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 54.5 mt -72.87 -15.89 61.59 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.37 1.068 . . . . 3.23 113.264 177.365 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.496 ' CD ' ' HZ2' ' A' ' 92' ' ' LYS . 23.3 mm-40 -106.41 -7.85 17.44 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.433 1.493 . . . . 3.7599999999999998 114.505 175.963 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -108.41 -51.38 2.9 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.412 1.485 . . . . 3.48 112.375 -175.114 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -82.86 27.1 0.55 Allowed 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 125.122 1.369 . . . . 2.9100000000000001 113.085 179.561 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.496 ' HZ2' ' CD ' ' A' ' 89' ' ' GLU . 1.0 OUTLIER . . . . . 0 C--O 1.252 1.199 0 C-N-CA 128.337 2.655 . . . . 4.3499999999999996 115.685 -178.182 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.473 0.714 0 N-CA-C 108.256 -1.016 . . . . 11.66 108.256 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -146.2 -72.77 0.23 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.861 2.064 . . . . 6.1699999999999999 111.697 -160.68 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 44.3 p -97.08 161.36 26.49 Favored Pre-proline 0 N--CA 1.468 0.461 0 C-N-CA 125.783 1.633 . . . . 3.0899999999999999 111.279 -154.664 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -62.06 -21.21 72.0 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 121.887 1.725 . . . . 1.5900000000000001 111.696 171.122 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -85.96 -39.54 16.8 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-O 116.683 -1.627 . . . . 3.6800000000000002 113.837 178.101 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -57.69 -37.9 74.25 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 121.925 2.148 . . . . 5.1799999999999997 110.665 166.663 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -72.95 -26.71 61.47 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.087 -1.008 . . . . 5.4000000000000004 112.718 178.14 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.05 -44.53 38.67 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.218 0.607 . . . . 2.1400000000000001 112.004 171.454 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 58.2 mt -57.13 -45.61 83.35 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.987 1.315 . . . . 2.9199999999999999 110.936 175.843 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 20.6 p -68.16 -43.57 77.94 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 116.875 -1.536 . . . . 3.2799999999999998 112.501 175.385 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 52.7 m -55.55 -43.18 75.61 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 120.567 1.531 . . . . 2.5899999999999999 111.028 172.312 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -51.88 66.35 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.121 0.968 . . . . 4.8600000000000003 110.019 178.815 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 75.7 t -64.26 -31.78 54.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 O-C-N 121.158 -0.964 . . . . 2.9199999999999999 112.907 176.436 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 81.2 m -60.72 -57.89 10.76 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.543 1.137 . . . . 2.46 109.841 176.135 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.44 -28.34 61.91 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 123.918 0.761 . . . . 3.6899999999999999 110.006 -173.598 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -55.85 -53.87 51.46 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-O 119.129 -0.462 . . . . 3.1400000000000001 110.571 166.573 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 49.0 m80 -70.28 -33.62 71.79 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 120.18 1.355 . . . . 3.0099999999999998 113.076 -178.609 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -64.26 -27.52 69.1 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.042 1.127 . . . . 5.71 114.042 174.483 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -100.23 -34.55 9.97 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.993 1.317 . . . . 3.52 112.995 177.8 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 7.4 t -82.03 -33.19 30.1 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 126.003 1.721 . . . . 2.4300000000000002 113.331 -178.69 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.54 -11.17 83.47 Favored Glycine 0 CA--C 1.525 0.68 0 O-C-N 120.949 -1.095 . . . . 1.6100000000000001 112.514 170.046 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -57.52 -41.14 80.28 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.671 1.236 . . . . 5.2999999999999998 112.402 -167.791 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -139.22 152.88 47.7 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 126.606 1.962 . . . . 4.9699999999999998 111.676 179.529 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 60.75 2.2 2.35 Favored Glycine 0 CA--C 1.535 1.324 0 O-C-N 121.112 -0.993 . . . . 2.6499999999999999 113.509 -165.302 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 6.0 t 59.47 -154.54 0.37 Allowed 'General case' 0 C--O 1.254 1.315 0 C-N-CA 126.022 1.729 . . . . 7.7800000000000002 111.477 -159.398 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 72.4 mttt 85.07 174.79 0.06 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 129.975 3.31 . . . . 11.43 113.738 156.16 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -76.71 19.33 0.28 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.68 0.792 . . . . 3.7999999999999998 112.721 158.0 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 69.7 p -121.06 132.83 55.12 Favored 'General case' 0 C--O 1.251 1.168 0 CA-C-O 122.978 1.371 . . . . 2.1000000000000001 113.588 -177.096 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -111.42 111.15 21.98 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 112.537 -2.12 . . . . 3.3300000000000001 110.913 177.13 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -88.29 170.02 11.34 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 121.517 0.675 . . . . 3.4700000000000002 111.789 166.364 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 -43.93 -29.59 0.59 Allowed 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 118.928 2.936 . . . . 4.4400000000000004 118.928 -162.803 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.92 -36.47 23.29 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.389 1.255 . . . . 6.2199999999999998 114.389 173.0 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -63.58 -49.58 72.81 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 106.845 -1.539 . . . . 2.1200000000000001 106.845 171.609 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 57.9 tp -56.13 -47.56 77.92 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.644 0.778 . . . . 3.8900000000000001 112.808 174.18 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -58.33 -44.4 88.65 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.394 0.997 . . . . 3.6400000000000001 111.865 -176.245 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -79.79 -17.66 52.83 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.215 1.561 . . . . 4.1900000000000004 115.215 -179.65 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 2.3 tt -72.32 -54.99 7.9 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.983 1.265 . . . . 3.0899999999999999 110.695 165.795 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 33.4 mt -53.24 -44.57 53.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 CA-C-N 119.42 1.009 . . . . 1.8700000000000001 110.688 -173.565 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -63.13 -13.93 42.58 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.044 1.127 . . . . 5.25 114.044 -177.091 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -95.06 -18.67 20.81 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.471 1.908 . . . . 3.8700000000000001 112.607 176.159 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -96.02 -56.62 2.59 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.828 1.651 . . . . 5.8700000000000001 109.894 178.189 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -99.19 71.65 1.82 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.122 1.369 . . . . 3.6000000000000001 109.574 -179.237 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 14.2 p -73.33 -2.42 22.03 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.014 0.926 . . . . 4.6200000000000001 113.285 167.245 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -138.39 162.57 34.08 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.854 2.461 . . . . 4.7800000000000002 110.371 -178.88 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.13 -129.83 10.03 Favored Glycine 0 N--CA 1.468 0.83 0 N-CA-C 108.884 -1.687 . . . . 6.8099999999999996 108.884 -165.43 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -148.62 64.73 1.06 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 122.761 1.267 . . . . 5.7000000000000002 111.805 168.139 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.15 66.78 3.01 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 123.871 1.795 . . . . 2.2200000000000002 112.019 176.303 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -63.31 143.92 57.39 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.106 -1.406 . . . . 5.21 109.614 165.199 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -57.78 -24.92 59.53 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.643 1.349 . . . . 4.9000000000000004 114.643 -174.342 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 8.6 t -78.45 -27.74 46.46 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 120.732 -1.23 . . . . 3.23 113.71 172.332 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 3.6 m -65.87 -17.01 64.36 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.247 0.931 . . . . 3.0800000000000001 111.848 175.307 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 39.9 mm -64.53 -38.96 83.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 125.34 1.456 . . . . 2.6000000000000001 112.031 177.475 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.28 -30.07 65.83 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.509 1.123 . . . . 3.1600000000000001 112.311 -177.1 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -83.71 -40.67 18.58 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.776 0.83 . . . . 2.5899999999999999 112.27 172.793 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.35 -35.32 77.12 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.343 -0.848 . . . . 3.8700000000000001 110.819 173.483 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 2.5 ttt -52.79 -51.62 60.0 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 118.874 -0.584 . . . . 2.8500000000000001 110.93 167.574 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -71.81 -27.14 62.72 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.58 1.082 . . . . 6.7400000000000002 113.008 -178.112 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 8.6 t -61.08 -31.82 71.49 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 113.868 1.062 . . . . 2.2000000000000002 113.868 168.64 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -114.6 -29.69 6.74 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 116.939 2.2 . . . . 3.8300000000000001 116.939 -176.119 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -76.29 85.14 3.08 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 124.725 1.21 . . . . 1.6399999999999999 107.809 168.419 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -47.43 -35.67 8.83 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.832 1.419 . . . . 5.7800000000000002 114.832 -164.943 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 44.1 p30 -96.58 -14.5 22.17 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.724 1.379 . . . . 3.1800000000000002 114.724 -179.917 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 70.9 m 53.98 62.97 2.35 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.932 1.293 . . . . 4.1600000000000001 111.644 -167.158 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 14.2 p30 -87.92 -79.49 0.29 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.044 1.338 . . . . 2.9300000000000002 108.787 177.306 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -178.92 -27.54 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 129.812 3.245 . . . . 5.5899999999999999 112.66 168.57 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -113.64 142.41 46.04 Favored 'General case' 0 C--O 1.242 0.667 0 C-N-CA 126.475 1.91 . . . . 2.7200000000000002 108.942 -174.366 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 6.3 mt -119.99 109.59 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 123.586 0.754 . . . . 2.6800000000000002 111.18 -176.451 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -84.06 157.61 21.73 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.008 2.123 . . . . 3.8100000000000001 110.987 172.731 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.93 -33.96 39.73 Favored 'General case' 0 CA--C 1.551 1.01 0 O-C-N 120.578 -1.326 . . . . 3.79 114.11 179.92 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -75.67 -19.28 59.26 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 119.982 -1.699 . . . . 6.0199999999999996 112.874 176.669 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -78.64 -63.65 1.36 Allowed 'General case' 0 CA--C 1.551 0.981 0 O-C-N 121.004 -1.06 . . . . 2.1800000000000002 108.624 160.727 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -58.03 -22.49 50.15 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.381 2.672 . . . . 3.2599999999999998 117.093 -172.387 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 2.3 p -58.54 -21.35 52.17 Favored 'General case' 0 N--CA 1.481 1.075 0 O-C-N 119.117 -2.24 . . . . 3.9100000000000001 112.718 170.48 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.4 p -71.2 -33.33 50.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 O-C-N 121.55 -0.718 . . . . 3.5600000000000001 112.432 171.93 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -62.97 -51.72 65.78 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.197 0.908 . . . . 2.9300000000000002 110.833 174.611 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 92.2 mt -53.51 -37.65 62.97 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.069 0.948 . . . . 2.8599999999999999 111.687 174.678 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 55.1 m -74.26 -39.33 63.08 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.42 1.088 . . . . 2.6800000000000002 113.205 179.315 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.1 mtm -64.05 -44.97 90.87 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.491 1.041 . . . . 3.0600000000000001 110.95 172.837 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 71.6 mt -63.31 -46.09 88.32 Favored 'General case' 0 CA--C 1.528 0.098 0 CA-C-O 118.495 -0.764 . . . . 2.9700000000000002 112.176 178.191 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.9 p -59.71 -34.61 73.12 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.793 1.179 . . . . 4.6200000000000001 112.655 178.834 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 20.9 mtp -72.34 -30.73 65.01 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.519 1.303 . . . . 3.5600000000000001 114.519 173.002 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.27 -33.26 74.93 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 120.62 1.555 . . . . 2.3399999999999999 111.536 171.543 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -73.07 -26.54 61.3 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.723 1.008 . . . . 4.1299999999999999 113.723 173.773 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -55.44 -53.8 51.81 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.93 1.241 . . . . 3.6400000000000001 110.213 166.008 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.17 -31.94 72.69 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.367 1.067 . . . . 3.6200000000000001 113.082 -175.861 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.0 -40.89 99.15 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.814 1.246 . . . . 3.5299999999999998 112.186 170.837 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -74.45 -30.3 61.83 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.331 1.452 . . . . 4.4199999999999999 112.134 176.563 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 34.9 mt -66.84 -30.1 70.2 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 117.289 -1.339 . . . . 3.4900000000000002 113.589 179.915 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -83.21 -6.31 59.43 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 114.363 1.246 . . . . 4.1699999999999999 114.363 174.834 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -92.92 -53.39 4.17 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.663 0.785 . . . . 4.5499999999999998 110.897 169.141 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -75.84 12.84 0.96 Allowed 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.798 1.407 . . . . 4.0599999999999996 114.798 -168.296 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.937 0 C-N-CA 128.978 2.911 . . . . 5.1900000000000004 113.334 179.71 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.5 mtt . . . . . 0 N--CA 1.477 0.91 0 N-CA-C 107.525 -1.287 . . . . 7.4500000000000002 107.525 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.3 mp0 -114.57 -95.74 0.46 Allowed 'General case' 0 CA--C 1.54 0.577 0 O-C-N 124.778 1.298 . . . . 4.4800000000000004 110.953 -151.172 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -140.72 155.83 69.21 Favored Pre-proline 0 N--CA 1.474 0.753 0 C-N-CA 124.648 1.179 . . . . 3.4500000000000002 109.352 176.781 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.18 -20.78 27.93 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.434 2.089 . . . . 1.5800000000000001 112.963 -179.066 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 tt -82.68 -41.15 19.71 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.271 1.028 . . . . 3.6299999999999999 110.438 174.482 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.429 ' CD ' ' HZ2' ' A' ' 7' ' ' LYS . 4.0 tm-20 -64.97 -38.69 91.8 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.632 0.73 . . . . 3.73 109.944 175.315 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.478 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -70.57 -34.14 71.87 Favored 'General case' 0 C--O 1.232 0.159 0 O-C-N 120.546 -1.346 . . . . 6.0700000000000003 113.32 176.569 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.82 -47.61 82.13 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.567 0.747 . . . . 1.8500000000000001 111.934 169.23 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.3 mt -64.7 -36.02 82.93 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.463 1.029 . . . . 2.6699999999999999 112.857 173.406 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 57.8 m -61.06 -42.33 98.3 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.995 0.918 . . . . 2.23 111.437 172.537 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.5 m -57.93 -34.15 69.57 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.084 1.353 . . . . 2.27 111.689 -178.958 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 10.2 mmt -53.65 -65.94 0.48 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.087 1.355 . . . . 4.29 111.068 174.355 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.3 m -63.1 -28.39 44.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 CA-C-N 118.792 0.724 . . . . 3.3900000000000001 112.546 -176.162 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.0 m -70.01 -48.24 58.88 Favored 'General case' 0 CA--C 1.502 -0.877 0 C-N-CA 125.618 1.567 . . . . 2.4500000000000002 112.691 -178.826 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.24 -35.48 48.24 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 117.772 -1.109 . . . . 3.6200000000000001 108.859 177.524 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.4 t80 -53.24 -45.13 68.62 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.994 0.918 . . . . 3.1600000000000001 111.897 -177.168 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.3 m80 -69.38 -11.97 61.27 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.671 1.36 . . . . 3.0 114.671 -175.839 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -30.11 66.17 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 120.661 -1.274 . . . . 4.7300000000000004 111.11 170.562 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -102.98 -46.59 4.61 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.922 1.289 . . . . 3.3700000000000001 112.234 -176.888 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.7 p -65.41 -24.3 67.17 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 124.629 1.172 . . . . 2.6099999999999999 113.764 -178.597 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.09 7.42 60.07 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 127.357 2.408 . . . . 1.3400000000000001 115.6 177.607 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -87.26 -102.35 0.07 Allowed 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.053 1.426 . . . . 5.5499999999999998 109.903 170.792 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -66.78 161.99 22.46 Favored 'General case' 0 C--O 1.246 0.889 0 C-N-CA 124.772 1.229 . . . . 4.9800000000000004 113.421 -176.482 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.42 -134.55 51.75 Favored Glycine 0 C--N 1.341 0.816 0 C-N-CA 125.266 1.412 . . . . 2.27 111.925 163.759 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.0 t -69.23 151.38 46.37 Favored 'General case' 0 C--O 1.251 1.159 0 CA-C-O 123.26 1.505 . . . . 3.6600000000000001 112.262 163.359 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -73.26 -22.2 60.45 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.989 0.916 . . . . 6.5199999999999996 112.958 171.174 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 28.8 tp -83.55 -11.18 57.71 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.307 1.043 . . . . 4.8799999999999999 112.65 175.748 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.0 p -115.59 154.33 29.61 Favored 'General case' 0 C--O 1.246 0.873 0 C-N-CA 125.981 1.712 . . . . 2.25 112.118 -177.367 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . 0.316 0.3 OUTLIER -121.6 108.18 13.27 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.862 1.06 . . . . 2.8999999999999999 113.862 166.582 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.0 t -71.77 174.16 7.23 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 124.661 1.184 . . . . 3.2999999999999998 113.993 174.336 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.432 HH21 ' CG ' ' A' ' 53' ' ' ASP . 19.1 ttt-85 -66.33 8.95 0.18 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 115.75 1.759 . . . . 5.29 115.75 -170.181 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.06 -37.92 2.89 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 119.979 -1.7 . . . . 6.1900000000000004 112.381 166.279 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -52.67 -54.55 31.95 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.434 1.016 . . . . 1.54 111.007 165.834 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 22.0 tp -74.66 -32.55 62.28 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.54 0.736 . . . . 3.3700000000000001 112.476 -176.423 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -51.92 -47.85 64.46 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.631 0.651 . . . . 4.2800000000000002 111.119 171.519 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.473 ' HG3' ' HE2' ' A' ' 40' ' ' LYS . 13.1 tp10 -91.64 4.06 53.58 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.08 1.141 . . . . 4.8099999999999996 114.08 -175.222 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 tt -78.49 -61.93 1.85 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.452 1.101 . . . . 3.0899999999999999 108.849 154.661 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.8 mt -51.32 -44.61 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 125.095 1.358 . . . . 1.95 110.65 -178.214 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.02 -20.01 64.91 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.838 1.051 . . . . 4.8600000000000003 113.838 -177.007 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.473 ' HE2' ' HG3' ' A' ' 36' ' ' GLU . 43.2 mttm -102.36 -38.71 7.49 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 124.883 1.273 . . . . 3.48 112.336 179.508 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -58.9 -77.56 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 128.958 2.903 . . . . 4.7300000000000004 109.464 171.29 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.5 mt -81.04 48.2 1.09 Allowed 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.569 -1.332 . . . . 3.6400000000000001 112.798 -179.265 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.37 14.04 0.08 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 125.19 1.396 . . . . 4.0099999999999998 114.485 176.794 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -122.69 -3.15 8.77 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.181 2.192 . . . . 4.5599999999999996 114.436 -178.045 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -114.75 -178.99 18.85 Favored Glycine 0 N--CA 1.473 1.154 0 C-N-CA 124.867 1.223 . . . . 4.6699999999999999 114.208 -177.694 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -71.67 34.12 0.06 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 127.906 2.482 . . . . 6.3600000000000003 113.897 -176.359 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -81.46 53.98 2.22 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.668 2.387 . . . . 2.5699999999999998 115.821 -153.478 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.6 tttt -81.85 166.64 19.78 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 128.282 2.633 . . . . 7.1799999999999997 111.259 -179.899 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -45.79 -53.39 9.65 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.31 1.044 . . . . 5.71 113.332 -174.111 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.7 m -70.88 -31.15 67.73 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 113.923 1.082 . . . . 3.2000000000000002 113.923 178.819 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.2 m -65.16 -20.46 66.46 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.908 0.883 . . . . 3.29 112.225 171.531 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 59.1 mt -93.8 -30.67 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 126.288 1.835 . . . . 2.0499999999999998 111.314 174.043 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.432 ' CG ' HH21 ' A' ' 31' ' ' ARG . 5.6 t0 -70.45 -43.54 69.66 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.505 1.122 . . . . 3.1099999999999999 112.316 -178.233 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.409 ' CG ' ' HZ3' ' A' ' 57' ' ' LYS . 12.1 t70 -69.11 -31.92 70.96 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.141 -0.974 . . . . 3.4500000000000002 111.502 174.431 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.71 -54.66 42.58 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.395 1.078 . . . . 3.6299999999999999 109.482 172.03 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.5 mmm -52.33 -41.14 62.75 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 127.257 2.223 . . . . 3.5499999999999998 112.038 174.403 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.409 ' HZ3' ' CG ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -67.25 -26.94 66.82 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.561 1.545 . . . . 5.4400000000000004 113.043 177.639 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.6 t -92.69 -20.53 20.72 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.346 -1.471 . . . . 3.77 113.272 171.97 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.3 -42.37 93.14 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 127.759 2.424 . . . . 4.1299999999999999 111.682 172.159 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -87.2 154.86 20.39 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 115.148 1.536 . . . . 1.96 115.148 -177.051 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -125.76 10.99 7.79 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 126.074 1.75 . . . . 3.8900000000000001 113.805 177.408 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -137.37 -34.94 0.69 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 116.064 1.876 . . . . 2.6299999999999999 116.064 -162.563 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 75.07 26.95 1.18 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.701 1.601 . . . . 3.98 111.551 -161.825 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 39.1 p-10 -93.73 -16.88 23.78 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.482 1.513 . . . . 2.3300000000000001 112.64 -169.84 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 68.78 -0.09 2.49 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.659 2.383 . . . . 5.0099999999999998 115.59 -178.333 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -101.25 140.85 34.98 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 122.244 1.021 . . . . 2.75 110.035 160.546 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 48.6 mm -100.25 113.5 36.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 106.622 -1.622 . . . . 2.3599999999999999 106.622 164.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.66 161.05 28.85 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.903 1.281 . . . . 2.5699999999999998 111.465 172.701 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -58.38 -26.69 63.49 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 115.008 1.485 . . . . 3.7799999999999998 115.008 -176.272 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.2 mtmm -79.82 -32.54 40.68 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.755 -1.215 . . . . 4.8700000000000001 112.397 173.222 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -60.67 -46.97 88.32 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 109.319 -0.623 . . . . 1.8999999999999999 109.319 168.94 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -58.28 -32.41 68.39 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.189 1.796 . . . . 3.77 113.856 173.281 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.3 m -61.21 -29.84 70.06 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 119.603 -1.936 . . . . 3.0 113.178 168.127 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 43.1 t -73.85 -36.07 44.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 O-C-N 121.127 -0.983 . . . . 3.9900000000000002 110.881 175.926 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -61.94 -51.44 68.09 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 118.911 0.778 . . . . 3.0600000000000001 112.853 170.842 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.4 mt -59.3 -33.29 70.92 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.467 0.707 . . . . 2.96 111.578 174.95 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 92.7 m -60.52 -47.48 85.98 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 118.231 -0.89 . . . . 2.0600000000000001 111.346 168.919 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 16.1 mtm -58.08 -44.51 87.62 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 120.118 1.326 . . . . 2.6200000000000001 112.022 177.441 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.0 mt -71.21 -43.63 66.98 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.546 0.612 . . . . 2.6000000000000001 112.632 -179.189 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 9.9 t -66.09 -26.37 67.44 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.294 -0.878 . . . . 2.4399999999999999 112.852 175.462 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 76.7 mtp -72.45 -40.11 67.28 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.306 -0.871 . . . . 2.5499999999999998 112.472 166.03 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.17 -38.5 89.27 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.571 1.078 . . . . 2.52 112.757 -178.963 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -65.11 -24.07 67.33 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.839 1.052 . . . . 3.5800000000000001 113.839 171.648 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -70.92 -44.11 66.86 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.3 0.954 . . . . 4.1399999999999997 112.864 179.009 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -60.22 -47.32 86.46 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.766 1.227 . . . . 3.1400000000000001 110.66 170.959 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -50.84 -40.84 56.92 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.907 1.283 . . . . 4.0800000000000001 112.672 176.919 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -70.61 -30.78 67.53 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.001 1.321 . . . . 3.2599999999999998 112.966 179.304 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 60.2 mt -78.55 -20.6 50.3 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.21 1.004 . . . . 2.3199999999999998 112.278 176.612 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.503 ' CD ' ' HZ3' ' A' ' 92' ' ' LYS . 59.3 mm-40 -90.01 -6.67 55.34 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.553 1.316 . . . . 3.79 114.553 174.487 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -100.11 -54.22 2.94 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.359 1.863 . . . . 2.8100000000000001 112.946 178.63 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.03 45.96 0.56 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.155 1.782 . . . . 2.8500000000000001 112.758 -177.096 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.503 ' HZ3' ' CD ' ' A' ' 89' ' ' GLU . 52.0 mmtt . . . . . 0 C--O 1.252 1.237 0 C-N-CA 128.25 2.62 . . . . 3.8700000000000001 114.98 173.064 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 107.987 -1.116 . . . . 6.8799999999999999 107.987 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 10.1 mp0 -104.51 -67.37 0.91 Allowed 'General case' 0 CA--C 1.538 0.501 0 O-C-N 124.93 1.394 . . . . 4.7699999999999996 112.677 -148.597 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 1.3 t -162.58 149.86 11.22 Favored Pre-proline 0 N--CA 1.473 0.691 0 C-N-CA 124.315 1.046 . . . . 3.6200000000000001 110.727 -166.334 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -62.54 -18.84 65.63 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 122.961 2.441 . . . . 1.5 114.089 175.869 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.7 -54.65 6.36 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.93 1.241 . . . . 3.6899999999999999 111.169 179.49 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -62.88 -30.97 71.92 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.931 0.787 . . . . 4.7599999999999998 110.657 174.482 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -62.98 -45.78 90.81 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 119.927 -1.733 . . . . 8.7799999999999994 111.471 166.512 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.5 -50.62 73.1 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.426 1.09 . . . . 1.6699999999999999 111.1 177.566 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 70.5 mt -56.99 -47.04 81.74 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.493 1.117 . . . . 2.4100000000000001 111.704 172.696 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 96.9 m -56.53 -44.38 80.76 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.488 0.715 . . . . 2.6499999999999999 111.362 175.222 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 91.8 m -63.69 -44.56 93.32 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.406 1.482 . . . . 2.1699999999999999 109.842 179.336 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 79.7 mtp -57.13 -51.36 69.62 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.561 0.744 . . . . 3.7000000000000002 110.617 174.376 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 53.2 t -63.39 -30.45 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 N-CA-C 113.367 0.877 . . . . 2.8100000000000001 113.367 176.422 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 82.4 m -62.79 -52.6 62.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.877 1.271 . . . . 1.8300000000000001 110.246 174.717 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -31.78 69.37 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 118.545 -0.741 . . . . 2.23 111.311 169.636 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -69.06 -58.41 4.13 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 118.642 0.655 . . . . 3.5099999999999998 111.942 -175.398 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 6.5 m170 -73.53 -12.31 60.73 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 120.307 1.412 . . . . 2.73 114.281 177.287 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -67.51 -66.92 0.5 Allowed 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.247 -0.908 . . . . 4.96 111.626 157.702 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -70.93 -32.53 69.46 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.73 1.011 . . . . 3.27 113.73 -172.517 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 8.2 p -65.1 -18.32 65.2 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 120.477 -1.389 . . . . 2.4100000000000001 112.225 169.301 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.64 9.25 77.45 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 126.048 1.785 . . . . 1.74 114.777 171.058 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -72.72 -24.22 60.96 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.597 1.698 . . . . 4.7800000000000002 112.304 174.262 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.435 ' CD ' ' HZ1' ' B' ' 32' ' ' LYS . 31.0 tt0 -161.4 152.67 18.67 Favored 'General case' 0 C--O 1.252 1.214 0 C-N-CA 125.415 1.486 . . . . 3.3399999999999999 111.91 179.494 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.84 -131.34 52.0 Favored Glycine 0 C--N 1.339 0.697 0 C-N-CA 126.013 1.768 . . . . 2.79 111.061 168.018 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.5 m -57.65 125.49 23.16 Favored 'General case' 0 C--O 1.248 1.025 0 O-C-N 122.139 -0.624 . . . . 3.7400000000000002 110.246 166.34 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -74.83 66.86 1.56 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.997 2.119 . . . . 8.9700000000000006 109.667 158.226 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 63.8 tp -167.97 -53.88 0.02 OUTLIER 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 127.526 2.33 . . . . 3.6099999999999999 107.728 -176.54 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 60.7 p -94.84 158.1 15.64 Favored 'General case' 0 C--O 1.252 1.196 0 C-N-CA 125.752 1.621 . . . . 2.29 112.911 176.429 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -103.82 116.8 32.95 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 127.05 2.14 . . . . 3.8799999999999999 109.701 169.112 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 3.0 p -74.34 165.98 24.26 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.141 0.576 . . . . 3.2799999999999998 111.602 164.674 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 15.8 tpp180 -41.49 -33.01 0.38 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.517 1.927 . . . . 5.5499999999999998 113.778 167.98 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.435 ' HZ1' ' CD ' ' B' ' 23' ' ' GLU . 0.0 OUTLIER -89.61 -40.11 12.81 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 120.698 -1.251 . . . . 5.1500000000000004 113.753 -179.353 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -56.84 -44.08 81.75 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.45 0.643 . . . . 2.02 110.457 170.564 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 tp -66.75 -44.31 81.81 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.35 1.06 . . . . 3.02 112.138 -179.498 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -57.38 -37.25 72.36 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.804 1.242 . . . . 3.6600000000000001 113.175 178.631 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -62.96 -65.76 0.64 Allowed 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 117.839 -1.077 . . . . 3.75 111.087 168.831 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 tp -48.06 -57.31 5.98 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 127.779 2.432 . . . . 3.1299999999999999 112.024 -175.107 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 34.9 mt -56.17 -56.87 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.065 0.848 . . . . 2.5299999999999998 110.135 -177.395 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -24.02 66.13 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.632 0.773 . . . . 6.2599999999999998 112.446 -174.111 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.95 -31.84 12.89 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.092 1.757 . . . . 7.2199999999999998 112.835 -173.586 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.6 mm-40 -97.04 -21.22 17.51 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 119.407 1.003 . . . . 5.25 112.712 176.924 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -113.31 118.27 34.15 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 119.712 1.142 . . . . 3.0099999999999998 108.488 171.755 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 15.7 p -139.55 10.73 2.49 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.756 1.222 . . . . 3.4100000000000001 113.623 -175.103 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -68.92 -42.9 76.18 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.615 1.566 . . . . 3.7599999999999998 111.088 -177.265 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -96.88 165.4 23.13 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 110.211 -1.156 . . . . 3.8199999999999998 110.211 156.475 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.424 ' O ' ' HE2' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -66.91 96.88 0.45 Allowed 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.899 -1.149 . . . . 6.5700000000000003 107.899 165.891 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 8.0 tpt -72.27 75.93 0.99 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.396 1.879 . . . . 3.3100000000000001 112.263 -168.088 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' B' ' 46' ' ' GLU . 0.0 OUTLIER -83.49 163.73 20.29 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.731 1.613 . . . . 5.0199999999999996 114.45 -161.669 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -47.82 -59.95 2.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.775 1.63 . . . . 5.0 112.057 177.839 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 13.1 m -71.77 6.09 2.17 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 115.179 1.548 . . . . 3.1400000000000001 115.179 178.973 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 34.3 p -119.83 16.73 12.67 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.768 -1.208 . . . . 3.3900000000000001 112.554 163.708 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 35.1 mt -110.42 -47.64 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.018 0.927 . . . . 2.7200000000000002 111.976 171.691 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -71.89 -30.43 65.38 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.996 1.271 . . . . 3.0699999999999998 113.255 -173.386 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.447 ' CG ' ' HZ1' ' B' ' 57' ' ' LYS . 12.2 t70 -65.52 -37.05 85.64 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.924 0.784 . . . . 2.4199999999999999 111.5 167.56 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 10.0 tt -60.93 -43.54 98.49 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 117.73 -1.129 . . . . 3.73 110.097 176.092 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 6.3 ttt -59.34 -50.55 73.55 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 120.099 1.318 . . . . 2.9900000000000002 113.276 170.632 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . 0.447 ' HZ1' ' CG ' ' B' ' 54' ' ' ASP . 2.0 tmtt? -52.49 -33.32 44.25 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.71 1.204 . . . . 4.9800000000000004 112.195 173.272 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 63.3 m -86.58 -22.94 25.98 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.758 1.623 . . . . 3.0800000000000001 113.532 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 9.5 mt -70.16 -42.18 72.84 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 120.159 1.345 . . . . 2.98 110.877 169.386 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.71 141.53 43.58 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.235 1.414 . . . . 3.1299999999999999 113.093 -179.929 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 33.9 mmtm -124.21 -1.06 8.23 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.69 1.196 . . . . 4.1200000000000001 113.066 172.432 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 31.4 p-10 -113.47 -48.84 2.92 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.642 1.977 . . . . 3.0 111.125 167.345 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 5.0 t 94.62 111.12 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 129.399 3.08 . . . . 2.77 107.879 -167.29 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 p30 -155.69 -135.46 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 122.037 0.922 . . . . 3.0800000000000001 109.0 -173.475 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -140.58 5.63 2.02 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 114.544 1.313 . . . . 5.2999999999999998 114.544 175.856 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -132.32 136.89 47.19 Favored 'General case' 0 C--O 1.246 0.898 0 C-N-CA 127.393 2.277 . . . . 3.5099999999999998 111.998 -174.306 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 31.8 mm -108.71 122.27 63.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 126.08 1.752 . . . . 2.3900000000000001 108.456 169.186 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -98.44 -174.48 2.83 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.594 1.957 . . . . 3.0699999999999998 110.994 169.239 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -25.11 65.31 Favored 'General case' 0 CA--C 1.551 0.985 0 O-C-N 120.456 -1.402 . . . . 4.0899999999999999 114.374 177.456 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -71.65 -46.68 58.26 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.436 -1.415 . . . . 6.96 112.079 174.137 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -63.11 -48.73 77.31 Favored 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 118.829 0.741 . . . . 1.77 110.177 171.329 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -59.48 -23.43 62.74 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 120.029 -1.669 . . . . 3.0099999999999998 114.33 -179.33 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 41.4 t -53.01 -35.18 59.12 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.612 -1.305 . . . . 2.77 111.904 167.887 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 59.7 t -64.63 -40.54 89.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 CA-C-N 119.181 0.9 . . . . 2.8500000000000001 111.357 178.383 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -62.94 -50.98 68.67 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.881 0.873 . . . . 2.6400000000000001 111.26 176.867 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.9 -43.81 98.02 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.167 0.987 . . . . 2.6699999999999999 110.961 178.546 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 95.0 m -60.93 -52.12 66.37 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.909 1.284 . . . . 2.02 112.07 177.841 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 30.6 ttp -61.06 -41.16 96.09 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.097 0.959 . . . . 3.5299999999999998 111.93 -175.22 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 98.0 mt -72.45 -45.3 60.2 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 123.796 0.838 . . . . 2.8799999999999999 112.219 175.784 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.4 t -67.19 -28.46 68.11 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.111 0.869 . . . . 2.6699999999999999 112.998 -177.99 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -50.01 71.48 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.013 0.824 . . . . 4.4199999999999999 111.338 166.63 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.9 -30.56 70.24 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.742 0.701 . . . . 1.99 112.865 -178.71 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -74.64 -24.73 58.88 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.768 1.025 . . . . 3.5099999999999998 113.768 172.282 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -78.59 -42.26 29.54 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.069 0.948 . . . . 3.4700000000000002 111.537 172.725 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -60.8 -35.89 77.62 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.664 0.786 . . . . 3.8100000000000001 110.703 171.589 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -57.24 -46.33 83.09 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.185 0.994 . . . . 4.2800000000000002 112.203 171.527 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -65.5 -34.95 79.47 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.503 1.121 . . . . 3.5099999999999998 112.217 -179.057 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 98.0 mt -69.58 -30.98 68.87 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.776 0.83 . . . . 2.71 112.816 175.749 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.407 ' CD ' ' HZ3' ' B' ' 92' ' ' LYS . 46.8 mm-40 -89.31 -6.44 56.71 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 114.498 1.295 . . . . 4.5199999999999996 114.498 178.656 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -93.54 -50.01 5.62 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.395 1.478 . . . . 3.0800000000000001 112.142 170.852 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.73 44.26 0.72 Allowed 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 123.09 1.424 . . . . 2.79 112.963 -178.303 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . 0.407 ' HZ3' ' CD ' ' B' ' 89' ' ' GLU . 28.8 mmtm . . . . . 0 C--O 1.25 1.116 0 C-N-CA 129.7 3.2 . . . . 4.79 115.234 171.399 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.9 mmt . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 108.424 -0.954 . . . . 6.4299999999999997 108.424 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 -116.2 -104.24 0.41 Allowed 'General case' 0 CA--C 1.539 0.532 0 O-C-N 125.506 1.754 . . . . 4.1399999999999997 107.844 -159.183 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 46.3 p -120.21 174.75 2.69 Favored Pre-proline 0 N--CA 1.469 0.522 0 C-N-CA 124.052 0.941 . . . . 2.3500000000000001 113.372 -153.703 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -75.11 -29.52 7.97 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 121.659 1.572 . . . . 2.21 111.485 159.222 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.0 tp -77.17 -53.77 7.34 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.318 0.963 . . . . 4.1500000000000004 113.064 -170.816 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -71.03 -26.82 63.27 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.876 1.217 . . . . 5.6200000000000001 111.068 -177.874 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -60.58 -40.99 93.75 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.122 -0.986 . . . . 5.5 111.67 164.38 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.97 -31.11 61.38 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.048 0.939 . . . . 2.0299999999999998 112.148 176.421 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.5 mt -66.36 -42.57 87.85 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.012 1.278 . . . . 2.5099999999999998 111.587 168.018 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 91.5 m -60.4 -43.35 96.74 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 121.341 -0.849 . . . . 2.3999999999999999 110.692 172.872 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 51.2 m -60.91 -38.4 85.62 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.205 1.002 . . . . 2.4700000000000002 111.158 172.065 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 43.1 ttm -62.85 -49.82 73.36 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.56 -1.21 . . . . 4.1699999999999999 111.952 175.764 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.3 m -66.36 -22.4 30.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 CA-C-N 120.804 1.638 . . . . 3.5499999999999998 113.317 174.938 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 60.2 m -67.75 -54.74 16.83 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 117.608 -1.187 . . . . 1.8700000000000001 109.72 173.069 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -52.99 -36.55 60.51 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-N 119.2 0.909 . . . . 3.1000000000000001 111.221 168.753 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -64.42 -44.79 90.12 Favored 'General case' 0 C--O 1.219 -0.503 0 O-C-N 123.849 0.718 . . . . 2.8199999999999998 111.3 -175.173 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -75.22 -37.28 61.17 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.999 1.272 . . . . 2.3399999999999999 112.895 173.375 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.436 ' HZ3' ' CD ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -59.17 -15.99 17.72 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.121 1.768 . . . . 6.7999999999999998 113.683 175.607 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -121.66 -20.18 6.58 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 116.718 2.118 . . . . 3.5899999999999999 116.718 162.966 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.7 t -71.44 -23.66 61.88 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 122.462 2.392 . . . . 2.5600000000000001 112.478 172.743 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.8 0.77 89.4 Favored Glycine 0 CA--C 1.535 1.31 0 CA-C-O 118.192 -1.338 . . . . 1.8999999999999999 114.062 166.103 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.4 tpt85 -62.84 -22.86 66.98 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 119.898 1.849 . . . . 6.5300000000000002 112.76 177.525 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -164.03 148.61 10.19 Favored 'General case' 0 C--O 1.252 1.218 0 C-N-CA 127.483 2.313 . . . . 5.0099999999999998 110.447 168.182 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 43.35 -126.55 5.33 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 126.573 2.035 . . . . 3.7200000000000002 114.772 163.185 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.5 m -44.68 137.65 3.79 Favored 'General case' 0 C--O 1.245 0.853 0 C-N-CA 126.686 1.994 . . . . 3.2000000000000002 114.149 178.557 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -110.5 -11.59 14.46 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 127.018 2.127 . . . . 4.8600000000000003 115.586 -163.011 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 28.2 tp -95.89 0.02 51.5 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.095 0.958 . . . . 4.7599999999999998 111.066 170.259 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.3 p -142.68 156.38 45.03 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 126.14 1.776 . . . . 1.8500000000000001 113.99 -162.174 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.9 mt -111.34 104.58 13.05 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.703 1.201 . . . . 2.4399999999999999 109.145 171.129 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.1 t -66.25 152.4 44.99 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.4 -0.813 . . . . 2.4500000000000002 110.683 168.044 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.7 ttp180 -42.51 -29.86 0.31 Allowed 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.926 2.09 . . . . 6.3099999999999996 115.693 -175.377 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -83.38 -33.17 25.85 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 116.592 2.071 . . . . 8.2300000000000004 116.592 171.479 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -60.81 -43.31 98.37 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.011 0.925 . . . . 1.98 109.948 165.874 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.9 tp -66.94 -45.14 78.72 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.669 0.788 . . . . 3.2000000000000002 112.656 -174.703 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -50.3 -47.29 55.66 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.383 0.992 . . . . 4.1399999999999997 111.44 174.757 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -70.89 -46.0 63.36 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 118.441 -0.79 . . . . 3.0499999999999998 111.615 -174.017 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.4 tp -55.47 -52.84 62.3 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.859 1.264 . . . . 3.3999999999999999 112.352 179.824 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 51.3 mt -54.05 -57.57 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 107.866 -1.161 . . . . 1.8600000000000001 107.866 -178.866 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.16 -16.7 60.5 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.883 1.068 . . . . 4.8099999999999996 113.883 -171.27 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.2 mmtp -81.99 -47.93 12.07 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.984 1.314 . . . . 4.0700000000000003 112.208 177.553 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.436 ' CD ' ' HZ3' ' A' ' 18' ' ' LYS . 11.0 mm-40 -101.98 15.23 29.69 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.604 1.162 . . . . 6.04 111.696 -172.23 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -164.83 122.11 1.59 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.217 2.207 . . . . 3.75 111.643 173.698 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 48.8 t -71.39 -53.69 13.25 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 114.045 1.128 . . . . 4.7300000000000004 114.045 -179.188 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 61.99 -56.52 0.13 Allowed 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 128.778 2.831 . . . . 6.6699999999999999 113.973 -170.993 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 161.42 26.45 0.02 OUTLIER Glycine 0 CA--C 1.536 1.369 1 C-N-CA 130.818 4.056 . . . . 3.5899999999999999 110.427 -174.355 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 65.09 132.79 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 128.706 2.802 . . . . 9.4299999999999997 111.458 -157.328 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 41.8 mmm -88.24 129.29 35.4 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.892 0.853 . . . . 3.5899999999999999 110.335 174.797 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -112.85 159.19 19.28 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.241 1.017 . . . . 4.7300000000000004 110.463 178.417 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -45.2 -46.29 12.17 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 114.673 1.36 . . . . 5.1900000000000004 114.673 -169.928 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -61.46 -7.29 2.96 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 115.588 1.699 . . . . 4.4299999999999997 115.588 179.884 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.3 m -115.44 -12.11 11.75 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.584 1.084 . . . . 3.0899999999999999 113.139 171.935 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 74.7 mt -84.39 -44.72 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 O-C-N 120.692 -1.255 . . . . 3.8300000000000001 112.287 -171.347 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -74.94 -12.68 60.41 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.237 0.458 . . . . 4.2599999999999998 112.237 176.742 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.449 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 1.0 OUTLIER -91.0 -28.75 17.79 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.43 1.092 . . . . 2.6200000000000001 113.383 169.375 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.0 -47.27 81.24 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.573 -0.704 . . . . 3.2799999999999998 109.654 156.925 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 6.4 tpt -56.35 -49.05 75.49 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.659 0.784 . . . . 2.8100000000000001 110.712 176.224 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.449 ' HE2' ' HA ' ' A' ' 54' ' ' ASP . 14.8 mtmm -60.05 -39.12 84.86 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.587 1.085 . . . . 5.1699999999999999 112.916 174.37 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 73.0 m -67.32 -25.04 65.82 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.091 0.774 . . . . 2.3199999999999998 113.091 175.575 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -86.67 -40.85 14.71 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.055 1.342 . . . . 3.8599999999999999 113.631 172.069 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -88.73 64.3 7.25 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 114.606 1.336 . . . . 1.9099999999999999 114.606 -156.378 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -47.6 -44.85 26.91 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.568 1.547 . . . . 4.0 114.28 -176.258 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . 0.281 0.4 OUTLIER -84.03 2.93 36.8 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 114.008 1.114 . . . . 3.4500000000000002 114.008 -175.159 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 69.2 m 60.14 79.68 0.23 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 127.659 2.384 . . . . 5.0899999999999999 113.253 168.998 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -158.3 -114.8 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.652 -0.655 . . . . 2.7799999999999998 110.153 -155.105 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -155.4 -10.58 0.12 Allowed 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 116.424 2.009 . . . . 5.3600000000000003 116.424 176.816 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -127.35 146.14 50.56 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.227 1.811 . . . . 2.4300000000000002 109.412 -173.467 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 9.4 mm -106.54 98.44 6.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 125.801 1.641 . . . . 2.1800000000000002 110.205 176.136 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -67.76 158.08 33.23 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.557 1.143 . . . . 3.2799999999999998 111.973 168.543 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -52.64 -31.38 36.52 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.216 1.561 . . . . 3.98 115.216 -176.533 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.2 -35.4 59.11 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 120.669 -1.269 . . . . 5.0199999999999996 112.581 175.309 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -62.55 -47.86 82.03 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.118 0.567 . . . . 1.72 109.532 166.433 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -60.8 -39.67 89.77 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 127.451 2.3 . . . . 3.8300000000000001 115.219 -170.758 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 38.9 m -53.62 -25.56 18.17 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.629 1.171 . . . . 2.7599999999999998 114.117 -171.29 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.7 m -69.59 -25.6 29.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 O-C-N 121.017 -1.052 . . . . 3.9399999999999999 113.548 178.351 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -62.88 -56.97 12.61 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.519 1.054 . . . . 3.54 110.866 -177.82 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.6 mt -65.41 -29.06 69.71 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 118.583 -0.723 . . . . 3.3199999999999998 112.009 176.115 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 66.6 m -60.72 -52.22 66.05 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.792 0.837 . . . . 2.0499999999999998 110.94 170.85 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 77.5 mtm -60.12 -41.69 93.16 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.557 0.743 . . . . 2.6600000000000001 111.65 177.088 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 77.2 mt -67.48 -41.59 84.35 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 118.582 -0.723 . . . . 2.3199999999999998 112.589 179.4 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 3.7 t -69.66 -28.13 65.62 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.735 1.152 . . . . 2.8199999999999998 113.053 175.329 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 27.2 mtp -65.52 -42.53 91.9 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.295 -0.878 . . . . 3.3399999999999999 112.515 165.896 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.04 -33.94 76.88 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 120.009 1.277 . . . . 1.6599999999999999 113.031 175.962 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -64.58 -24.16 67.5 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.221 -0.925 . . . . 3.8700000000000001 112.8 171.459 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.441 ' ND2' ' HD1' ' B' ' 17' ' ' HIS . 2.0 t-20 -75.51 -35.76 60.7 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.279 -0.888 . . . . 3.8999999999999999 113.0 178.379 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -62.37 -44.66 95.95 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.604 1.162 . . . . 3.9900000000000002 110.839 171.558 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.64 -50.75 62.52 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.048 1.339 . . . . 3.9700000000000002 111.728 171.673 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -62.78 -33.57 75.46 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.161 0.984 . . . . 3.5499999999999998 111.935 178.711 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 42.6 mt -69.63 -18.61 63.61 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 117.507 -1.235 . . . . 2.4500000000000002 113.308 178.297 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -91.24 -17.2 26.4 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 114.917 1.451 . . . . 2.7400000000000002 114.917 171.622 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -93.73 -43.55 8.58 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.663 1.185 . . . . 3.6400000000000001 112.835 -176.13 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.77 8.11 2.13 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 116.828 2.158 . . . . 6.2599999999999998 116.828 -179.424 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 74.5 tttt . . . . . 0 C--O 1.249 1.028 0 C-N-CA 129.869 3.267 . . . . 4.3300000000000001 116.314 -148.299 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.9 tmm? . . . . . 0 N--CA 1.479 0.989 0 CA-C-O 115.832 -2.032 . . . . 7.3899999999999997 105.751 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 72.51 -142.86 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 120.104 1.32 . . . . 6.3600000000000003 111.799 131.576 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 58.7 p -105.49 167.27 9.98 Favored Pre-proline 0 N--CA 1.471 0.612 0 C-N-CA 125.41 1.484 . . . . 2.3799999999999999 112.24 -166.488 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -62.56 -16.33 51.69 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 122.323 2.015 . . . . 1.8200000000000001 113.039 165.69 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -80.72 -32.04 35.89 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 117.516 -1.231 . . . . 3.2599999999999998 111.911 173.274 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -50.41 -46.07 56.07 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.194 0.906 . . . . 6.1200000000000001 109.118 159.675 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . 0.466 ' HA ' ' CE ' ' B' ' 7' ' ' LYS . 0.2 OUTLIER -77.67 -25.34 49.48 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 114.707 1.373 . . . . 4.9800000000000004 114.707 -177.544 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.38 -46.28 56.02 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.859 0.754 . . . . 1.8899999999999999 110.959 171.157 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 79.7 mt -68.86 -37.62 79.22 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.248 1.019 . . . . 2.75 111.834 175.568 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 97.2 m -54.22 -56.54 17.27 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 117.831 -1.08 . . . . 3.4300000000000002 108.657 167.098 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 43.9 m -53.18 -49.73 66.06 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.319 0.963 . . . . 2.48 110.527 -179.13 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 37.2 ttm -62.42 -46.17 89.78 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.666 0.786 . . . . 3.9399999999999999 112.556 -178.146 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 1.8 p -70.25 -26.46 29.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.871 1.214 . . . . 3.9500000000000002 112.691 175.685 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 65.6 m -70.82 -46.03 63.49 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.373 1.469 . . . . 2.3399999999999999 111.736 -177.898 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -64.79 -43.16 94.12 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.86 0.864 . . . . 2.0499999999999998 109.459 169.189 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 29.7 t80 -66.55 -49.75 65.43 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 120.081 -0.648 . . . . 3.4300000000000002 111.417 -168.671 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . 0.441 ' HD1' ' ND2' ' A' ' 84' ' ' ASN . 0.1 OUTLIER -67.94 -3.6 10.4 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 120.689 -1.257 . . . . 2.4700000000000002 114.337 178.086 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.63 -57.9 2.08 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.026 -1.046 . . . . 5.5700000000000003 110.806 171.291 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -61.97 -34.1 75.52 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.303 -0.873 . . . . 2.9500000000000002 112.717 177.056 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 67.5 m -70.02 -11.99 61.28 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.58 -1.325 . . . . 2.3599999999999999 114.121 171.645 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -94.11 -4.04 63.25 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 125.187 1.375 . . . . 1.3300000000000001 114.451 166.349 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 36.5 tpt85 -64.5 -23.48 67.29 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.138 1.469 . . . . 4.9100000000000001 112.502 176.941 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -151.59 175.52 12.25 Favored 'General case' 0 C--O 1.246 0.879 0 C-N-CA 127.225 2.21 . . . . 4.5700000000000003 108.658 172.08 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -41.31 153.8 0.1 OUTLIER Glycine 0 N--CA 1.474 1.176 0 C-N-CA 126.688 2.089 . . . . 3.46 115.122 -174.022 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 16.3 m 63.26 122.78 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.205 1.402 . . . . 4.0899999999999999 112.613 -179.358 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 23.2 mtpt -81.25 -25.39 36.65 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 114.819 1.414 . . . . 8.0999999999999996 114.819 -175.063 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -94.02 6.47 48.42 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.195 0.998 . . . . 4.5499999999999998 113.513 -173.882 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 19.0 p -144.63 154.39 42.76 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 127.159 2.184 . . . . 2.75 111.849 -166.929 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 77.1 mt -107.0 108.54 20.1 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.224 1.41 . . . . 2.77 109.722 167.686 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.42 160.9 4.86 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 120.156 -1.59 . . . . 2.3399999999999999 111.228 161.484 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -43.98 -35.21 1.96 Allowed 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.441 1.097 . . . . 4.3600000000000003 113.921 176.488 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.97 -40.5 39.09 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.245 1.018 . . . . 6.3300000000000001 113.331 178.623 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -59.17 -42.48 90.91 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.084 0.954 . . . . 2.2400000000000002 109.76 173.282 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tp -66.33 -47.02 74.84 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.265 -0.874 . . . . 2.9300000000000002 111.839 176.032 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -54.73 -54.21 44.88 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 120.354 1.434 . . . . 3.8999999999999999 112.045 176.994 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.402 ' HG3' ' HE3' ' B' ' 40' ' ' LYS . 4.8 tp10 -41.81 -62.61 0.87 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.262 1.425 . . . . 3.48 112.601 170.66 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 tp -48.93 -62.96 1.24 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.114 1.766 . . . . 3.3500000000000001 110.433 -177.871 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 22.3 mt -62.01 -38.01 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 109.546 -0.539 . . . . 2.1800000000000002 109.546 -171.942 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 51.2 mttm -58.12 -33.24 68.92 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.907 0.706 . . . . 5.8399999999999999 112.907 179.955 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . 0.402 ' HE3' ' HG3' ' B' ' 36' ' ' GLU . 14.2 mttt -82.97 -47.69 11.48 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 122.979 0.512 . . . . 5.8799999999999999 111.927 177.835 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -75.63 -55.71 5.4 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 124.335 1.022 . . . . 5.5300000000000002 111.014 -172.598 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -83.01 49.13 1.47 Allowed 'General case' 0 CA--C 1.546 0.814 0 O-C-N 119.679 -1.888 . . . . 3.6200000000000001 110.928 -177.899 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 15.4 t -75.92 16.62 0.39 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.617 1.967 . . . . 4.6100000000000003 114.573 -176.521 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.48 18.05 0.18 Allowed 'General case' 0 N--CA 1.478 0.955 0 O-C-N 120.084 -1.635 . . . . 5.0 115.093 -177.029 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.95 -40.93 1.45 Allowed Glycine 0 CA--C 1.534 1.245 0 C-N-CA 126.172 1.844 . . . . 4.96 114.72 -179.526 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.461 ' CD ' ' HZ2' ' B' ' 48' ' ' LYS . 41.7 tp10 -64.27 -22.61 67.01 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.177 1.391 . . . . 5.2699999999999996 113.985 -175.82 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 7.6 tpt -74.85 76.83 2.12 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.759 1.624 . . . . 2.79 112.509 -175.866 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.461 ' HZ2' ' CD ' ' B' ' 46' ' ' GLU . 20.2 mttm -62.74 120.73 11.81 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 120.786 -1.196 . . . . 4.8399999999999999 111.029 -170.548 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.67 -34.9 69.87 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.923 1.453 . . . . 4.1200000000000001 114.923 -156.934 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 3.0 m -87.93 -14.68 38.65 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.299 -0.876 . . . . 5.9500000000000002 112.388 -178.442 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 17.9 t -70.48 -10.26 58.71 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.479 -1.388 . . . . 3.2799999999999998 111.979 166.426 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 5.4 mm -65.35 -35.34 75.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 124.191 0.996 . . . . 2.4300000000000002 111.532 172.138 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.78 -39.4 69.97 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.148 0.885 . . . . 3.5 111.821 -176.633 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.29 -30.9 66.82 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.543 0.737 . . . . 4.2999999999999998 112.985 170.895 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 7.8 tt -65.13 -45.83 83.47 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.617 -0.706 . . . . 3.4900000000000002 110.664 166.917 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -56.56 -48.77 76.62 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.576 1.55 . . . . 2.75 111.257 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 35.8 mtpt -54.75 -32.79 60.35 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.549 1.54 . . . . 5.4299999999999997 113.782 171.592 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 50.7 m -82.51 -30.21 29.97 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.291 1.037 . . . . 3.2599999999999998 113.065 178.618 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 19.1 mt -73.66 -36.07 65.31 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.893 0.877 . . . . 2.9900000000000002 111.988 173.856 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -74.82 74.88 2.12 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 123.178 1.466 . . . . 1.8799999999999999 110.24 -177.892 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.2 tmtm? -61.33 -16.22 43.74 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 114.137 -1.392 . . . . 5.9800000000000004 113.863 -158.424 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 48.1 p-10 -105.89 -14.44 15.21 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 115.777 1.769 . . . . 4.2599999999999998 115.777 172.594 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 40.1 t 56.54 90.88 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.308 1.443 . . . . 4.3600000000000003 113.064 -162.341 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 11.3 p30 -123.91 -79.93 0.62 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.153 1.381 . . . . 3.21 109.864 176.48 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -168.74 -34.77 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 129.77 3.228 . . . . 8.2100000000000009 112.024 177.428 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -129.12 147.22 50.95 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 126.178 1.791 . . . . 2.5699999999999998 110.443 -167.349 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 75.2 mt -97.06 102.36 13.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 121.941 0.877 . . . . 2.6600000000000001 109.105 178.576 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -66.68 152.95 44.39 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.163 1.785 . . . . 3.1400000000000001 108.961 171.752 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -47.65 -41.85 23.14 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.062 1.345 . . . . 3.5299999999999998 113.57 -178.11 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.55 -8.37 59.12 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 115.612 1.708 . . . . 4.0899999999999999 115.612 177.031 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -83.28 -52.29 6.69 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 107.505 -1.295 . . . . 2.1099999999999999 107.505 160.528 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -52.98 -34.0 53.94 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.584 1.954 . . . . 4.2999999999999998 114.867 -174.765 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 79.6 p -63.07 -17.64 62.5 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 117.401 -1.285 . . . . 2.8999999999999999 113.992 174.695 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 92.6 t -56.71 -38.91 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-N 120.837 1.653 . . . . 2.3999999999999999 111.213 168.361 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -60.41 -54.23 48.06 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 118.634 0.652 . . . . 3.0 111.394 172.517 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 69.4 mt -62.8 -37.68 87.69 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 123.784 0.834 . . . . 2.54 110.768 -174.63 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 19.1 m -69.37 -43.35 73.75 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.634 1.574 . . . . 2.71 112.532 175.446 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 5.8 mmm -56.47 -46.11 80.57 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 120.191 1.359 . . . . 3.8700000000000001 111.801 173.101 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 97.3 mt -67.25 -50.72 59.5 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.43 0.692 . . . . 2.7000000000000002 111.365 175.949 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 2.0 t -66.45 -25.58 66.8 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.101 -0.999 . . . . 2.3700000000000001 113.131 -177.151 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 62.7 mtm -73.04 -37.34 66.92 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.156 -0.965 . . . . 4.1699999999999999 112.683 168.36 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.97 -33.87 76.3 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.164 0.893 . . . . 2.2200000000000002 112.049 170.929 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -70.68 -32.85 70.25 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 113.378 0.881 . . . . 3.3500000000000001 113.378 168.381 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -69.74 -42.99 73.21 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.28 0.945 . . . . 4.3300000000000001 112.087 179.845 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -58.04 -46.46 85.3 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.729 1.212 . . . . 3.0299999999999998 112.075 170.818 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.26 -50.67 64.34 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.879 1.272 . . . . 5.3399999999999999 111.424 175.615 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -66.67 -27.71 67.88 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.566 1.546 . . . . 3.6000000000000001 111.336 -177.695 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 34.1 mt -81.16 -9.53 59.78 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 125.414 1.485 . . . . 3.4700000000000002 114.488 177.757 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -87.76 -18.0 30.39 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 120.047 1.294 . . . . 5.5599999999999996 114.168 164.155 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -80.92 -52.92 6.92 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.108 0.963 . . . . 5.0499999999999998 110.821 164.406 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -98.46 28.13 4.34 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.297 1.839 . . . . 5.7999999999999998 113.11 -171.906 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.071 0 C-N-CA 128.272 2.629 . . . . 9.2899999999999991 114.445 -177.485 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.242 0.663 0 N-CA-C 106.39 -1.707 . . . . 3.9700000000000002 106.39 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.7 p -71.05 168.07 24.04 Favored Pre-proline 0 N--CA 1.478 0.94 0 C-N-CA 123.379 0.671 . . . . 1.76 112.805 -171.087 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -61.28 -20.82 69.73 Favored 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 122.484 2.123 . . . . 1.78 113.211 165.079 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.01 -41.59 42.11 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.637 1.175 . . . . 2.4100000000000001 111.327 173.132 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -61.08 -36.05 78.59 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.642 -1.286 . . . . 3.8599999999999999 110.741 169.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.9 mttp -69.97 -32.61 70.91 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.723 -1.236 . . . . 3.54 112.749 172.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.05 -53.07 55.71 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.261 1.025 . . . . 0.89000000000000001 111.091 170.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.4 mt -55.31 -43.18 74.64 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.35 1.46 . . . . 1.4399999999999999 111.729 173.095 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 95.7 m -59.14 -40.95 87.08 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 117.611 -1.185 . . . . 1.6100000000000001 111.678 173.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 29.0 m -66.13 -39.45 89.89 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.397 1.079 . . . . 1.25 110.756 176.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 61.1 mtp -64.19 -40.42 96.06 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.89 1.276 . . . . 3.1299999999999999 111.691 174.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.35 -33.19 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 123.493 0.717 . . . . 1.8999999999999999 112.291 167.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 94.0 m -71.15 -58.21 3.77 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 117.677 -1.154 . . . . 1.02 110.464 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.3 p -65.09 -31.49 72.73 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 118.164 -0.922 . . . . 2.0600000000000001 110.271 178.477 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -67.32 -64.56 0.83 Allowed 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 119.288 -0.965 . . . . 1.9399999999999999 110.508 176.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.47 -39.62 84.3 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 120.12 1.327 . . . . 2.2799999999999998 112.462 -176.243 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -60.1 -51.45 69.55 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.766 -1.209 . . . . 3.8799999999999999 112.345 176.183 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -78.24 -24.34 47.01 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.002 -1.061 . . . . 2.0499999999999998 112.185 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.6 t -68.67 -19.04 64.38 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 126.466 1.906 . . . . 1.8999999999999999 112.715 173.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.84 2.47 87.18 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 126.057 1.789 . . . . 1.3 115.393 167.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.34 -26.01 61.76 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 120.415 2.108 . . . . 4.25 113.192 176.201 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -167.21 177.94 5.89 Favored 'General case' 0 C--O 1.245 0.848 0 C-N-CA 125.776 1.63 . . . . 4.1299999999999999 111.129 -172.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.77 -141.5 44.73 Favored Glycine 0 N--CA 1.468 0.831 0 C-N-CA 124.216 0.912 . . . . 1.8799999999999999 111.951 170.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.1 t -73.97 157.33 36.38 Favored 'General case' 0 CA--C 1.551 1.013 0 O-C-N 121.558 -0.966 . . . . 3.21 111.979 159.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -71.48 -12.81 61.58 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 127.009 2.124 . . . . 4.9299999999999997 112.952 173.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.8 mt -101.57 -11.5 19.2 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.126 1.37 . . . . 3.5899999999999999 112.96 176.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.9 p -111.04 144.22 40.5 Favored 'General case' 0 C--O 1.248 1.002 0 C-N-CA 125.089 1.355 . . . . 0.97999999999999998 112.86 176.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.8 mt -95.08 104.94 16.82 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.324 1.05 . . . . 1.6399999999999999 109.396 161.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.6 p -57.33 162.09 2.97 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 120.684 -1.26 . . . . 2.48 111.223 168.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -50.55 -25.42 4.07 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 120.133 -1.604 . . . . 3.1499999999999999 114.267 174.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.87 -45.42 18.68 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.105 0.962 . . . . 4.5800000000000001 113.212 171.754 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -62.48 -41.64 98.93 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.888 0.875 . . . . 1.4299999999999999 110.947 175.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.2 tp -66.14 -46.65 76.74 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.176 0.591 . . . . 1.8799999999999999 110.09 176.264 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 15.4 ttmt -61.81 -46.14 90.79 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.054 0.843 . . . . 3.6200000000000001 111.803 178.181 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -45.05 -59.87 2.38 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 117.406 -1.283 . . . . 3.6299999999999999 111.84 165.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.0 -54.14 49.54 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.974 1.261 . . . . 1.73 112.407 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.7 mt -56.25 -42.66 74.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 119.592 1.087 . . . . 1.04 109.509 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 26.1 mmmt -64.87 -14.41 59.48 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 113.524 0.935 . . . . 3.6099999999999999 113.524 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 32.2 mmtm -102.22 -38.28 7.74 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.988 1.267 . . . . 3.6699999999999999 113.726 169.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -82.99 -31.62 27.41 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.534 1.534 . . . . 3.6800000000000002 112.472 -166.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -117.34 94.71 4.66 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.574 1.149 . . . . 2.6499999999999999 109.19 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.4 t -79.11 -6.25 56.02 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 115.048 1.499 . . . . 3.3700000000000001 115.048 -166.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.31 33.77 0.08 Allowed 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 117.65 2.463 . . . . 3.8199999999999998 117.65 -161.604 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.78 -46.88 2.69 Favored Glycine 0 N--CA 1.477 1.383 0 C-N-CA 125.469 1.509 . . . . 3.04 115.407 166.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.427 ' CD ' ' HZ3' ' A' ' 48' ' ' LYS . 38.0 mm-40 -86.07 7.23 25.5 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.357 1.243 . . . . 5.2400000000000002 114.357 -176.046 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.7 66.2 0.73 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 124.677 2.179 . . . . 2.8700000000000001 111.001 163.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.427 ' HZ3' ' CD ' ' A' ' 46' ' ' GLU . 60.7 mttp -101.4 165.55 11.2 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 128.363 2.665 . . . . 4.3499999999999996 110.839 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -62.8 -45.47 92.48 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 115.193 1.553 . . . . 3.7400000000000002 115.193 -160.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.3 t -73.83 -28.67 61.73 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 117.91 -1.043 . . . . 2.8700000000000001 113.3 172.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.77 -38.69 79.04 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.548 1.522 . . . . 2.2999999999999998 110.61 170.256 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 65.3 mt -81.85 -39.22 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 124.875 1.27 . . . . 1.3400000000000001 112.73 -176.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -76.71 -26.87 55.17 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 118.99 0.814 . . . . 3.3500000000000001 112.787 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -78.6 -38.69 39.39 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.116 0.871 . . . . 2.25 112.208 168.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 39.3 tp -55.03 -54.06 47.91 Favored 'General case' 0 C--N 1.344 0.362 0 O-C-N 121.462 -0.774 . . . . 1.72 109.964 168.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 8.9 tpt -48.61 -49.45 36.96 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.706 2.002 . . . . 1.8300000000000001 111.913 176.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.58 -25.6 60.24 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.037 1.335 . . . . 3.77 113.66 176.031 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.7 t -96.3 -25.87 15.6 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.941 1.297 . . . . 1.9099999999999999 113.788 177.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.1 mt -73.37 -41.93 62.8 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.154 0.981 . . . . 2.0299999999999998 111.565 173.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -69.32 149.74 48.11 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.495 0.718 . . . . 1.6899999999999999 112.053 176.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.19 -10.14 19.86 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 120.954 -1.091 . . . . 3.1499999999999999 113.791 -176.309 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -148.52 -10.84 0.35 Allowed 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.962 1.467 . . . . 2.6099999999999999 114.962 -165.223 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.0 t 79.66 18.95 0.7 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.625 2.37 . . . . 3.1800000000000002 113.315 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.3 p30 -65.05 -24.3 67.43 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.331 1.452 . . . . 2.2400000000000002 110.928 -178.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 63.84 22.23 12.95 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 130.701 3.6 . . . . 4.3899999999999997 114.211 -172.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -115.78 121.35 42.18 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 128.907 2.883 . . . . 2.6099999999999999 107.304 164.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 14.1 mm -93.03 105.02 16.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 124.998 1.319 . . . . 1.03 109.037 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.23 158.13 36.41 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.894 2.078 . . . . 2.52 111.379 167.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -54.82 -34.0 62.27 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.982 -1.074 . . . . 1.8999999999999999 113.704 -175.246 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm -78.88 -27.31 43.99 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 120.781 -1.199 . . . . 2.96 112.347 177.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -64.82 -53.02 53.42 Favored 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 108.307 -0.997 . . . . 1.77 108.307 163.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -55.57 -31.38 62.14 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 119.866 -1.771 . . . . 2.0600000000000001 114.349 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.53 -24.04 63.34 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 119.543 -1.973 . . . . 1.6299999999999999 114.28 172.046 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 49.0 t -63.81 -41.33 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 CA-C-N 119.067 0.849 . . . . 1.8600000000000001 110.153 172.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -61.26 -51.83 67.29 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.036 0.934 . . . . 1.9199999999999999 111.116 176.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.8 mt -59.3 -38.11 79.42 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.894 1.278 . . . . 2.3199999999999998 112.204 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 83.2 m -59.87 -55.79 29.75 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.803 0.841 . . . . 0.95999999999999996 110.545 175.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 75.0 mtm -61.44 -40.27 93.85 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 111.951 0.352 . . . . 1.3700000000000001 111.951 -176.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 89.0 mt -69.15 -37.0 78.02 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.281 0.845 . . . . 1.6100000000000001 113.281 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 5.7 t -73.94 -31.53 63.09 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.134 0.879 . . . . 1.78 112.979 176.158 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 49.1 mtp -67.65 -42.76 81.72 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.319 0.509 . . . . 1.8300000000000001 111.652 167.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.07 -41.1 91.18 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.071 -1.018 . . . . 1.03 112.621 -175.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -68.4 -26.94 65.8 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 113.12 0.785 . . . . 2.3700000000000001 113.12 174.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -67.88 -43.5 79.23 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 120.231 1.378 . . . . 1.6899999999999999 112.734 169.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -71.26 -28.8 64.41 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.731 0.813 . . . . 4.1100000000000003 110.973 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.46 -51.01 70.48 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.855 1.262 . . . . 1.8600000000000001 111.652 164.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 35.3 t80 -60.14 -33.43 72.15 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.104 1.362 . . . . 2.3500000000000001 112.316 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 41.1 mt -68.02 -20.28 64.98 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.859 1.264 . . . . 1.54 113.87 173.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -101.11 -9.95 20.9 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.632 1.173 . . . . 2.6400000000000001 114.09 176.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 12.4 t70 . . . . . 0 N--CA 1.472 0.642 0 C-N-CA 125.163 1.385 . . . . 2.7200000000000002 113.079 -173.068 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 59.1 p . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 113.519 0.933 . . . . 1.97 113.519 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.69 -21.51 69.72 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.579 2.186 . . . . 1.45 112.967 167.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.57 -44.11 36.03 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 119.397 0.999 . . . . 2.5299999999999998 110.842 173.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -58.93 -35.07 72.47 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.398 -0.814 . . . . 3.6299999999999999 111.026 170.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -74.94 -27.95 60.4 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 119.869 -1.769 . . . . 3.9199999999999999 113.72 173.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.8 -50.66 61.93 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.373 1.069 . . . . 0.91000000000000003 110.8 169.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 48.0 mt -56.83 -39.73 74.75 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.282 1.433 . . . . 1.53 111.898 169.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 88.0 m -62.39 -43.27 99.22 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 117.918 -1.039 . . . . 1.6599999999999999 111.033 173.007 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 62.0 m -57.74 -47.85 81.29 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.583 1.083 . . . . 1.3200000000000001 109.896 173.641 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 61.9 mtp -59.2 -43.41 92.22 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.086 1.354 . . . . 2.9199999999999999 112.826 175.094 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 32.2 t -64.76 -32.59 58.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 O-C-N 121.009 -1.057 . . . . 1.8200000000000001 112.045 173.239 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 89.3 m -74.49 -45.23 47.37 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.336 1.455 . . . . 0.87 112.16 -178.244 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 22.4 p -70.64 -37.86 73.8 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.293 0.637 . . . . 1.53 109.536 173.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -62.66 -66.59 0.52 Allowed 'General case' 0 C--O 1.219 -0.53 0 CA-C-O 117.383 -1.294 . . . . 1.95 109.864 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -59.06 -29.5 67.36 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 121.544 1.975 . . . . 2.4500000000000002 112.653 -173.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -62.17 -56.52 17.9 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.976 -1.078 . . . . 3.6099999999999999 113.455 173.678 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -81.24 -34.15 32.32 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.422 -0.799 . . . . 2.3500000000000001 112.979 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.5 t -64.76 -20.61 66.45 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 127.535 2.334 . . . . 2.1699999999999999 112.032 174.24 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.32 -5.44 79.56 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 127.307 2.384 . . . . 1.8600000000000001 116.133 170.456 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.52 -4.53 50.89 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-N 119.709 1.754 . . . . 3.2599999999999998 114.596 -163.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -165.35 161.6 19.11 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.393 1.477 . . . . 3.6699999999999999 111.843 174.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.13 -131.42 52.04 Favored Glycine 0 N--CA 1.472 1.082 0 O-C-N 120.985 -1.072 . . . . 2.2400000000000002 111.027 173.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 18.9 m -80.88 159.02 25.13 Favored 'General case' 0 CA--C 1.546 0.793 0 O-C-N 121.699 -0.883 . . . . 3.77 111.184 166.206 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -93.35 -3.3 53.64 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 116.557 2.058 . . . . 6.21 116.557 -167.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 22.9 tp -112.28 16.21 20.1 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.503 1.521 . . . . 3.29 110.625 178.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 23.3 p -148.78 133.1 17.48 Favored 'General case' 0 C--O 1.242 0.702 0 C-N-CA 127.029 2.132 . . . . 1.21 109.545 -161.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 5.7 mt -98.57 96.23 7.82 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.058 1.343 . . . . 1.8899999999999999 112.539 179.115 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 14.9 t -43.25 152.92 0.11 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.867 2.067 . . . . 2.1400000000000001 112.764 160.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.7 ttp85 -43.13 -27.96 0.25 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.779 1.632 . . . . 3.2999999999999998 113.323 171.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.6 -45.21 11.26 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.577 1.325 . . . . 4.4100000000000001 114.577 172.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -58.73 -38.22 77.87 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.686 1.194 . . . . 1.8999999999999999 111.47 174.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 29.4 tp -72.15 -44.57 62.89 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.862 1.265 . . . . 1.8899999999999999 110.603 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.3 ttmm -67.58 -36.28 80.6 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 120.707 -1.246 . . . . 3.0800000000000001 112.396 -179.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -52.2 -68.01 0.2 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.578 1.551 . . . . 3.4100000000000001 111.619 157.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 tt -52.23 -49.41 64.03 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.67 1.188 . . . . 1.9099999999999999 112.875 -174.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 48.4 mt -58.62 -51.33 73.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 108.461 -0.94 . . . . 1.1399999999999999 108.461 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -72.14 -9.11 57.98 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 112.841 0.682 . . . . 3.7599999999999998 112.841 -175.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -91.28 -37.22 13.42 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.707 1.603 . . . . 3.5099999999999998 113.664 168.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -88.89 -27.24 21.13 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.219 1.408 . . . . 3.9399999999999999 113.885 -175.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -117.46 108.26 15.32 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.588 1.155 . . . . 2.2000000000000002 110.631 -174.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 8.0 t -79.23 3.92 16.49 Favored 'General case' 0 CA--C 1.555 1.15 0 N-CA-C 115.064 1.505 . . . . 3.5499999999999998 115.064 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -61.88 -42.83 99.53 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.83 2.052 . . . . 2.71 115.439 -161.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.23 -23.79 34.13 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 124.672 1.13 . . . . 3.1499999999999999 114.49 -178.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -86.97 9.44 19.45 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 118.743 1.272 . . . . 5.1299999999999999 113.711 167.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.76 57.91 2.66 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 123.896 1.807 . . . . 2.8300000000000001 111.096 165.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -89.56 161.47 16.17 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.733 2.413 . . . . 3.8500000000000001 112.334 -177.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -53.2 -53.17 54.61 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 115.902 1.816 . . . . 3.27 115.902 -166.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 5.2 m -73.01 -28.26 62.26 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 119.767 1.167 . . . . 2.6800000000000002 114.002 178.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 1.2 t -61.72 -42.05 98.44 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.312 0.645 . . . . 2.54 109.779 169.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 47.7 mt -73.82 -35.06 42.06 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.191 0 C-N-CA 124.353 1.061 . . . . 1.45 112.61 176.52 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.66 -35.67 72.99 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.197 0.908 . . . . 2.8100000000000001 111.408 178.005 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -69.47 -46.47 66.58 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 119.199 0.909 . . . . 2.5099999999999998 111.425 167.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 51.7 tp -55.88 -49.36 73.58 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.151 0.98 . . . . 2.04 110.628 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.22 -57.8 9.24 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.662 1.185 . . . . 2.1299999999999999 110.12 172.14 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -25.76 44.87 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.836 1.254 . . . . 3.4500000000000002 113.83 176.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 13.8 m -88.67 -27.42 21.28 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.639 1.976 . . . . 2.75 113.028 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 66.6 mt -78.72 -39.25 36.9 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 125.705 1.602 . . . . 2.02 111.096 174.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -76.27 73.1 3.07 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.872 2.069 . . . . 1.6899999999999999 112.808 -171.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.36 -30.71 0.88 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 125.927 1.691 . . . . 3.2400000000000002 114.614 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -112.95 -4.28 13.94 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.779 2.431 . . . . 1.9099999999999999 114.083 -168.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 8.5 t 65.31 14.94 9.75 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 115.322 1.601 . . . . 2.4500000000000002 115.322 173.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -79.74 -15.83 56.76 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.335 1.454 . . . . 2.3900000000000001 111.651 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 68.0 14.44 9.35 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 128.841 2.857 . . . . 5.0 114.371 174.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -101.21 153.36 19.68 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-O 124.169 1.938 . . . . 2.7599999999999998 110.61 141.186 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 29.9 mm -99.62 101.41 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 127.477 2.311 . . . . 1.23 108.296 171.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.82 162.52 3.14 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.404 1.482 . . . . 2.5099999999999998 112.143 162.753 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.61 -36.76 67.3 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.05 -1.031 . . . . 2.21 113.083 -177.551 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -80.2 -17.66 51.73 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 120.939 -1.101 . . . . 3.6099999999999999 112.26 178.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -73.92 -44.94 53.46 Favored 'General case' 0 CA--C 1.552 1.046 0 O-C-N 121.156 -0.965 . . . . 1.8 109.233 163.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -62.88 -30.98 71.93 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.871 1.669 . . . . 2.0699999999999998 112.969 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 85.9 p -63.68 -24.39 67.76 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 119.973 -1.705 . . . . 1.96 113.433 172.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 24.4 t -67.26 -36.13 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 CA-C-N 119.561 1.073 . . . . 1.55 110.984 174.256 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -63.22 -53.13 57.97 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.836 0.854 . . . . 1.72 110.916 173.256 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 83.7 mt -57.74 -36.54 72.22 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.217 1.007 . . . . 1.5700000000000001 111.945 177.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 93.1 m -62.4 -54.06 45.83 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.894 1.278 . . . . 0.81000000000000005 111.538 175.239 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.2 mtm -58.41 -39.42 79.68 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 118.164 0.438 . . . . 1.45 111.662 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 94.3 mt -69.92 -45.25 67.95 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.669 -0.682 . . . . 1.6799999999999999 112.297 177.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 87.1 m -64.24 -32.46 74.06 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.672 1.124 . . . . 1.8700000000000001 113.205 176.221 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 52.6 mtp -71.24 -38.86 71.94 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.977 0.808 . . . . 2.1200000000000001 112.522 168.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.9 -36.78 75.68 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.084 1.311 . . . . 0.95999999999999996 112.955 -177.283 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -75.35 -26.15 58.34 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.787 -0.571 . . . . 2.6099999999999999 111.824 176.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -66.08 -42.99 88.63 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.793 0.837 . . . . 1.9199999999999999 112.267 166.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -71.17 -26.99 63.21 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.142 0.577 . . . . 3.7200000000000002 111.408 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -54.76 35.57 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.511 1.524 . . . . 2.21 112.266 162.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -59.48 -27.73 66.39 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.592 1.957 . . . . 2.1099999999999999 112.556 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 16.8 mt -72.38 -11.48 60.71 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 126.163 1.785 . . . . 1.8300000000000001 114.446 176.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -96.38 -3.93 42.8 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 113.625 0.972 . . . . 3.8999999999999999 113.625 170.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -117.43 -65.1 1.22 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.391 1.476 . . . . 3.1899999999999999 110.919 -178.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -87.37 40.47 0.93 Allowed 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 126.932 2.093 . . . . 4.7300000000000004 112.45 173.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp . . . . . 0 C--O 1.251 1.141 0 C-N-CA 129.558 3.143 . . . . 8.0199999999999996 116.493 -169.069 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 . . . . . 0 C--O 1.238 0.456 0 N-CA-C 112.372 0.508 . . . . 5.0499999999999998 112.372 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.475 ' HB ' ' H ' ' A' ' 5' ' ' LEU . 40.7 p -158.7 161.59 28.09 Favored Pre-proline 0 CA--C 1.534 0.338 0 C-N-CA 127.527 2.331 . . . . 2.3799999999999999 109.968 -176.418 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -70.74 -8.71 24.23 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.708 2.272 . . . . 1.8600000000000001 112.188 157.462 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.475 ' H ' ' HB ' ' A' ' 3' ' ' THR . 0.3 OUTLIER -73.32 -47.4 42.94 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.751 2.02 . . . . 2.6099999999999999 110.247 179.963 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.32 -40.61 71.37 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.066 0.848 . . . . 3.3399999999999999 111.199 167.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.9 mtpt -67.87 -28.15 67.29 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 119.829 -1.794 . . . . 5.6699999999999999 114.113 173.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.83 -50.6 19.67 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.471 1.108 . . . . 1.03 110.653 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.0 mt -56.04 -50.6 70.48 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.862 1.265 . . . . 1.78 110.497 175.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 32.5 p -65.89 -39.65 90.85 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 116.845 -1.55 . . . . 2.2400000000000002 112.398 178.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 50.0 m -57.55 -45.75 84.75 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 120.603 1.547 . . . . 1.5 109.949 172.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 12.8 ttp -66.85 -45.11 79.21 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.444 1.098 . . . . 2.9500000000000002 112.126 -175.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -60.13 -41.62 87.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 124.799 1.24 . . . . 2.2599999999999998 112.023 171.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 90.4 m -61.43 -52.05 66.17 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.218 1.007 . . . . 1.03 111.333 177.439 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.46 -36.93 67.1 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 119.148 -0.453 . . . . 2.1200000000000001 111.302 170.613 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -64.02 -37.51 87.7 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 120.81 -0.356 . . . . 2.0499999999999998 111.708 -177.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.3 m-70 -62.29 -50.26 72.37 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.098 0.863 . . . . 4.5300000000000002 111.718 170.258 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.424 ' HE2' ' CE1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -60.75 -38.65 85.93 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.423 0.689 . . . . 6.75 112.842 -176.719 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.424 ' CE1' ' HE2' ' A' ' 18' ' ' LYS . 49.2 m-85 -76.58 -43.87 36.94 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.79 0.836 . . . . 3.21 111.303 172.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.0 t -64.43 -38.73 92.06 Favored 'General case' 0 C--O 1.241 0.635 0 O-C-N 119.936 -1.727 . . . . 2.2000000000000002 113.244 -176.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.36 3.59 86.49 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 126.178 1.847 . . . . 1.6899999999999999 115.325 -175.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.09 -43.23 61.03 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.464 1.505 . . . . 5.2599999999999998 113.958 175.264 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 178.29 -138.3 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 129.28 3.032 . . . . 3.77 107.116 -173.037 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -11.6 99.06 0.01 OUTLIER Glycine 0 N--CA 1.475 1.263 0 C-N-CA 127.939 2.685 . . . . 3.7599999999999998 114.284 -174.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.2 t 57.4 163.4 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 116.357 1.984 . . . . 2.7200000000000002 116.357 175.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -137.68 134.71 35.72 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.429 1.891 . . . . 4.9900000000000002 110.532 -171.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 92.9 mt 92.34 -9.08 0.2 Allowed 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 130.135 3.374 . . . . 3.5800000000000001 111.042 -158.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.1 p -132.49 152.16 51.64 Favored 'General case' 0 C--O 1.249 1.035 0 C-N-CA 127.68 2.392 . . . . 1.6699999999999999 114.021 -176.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 10.8 mt -104.62 103.63 13.32 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.163 1.385 . . . . 1.9399999999999999 109.638 172.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.4 t -72.88 150.92 42.22 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 120.395 -1.441 . . . . 2.27 111.017 168.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -40.61 -45.31 2.3 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 116.444 2.016 . . . . 3.2799999999999998 116.444 -165.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.45 -31.45 69.77 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.178 -1.576 . . . . 4.2000000000000002 114.022 177.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -68.52 -47.07 67.9 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.441 1.897 . . . . 2.0299999999999998 109.812 173.169 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.1 tp -59.8 -37.85 80.28 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.148 0.579 . . . . 1.98 111.117 175.084 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.1 ttmt -68.33 -42.63 79.03 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 121.654 -0.654 . . . . 3.2599999999999998 111.845 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -51.24 -44.0 61.61 Favored 'General case' 0 CA--C 1.55 0.956 0 CA-C-N 118.405 0.548 . . . . 5.4100000000000001 112.244 164.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.2 tt -63.23 -64.1 1.0 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.013 0.925 . . . . 2.1200000000000001 111.324 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.3 mt -56.94 -50.08 77.01 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 N-CA-C 108.851 -0.796 . . . . 0.77000000000000002 108.851 -175.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.3 tttt -66.22 -13.17 59.89 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 119.708 1.14 . . . . 4.0 113.941 -176.191 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -95.88 -32.89 12.43 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 117.914 -1.041 . . . . 3.0699999999999998 113.809 168.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -80.82 -46.82 14.75 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.963 1.705 . . . . 4.2999999999999998 111.554 -178.521 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 26.6 mt -147.44 80.8 1.51 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.157 1.783 . . . . 3.0299999999999998 110.409 -177.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 43.9 t -91.84 -51.01 5.43 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 120.398 -1.439 . . . . 5.54 111.969 169.063 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.6 mp 52.53 -143.6 0.69 Allowed 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.94 1.296 . . . . 4.5999999999999996 108.17 -165.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -95.64 10.8 68.72 Favored Glycine 0 CA--C 1.533 1.199 0 O-C-N 121.263 -0.898 . . . . 3.8999999999999999 112.312 157.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -107.32 -55.52 2.33 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 118.166 0.983 . . . . 5.5800000000000001 112.812 -157.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 42.7 tpp -76.59 88.01 3.29 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.337 1.455 . . . . 2.73 110.733 -171.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.8 mttp -87.11 166.97 14.6 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.569 1.548 . . . . 3.96 112.737 -175.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -47.61 -53.17 15.49 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 115.593 1.701 . . . . 4.3700000000000001 115.593 -169.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.3 m -73.98 -26.58 60.54 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.139 0.792 . . . . 3.52 113.139 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.8 m -71.27 -29.79 65.5 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 118.819 0.736 . . . . 2.54 110.829 174.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.4 mt -68.55 -47.78 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.214 1.005 . . . . 1.51 110.676 169.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -71.03 -30.92 67.26 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 112.787 0.662 . . . . 4.0499999999999998 112.787 -176.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -73.9 -37.75 64.57 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.355 -0.841 . . . . 3.1200000000000001 112.229 170.337 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 64.8 tp -60.84 -40.32 92.37 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-O 117.738 -1.125 . . . . 2.02 111.109 169.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -57.31 -51.51 69.08 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 120.278 1.399 . . . . 1.8100000000000001 110.213 176.431 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 tttm -50.66 -30.39 13.44 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.228 1.411 . . . . 3.3100000000000001 113.673 168.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.35 -32.36 22.49 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.515 1.126 . . . . 2.0699999999999998 112.205 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.7 mt -67.27 -41.54 85.35 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.091 0.956 . . . . 2.3399999999999999 110.622 173.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -94.47 80.02 3.88 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.93 2.092 . . . . 1.6399999999999999 113.297 -167.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -58.77 -21.6 56.16 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 115.044 1.498 . . . . 3.6699999999999999 115.044 -166.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -106.69 -5.73 18.38 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.201 1.4 . . . . 2.3100000000000001 114.374 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.5 t 58.61 31.16 20.79 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.915 1.286 . . . . 2.6499999999999999 114.215 -175.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.6 p30 -69.68 -14.64 62.91 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.578 1.151 . . . . 2.6000000000000001 111.791 175.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 68.02 8.5 6.54 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 129.861 3.264 . . . . 4.5300000000000002 114.39 -178.316 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -112.56 120.13 40.52 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 127.092 2.157 . . . . 3.1299999999999999 107.554 172.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 15.4 mm -90.23 101.28 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 123.466 0.707 . . . . 1.1000000000000001 109.256 174.38 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -48.35 155.42 0.51 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.24 1.016 . . . . 3.5899999999999999 111.955 161.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.459 ' CZ ' ' HB3' ' B' ' 80' ' ' CYS . 0.1 OUTLIER -51.43 -41.85 61.11 Favored 'General case' 0 CA--C 1.548 0.865 0 O-C-N 120.634 -1.291 . . . . 3.1499999999999999 110.982 158.122 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.8 pttm -66.86 -21.08 66.02 Favored 'General case' 0 CA--C 1.552 1.023 0 O-C-N 120.035 -1.666 . . . . 3.8300000000000001 114.781 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -85.39 -48.78 8.69 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.147 1.379 . . . . 2.2799999999999998 110.834 170.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -55.89 -33.8 64.96 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 126.029 1.732 . . . . 2.0299999999999998 112.43 174.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.3 t -58.94 -29.1 66.87 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.542 -1.349 . . . . 2.27 113.333 170.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 19.2 t -69.34 -36.86 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 O-C-N 120.563 -1.335 . . . . 2.1000000000000001 110.407 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.405 ' CZ ' HD11 ' A' ' 79' ' ' LEU . 52.5 t80 -63.32 -51.72 64.87 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.525 1.13 . . . . 2.5299999999999998 111.722 169.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 65.9 mt -58.01 -33.77 69.31 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 118.512 0.596 . . . . 1.7 112.388 176.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 50.0 m -62.41 -54.73 35.95 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.642 1.177 . . . . 0.78000000000000003 110.344 171.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 45.6 mtp -53.27 -45.99 69.08 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.401 1.08 . . . . 1.6499999999999999 112.028 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.405 HD11 ' CZ ' ' A' ' 75' ' ' PHE . 88.8 mt -66.83 -48.83 67.68 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 123.898 0.879 . . . . 1.29 112.211 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 9.0 t -66.76 -34.4 77.74 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.695 -0.628 . . . . 1.6499999999999999 112.406 -178.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 89.9 mtp -64.61 -39.1 93.11 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.289 0.636 . . . . 1.55 112.258 168.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.32 -34.68 78.52 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.669 1.122 . . . . 0.70999999999999996 112.743 177.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -63.42 -23.18 67.29 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 113.357 0.873 . . . . 2.54 113.357 170.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.65 -40.45 88.69 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 119.923 1.238 . . . . 2.25 112.472 170.081 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -71.58 -39.24 70.71 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.681 0.792 . . . . 3.1400000000000001 110.825 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.2 -43.35 67.12 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.25 1.42 . . . . 1.98 112.287 170.402 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -67.76 -27.46 66.79 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.234 1.414 . . . . 2.5800000000000001 112.971 177.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.3 mt -74.31 -15.49 60.96 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 113.454 0.909 . . . . 2.0800000000000001 113.454 172.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -95.07 -4.84 45.64 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.873 1.269 . . . . 4.5300000000000002 114.394 173.034 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 20.7 t70 . . . . . 0 N--CA 1.468 0.47 0 C-N-CA 125.131 1.372 . . . . 3.77 111.805 175.783 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 74.2 p . . . . . 0 N--CA 1.466 0.37 0 N-CA-C 111.601 0.223 . . . . 2.02 111.601 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.46 -21.95 69.9 Favored 'Trans proline' 0 CA--C 1.537 0.65 0 C-N-CA 121.987 1.791 . . . . 1.3999999999999999 113.235 170.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -83.89 -42.35 16.46 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.757 1.162 . . . . 3.3599999999999999 112.417 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -59.81 -43.18 94.63 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 118.918 0.781 . . . . 4.1799999999999997 110.214 168.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -62.76 -39.29 93.71 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 120.855 -1.153 . . . . 4.0999999999999996 112.471 171.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.97 -52.68 62.06 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.44 1.018 . . . . 0.93000000000000005 111.23 176.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 37.6 mt -57.38 -39.04 75.22 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.785 1.234 . . . . 1.55 112.231 176.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 94.8 m -61.75 -51.98 66.1 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.451 0.7 . . . . 1.6299999999999999 110.793 171.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 86.5 m -55.54 -36.22 66.53 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.396 1.478 . . . . 1.48 112.28 -179.023 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 75.1 mmm -55.63 -51.98 65.37 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 122.926 0.49 . . . . 3.2799999999999998 111.943 170.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.17 -26.07 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.158 0.89 . . . . 2.52 112.842 -178.004 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 25.4 m -56.67 -56.49 20.75 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.078 1.351 . . . . 0.77000000000000002 110.844 169.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.98 -35.94 77.29 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 118.08 -0.962 . . . . 2.7200000000000002 109.482 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -59.73 -49.25 78.45 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 118.448 -0.787 . . . . 2.2000000000000002 111.972 177.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 15.8 m80 -56.82 -48.69 77.44 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 120.012 1.278 . . . . 2.0600000000000001 111.544 173.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -26.62 65.93 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 124.144 0.978 . . . . 5.8099999999999996 113.082 178.216 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -87.96 -30.24 20.18 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.6 -1.313 . . . . 3.2599999999999998 113.281 168.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 42.2 p -87.24 -36.99 17.63 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 120.914 1.688 . . . . 1.77 114.678 -162.089 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.45 3.15 85.85 Favored Glycine 0 CA--C 1.533 1.166 0 O-C-N 119.714 -1.866 . . . . 1.55 112.922 169.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -43.23 91.68 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 119.042 1.421 . . . . 4.7000000000000002 111.81 -172.473 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -138.27 157.78 45.59 Favored 'General case' 0 C--O 1.249 1.073 0 C-N-CA 127.237 2.215 . . . . 4.5599999999999996 111.153 173.025 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.88 7.1 10.92 Favored Glycine 0 CA--C 1.534 1.233 0 CA-C-N 114.703 -1.135 . . . . 2.2999999999999998 113.25 -167.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 53.9 m 48.1 -145.51 0.32 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.044 1.737 . . . . 6.96 111.464 -161.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 32.3 mtpt 71.53 -163.94 0.13 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 127.324 2.25 . . . . 11.51 111.938 169.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 5.4 mp -106.68 14.07 27.34 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.655 1.582 . . . . 4.5599999999999996 111.63 168.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 74.7 p -108.72 149.44 29.0 Favored 'General case' 0 C--O 1.248 1.023 0 C-N-CA 126.223 1.809 . . . . 1.28 113.402 -174.148 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -115.13 90.62 3.38 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.712 2.405 . . . . 1.98 109.45 -157.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.2 m -81.53 160.58 23.86 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.324 1.45 . . . . 2.0800000000000001 113.304 -173.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -40.44 -41.26 1.37 Allowed 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 116.41 2.004 . . . . 3.5600000000000001 116.41 -175.328 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? -78.63 -43.04 27.22 Favored 'General case' 0 CA--C 1.546 0.827 0 O-C-N 119.971 -1.706 . . . . 6.4199999999999999 112.034 175.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -53.7 -44.16 69.56 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.364 0.983 . . . . 1.72 109.6 172.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.43 -49.33 77.27 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.889 2.076 . . . . 2.2200000000000002 112.029 176.633 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -52.39 -47.1 66.42 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 121.093 -1.005 . . . . 2.8999999999999999 111.795 169.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -68.67 -24.21 64.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.108 1.763 . . . . 3.4199999999999999 114.381 177.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.5 tt -71.58 -59.32 2.82 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.001 1.32 . . . . 2.1000000000000001 108.912 172.437 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 78.8 mt -53.76 -58.71 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.386 0.674 . . . . 1.24 110.419 -176.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -9.15 8.56 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 114.07 1.137 . . . . 5.2199999999999998 114.07 -172.595 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 40' ' ' LYS . . . . . 0.434 ' HA ' ' HE2' ' B' ' 40' ' ' LYS . 0.0 OUTLIER -114.29 -40.79 3.59 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 125.942 1.697 . . . . 6.25 110.836 -177.496 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 41' ' ' GLU . . . . . 0.448 ' HA ' HG21 ' A' ' 3' ' ' THR . 80.9 mt-10 -68.04 -49.9 58.58 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.187 1.358 . . . . 3.9199999999999999 110.839 176.373 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -115.21 178.24 4.36 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.979 2.512 . . . . 2.8300000000000001 111.93 -171.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.1 m -138.55 -43.35 0.49 Allowed 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 114.774 1.398 . . . . 4.3700000000000001 114.774 165.116 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 7.4 mp 50.92 -112.73 0.65 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.626 1.571 . . . . 5.9000000000000004 111.759 -176.255 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -157.99 -58.12 0.01 OUTLIER Glycine 0 N--CA 1.471 1.023 0 CA-C-N 119.067 0.848 . . . . 4.1100000000000003 113.934 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.71 -23.43 66.11 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 117.45 0.625 . . . . 6.7300000000000004 112.018 174.279 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 2.0 ttm -58.5 104.88 0.24 Allowed 'General case' 0 C--N 1.338 0.105 0 C-N-CA 124.988 1.315 . . . . 2.6600000000000001 113.538 -157.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -163.62 176.7 9.4 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 128.122 2.569 . . . . 4.54 109.532 -171.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 33.7 tp10 -39.35 -58.9 1.14 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.912 1.685 . . . . 4.8399999999999999 113.639 -171.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 3.7 m -74.18 -4.88 38.55 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 116.439 2.014 . . . . 2.6299999999999999 116.439 -176.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 97.6 p -102.21 -28.72 12.13 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 120.979 1.718 . . . . 2.2200000000000002 112.5 161.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 54.0 mt -69.5 -39.77 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.645 1.578 . . . . 1.8300000000000001 112.826 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -72.33 -37.4 68.9 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.637 0.653 . . . . 2.9300000000000002 112.546 -177.188 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -67.92 -45.39 74.5 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.42 -0.8 . . . . 2.96 111.315 169.203 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.426 HD23 ' C ' ' B' ' 55' ' ' LEU . 4.7 tt -51.86 -51.37 57.17 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 117.588 -1.196 . . . . 2.1400000000000001 110.211 176.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.6 ppp? -64.72 -44.83 88.95 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.128 0.876 . . . . 2.02 112.021 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.54 -32.29 68.75 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.607 1.163 . . . . 3.8199999999999998 111.832 174.356 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 58.9 m -80.49 -16.92 53.14 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.969 1.307 . . . . 2.2999999999999998 113.663 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 17.7 mt -73.78 -40.32 63.53 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 119.124 0.874 . . . . 2.1299999999999999 110.442 165.036 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -76.32 149.27 37.07 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.696 1.199 . . . . 2.1499999999999999 114.2 -176.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.77 -2.73 9.28 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.756 1.222 . . . . 2.9500000000000002 112.997 171.283 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -103.86 -27.47 12.18 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.547 1.314 . . . . 2.0099999999999998 114.547 -168.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 16.4 t 69.5 30.62 4.0 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.246 1.819 . . . . 3.1699999999999999 111.9 -158.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 42.5 p30 -91.21 -24.92 19.75 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.376 1.071 . . . . 2.4100000000000001 112.629 -172.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 63.38 16.8 9.81 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 129.24 3.016 . . . . 5.9900000000000002 113.697 -171.007 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -116.8 122.23 43.84 Favored 'General case' 0 C--O 1.24 0.565 0 C-N-CA 129.173 2.989 . . . . 2.6800000000000002 108.826 176.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 25.1 mm -101.37 87.87 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 125.779 1.632 . . . . 1.3200000000000001 109.169 -177.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -62.55 165.98 5.74 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.986 0.914 . . . . 4.1500000000000004 111.442 171.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.71 -34.15 37.54 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 120.563 -1.336 . . . . 2.1200000000000001 113.262 -177.443 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -73.66 -17.5 61.14 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.486 1.514 . . . . 4.9900000000000002 114.825 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -93.03 -44.17 8.54 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.38 1.872 . . . . 1.8600000000000001 108.896 169.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -54.07 -36.97 63.7 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.409 1.484 . . . . 2.1000000000000001 113.152 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 90.8 p -68.7 -19.95 64.39 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 119.993 -1.692 . . . . 1.6399999999999999 114.243 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 46.9 t -61.61 -41.78 91.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 120.658 1.572 . . . . 1.47 109.724 172.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -61.4 -52.41 64.69 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.567 1.147 . . . . 1.71 110.397 175.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 76.7 mt -58.22 -33.3 69.17 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.379 0.672 . . . . 1.3 112.066 177.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 28.0 m -67.33 -51.91 46.69 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.401 1.08 . . . . 0.82999999999999996 110.974 175.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 70.7 mtp -55.13 -44.37 74.99 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.539 1.136 . . . . 1.96 111.312 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.91 -51.19 65.64 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.617 1.167 . . . . 2.9300000000000002 111.639 178.528 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 80' ' ' CYS . . . . . 0.459 ' HB3' ' CZ ' ' A' ' 69' ' ' PHE . 86.2 m -70.48 -33.58 71.41 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 114.065 1.135 . . . . 1.78 114.065 -175.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 94.0 mtp -68.06 -41.34 82.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 118.934 0.788 . . . . 2.0 111.256 171.094 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.98 -35.82 77.17 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 118.659 -0.686 . . . . 0.88 112.78 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -76.84 -29.79 56.04 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.729 1.149 . . . . 3.02 112.366 177.217 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -56.37 -47.67 78.4 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.213 0.915 . . . . 1.77 111.551 165.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -69.75 -35.38 74.92 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.183 0.993 . . . . 3.6200000000000001 112.01 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -60.67 -48.78 80.26 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.438 1.495 . . . . 2.9300000000000002 111.722 173.133 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -63.86 -34.95 79.09 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.049 0.94 . . . . 4.0700000000000003 111.214 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 83.4 mt -70.77 -11.72 61.12 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.658 0.985 . . . . 2.2599999999999998 113.658 175.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -99.06 -6.12 29.05 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.601 1.561 . . . . 3.6699999999999999 113.747 169.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -110.65 -42.74 3.98 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.061 1.745 . . . . 3.6800000000000002 112.552 -171.275 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -81.96 24.26 0.64 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.125 1.37 . . . . 3.8799999999999999 113.027 173.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 77.1 tttt . . . . . 0 C--O 1.254 1.306 0 C-N-CA 129.584 3.154 . . . . 5.25 115.78 -163.73 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 C--O 1.238 0.452 0 N-CA-C 105.835 -1.913 . . . . 4.2000000000000002 105.835 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.421 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 12.8 p -73.48 168.52 24.6 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 124.367 1.067 . . . . 2.3199999999999998 112.03 -175.278 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.421 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 37.5 Cg_endo -63.58 -29.23 70.11 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.756 1.637 . . . . 1.8300000000000001 112.946 176.652 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 42.7 tp -70.33 -39.66 74.6 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 118.555 0.616 . . . . 3.0800000000000001 111.111 174.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.424 ' HA ' ' HG ' ' A' ' 9' ' ' LEU . 50.0 mt-10 -65.43 -39.09 91.67 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.108 0.563 . . . . 3.8799999999999999 111.923 173.075 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.1 -43.25 95.71 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.211 -0.931 . . . . 3.6000000000000001 111.723 172.152 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.95 -51.95 67.5 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.403 1.081 . . . . 0.89000000000000001 112.738 175.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.424 ' HG ' ' HA ' ' A' ' 6' ' ' GLU . 4.5 pp -64.82 -28.47 69.59 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.387 0.994 . . . . 3.2999999999999998 113.195 175.153 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 90.7 m -58.73 -49.94 75.75 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 118.286 -0.864 . . . . 1.55 109.853 167.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.4 m -57.43 -37.27 72.51 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 119.537 1.062 . . . . 1.3500000000000001 111.717 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 80.6 mmm -59.78 -58.27 9.29 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.778 0.831 . . . . 3.1099999999999999 111.541 174.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.2 m -66.94 -29.18 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 O-C-N 121.242 -0.911 . . . . 2.1299999999999999 112.233 -176.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 52.4 m -61.55 -55.38 31.54 Favored 'General case' 0 CA--C 1.506 -0.742 0 C-N-CA 125.591 1.556 . . . . 1.0800000000000001 111.313 176.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -75.87 -35.34 59.91 Favored 'General case' 0 CA--C 1.522 -0.116 0 O-C-N 125.28 1.613 . . . . 2.9300000000000002 109.417 -176.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -57.24 -44.04 83.48 Favored 'General case' 0 C--O 1.226 -0.177 0 CA-C-O 118.504 -0.76 . . . . 2.3100000000000001 111.156 177.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -70.26 -35.71 73.95 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.127 1.33 . . . . 2.27 112.594 175.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -70.65 -12.22 61.42 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.712 1.004 . . . . 6.2599999999999998 113.712 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -107.58 -47.99 3.51 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.903 2.081 . . . . 1.98 112.94 171.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.5 t -62.0 -29.74 70.47 Favored 'General case' 0 C--O 1.249 1.04 0 C-N-CA 126.554 1.941 . . . . 2.04 113.553 176.338 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.56 -4.84 87.86 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 127.763 2.601 . . . . 1.3899999999999999 114.009 173.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -78.53 60.22 2.61 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.812 1.806 . . . . 6.6299999999999999 110.365 171.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 51.86 -151.07 0.28 Allowed 'General case' 0 C--O 1.252 1.196 0 C-N-CA 126.154 1.782 . . . . 8.3699999999999992 112.803 -175.176 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.91 -151.59 8.53 Favored Glycine 0 CA--C 1.529 0.966 0 N-CA-C 109.659 -1.376 . . . . 2.0299999999999998 109.659 -145.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.5 m -69.3 161.19 29.8 Favored 'General case' 0 C--O 1.25 1.125 0 CA-C-O 123.338 1.542 . . . . 3.6299999999999999 111.032 155.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.1 mtmt -139.01 108.55 6.18 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.201 1.4 . . . . 7.8499999999999996 108.228 -160.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 43.4 mt 114.6 -17.74 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.482 1 C-N-CA 132.592 4.357 . . . . 3.23 110.459 -154.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.3 p -121.62 161.97 21.49 Favored 'General case' 0 C--O 1.246 0.91 0 C-N-CA 127.177 2.191 . . . . 1.1100000000000001 112.0 173.705 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 39.8 mt -104.95 117.45 34.04 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.73 1.212 . . . . 1.78 110.1 170.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 13.0 t -80.61 160.29 25.13 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 118.28 0.491 . . . . 2.2799999999999998 111.0 160.102 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.72 -46.77 2.7 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 127.149 2.18 . . . . 3.8799999999999999 114.045 -169.621 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -76.01 -27.36 57.35 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 120.706 -1.246 . . . . 6.4500000000000002 112.718 -175.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -65.37 -57.27 8.78 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.733 1.213 . . . . 1.49 108.573 173.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.3 tp -56.39 -45.02 80.78 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.136 0.975 . . . . 2.2599999999999998 112.152 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -31.76 71.69 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.5 -0.75 . . . . 4.6399999999999997 112.846 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -82.33 -28.95 31.32 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.943 0.897 . . . . 4.0599999999999996 112.837 174.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.3 tt -73.34 -52.05 15.25 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.552 1.141 . . . . 2.2999999999999998 110.947 178.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.5 mt -50.88 -60.27 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-N 119.853 1.206 . . . . 1.3200000000000001 111.114 -175.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.273 0.0 OUTLIER -78.1 9.33 3.8 Favored 'General case' 0 CA--C 1.56 1.328 0 N-CA-C 114.197 1.184 . . . . 4.9800000000000004 114.197 -175.778 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.0 mmtm -106.53 -31.04 8.69 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 127.441 2.296 . . . . 2.5800000000000001 112.556 166.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -71.18 -56.74 5.45 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 126.371 1.868 . . . . 4.6200000000000001 108.463 173.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -102.69 125.36 49.4 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 127.863 2.465 . . . . 2.6000000000000001 108.248 172.057 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 30.4 m -107.07 26.14 10.5 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.455 1.102 . . . . 3.9300000000000002 112.693 176.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -147.44 172.72 13.5 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.716 1.206 . . . . 4.1699999999999999 113.352 -175.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.78 -178.96 53.5 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 124.787 1.184 . . . . 4.2199999999999998 112.919 -175.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -82.83 51.87 2.01 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.92 1.288 . . . . 6.5199999999999996 110.025 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.2 tpt -83.85 56.65 3.76 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 123.249 1.5 . . . . 1.8700000000000001 112.876 -168.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -102.68 175.16 5.59 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.11 1.764 . . . . 4.4699999999999998 112.171 -173.065 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -58.26 -39.52 79.42 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.14 -0.975 . . . . 3.6200000000000001 113.412 -170.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -71.54 6.23 1.97 Allowed 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 114.571 1.323 . . . . 3.7400000000000002 114.571 175.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 29.7 t -121.75 -48.07 2.17 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.278 1.831 . . . . 2.8100000000000001 109.889 170.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 37.1 mt -54.1 -39.21 40.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.778 1.231 . . . . 1.3 113.304 174.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.69 -54.07 37.37 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.778 0.717 . . . . 4.0099999999999998 111.695 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.96 -30.21 65.05 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.149 0.426 . . . . 2.9300000000000002 112.149 -176.85 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.8 tt -57.89 -51.61 68.89 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 116.895 -1.526 . . . . 1.98 110.135 165.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.9 ttt -52.22 -48.94 64.85 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 120.98 1.718 . . . . 1.6799999999999999 112.176 174.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.0 mtpt -62.63 -27.23 69.07 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.515 0.726 . . . . 4.7699999999999996 112.676 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.5 m -89.0 -25.73 21.85 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.48 1.512 . . . . 2.48 113.91 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.415 HD22 ' HB2' ' A' ' 75' ' ' PHE . 14.5 mt -63.56 -42.02 98.39 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.685 1.13 . . . . 2.0600000000000001 110.676 171.391 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -87.13 142.34 27.99 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 124.588 1.155 . . . . 1.8 113.509 -169.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.98 9.6 42.07 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.55 1.54 . . . . 3.1099999999999999 112.779 178.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -143.48 -25.65 0.58 Allowed 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 115.969 1.841 . . . . 2.2400000000000002 115.969 -164.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.6 m 56.45 34.31 24.04 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.432 1.493 . . . . 2.3999999999999999 112.88 -161.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -79.43 1.17 26.45 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.116 1.767 . . . . 2.1699999999999999 111.558 178.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 58.53 -13.43 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 129.475 3.11 . . . . 4.2599999999999998 116.569 -163.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -101.45 123.65 45.86 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-O 124.071 1.891 . . . . 2.7200000000000002 112.239 -176.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.6 mm -92.49 93.81 4.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 113.747 -1.57 . . . . 1.25 109.013 171.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -53.15 147.22 10.16 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 127.283 2.233 . . . . 2.5 110.542 164.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -47.44 -37.19 11.11 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.58 1.152 . . . . 2.3999999999999999 113.079 178.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -69.56 -31.08 69.05 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.714 2.405 . . . . 2.9700000000000002 113.862 176.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -77.49 -47.66 19.06 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.595 1.158 . . . . 2.0899999999999999 109.06 170.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -55.05 -28.16 50.12 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.297 1.439 . . . . 1.8799999999999999 112.277 173.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 52.1 m -62.03 -26.93 68.53 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 119.882 -1.761 . . . . 2.2400000000000002 113.683 171.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 m -78.68 -28.94 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 CA-C-N 121.004 1.729 . . . . 2.7999999999999998 112.831 175.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.492 ' CE1' HD11 ' A' ' 79' ' ' LEU . 18.0 t80 -59.97 -55.14 37.76 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.357 1.063 . . . . 1.8200000000000001 110.678 169.065 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.1 mt -56.06 -38.84 71.16 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.754 0.822 . . . . 1.8999999999999999 112.438 175.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 75.8 m -60.74 -55.53 32.12 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.495 1.118 . . . . 0.81000000000000005 111.562 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 16.3 ptp -61.07 -38.08 84.95 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.986 0.812 . . . . 1.77 112.333 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.492 HD11 ' CE1' ' A' ' 75' ' ' PHE . 85.5 mt -64.74 -41.44 95.94 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.829 0.851 . . . . 1.73 113.047 175.402 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 40.4 t -71.7 -32.16 67.51 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.656 0.613 . . . . 1.3600000000000001 112.656 178.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 77.2 mtp -65.83 -43.27 89.07 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.284 0.475 . . . . 1.6299999999999999 112.284 167.062 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.22 -38.07 89.73 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.659 0.663 . . . . 1.0 111.95 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -61.35 -20.56 63.13 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.18 1.178 . . . . 2.4100000000000001 114.18 174.556 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.407 HD21 ' CE1' ' B' ' 17' ' ' HIS . 0.2 OUTLIER -71.25 -40.88 70.73 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 120.77 1.623 . . . . 2.9199999999999999 112.332 171.109 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -69.51 -45.12 69.64 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.872 1.269 . . . . 3.46 109.833 -177.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.68 -46.43 67.25 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.539 1.936 . . . . 3.1899999999999999 111.224 171.499 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -68.58 -27.28 65.92 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.252 1.021 . . . . 3.48 113.645 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 58.5 mt -72.0 -8.26 53.48 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 120.759 -1.213 . . . . 2.6699999999999999 113.51 175.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -98.56 0.23 44.54 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 114.73 1.382 . . . . 5.21 114.73 167.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 30.7 t70 . . . . . 0 N--CA 1.474 0.73 0 C-N-CA 125.148 1.379 . . . . 3.8599999999999999 111.466 165.967 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.479 0.991 0 CA-C-O 119.301 -0.381 . . . . 2.0 110.536 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -63.17 -14.86 44.44 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.273 1.982 . . . . 1.9099999999999999 112.446 173.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.01 -48.1 15.03 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.316 1.447 . . . . 2.71 111.155 171.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -52.1 -42.21 63.06 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.494 1.043 . . . . 3.9199999999999999 110.753 167.017 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 7' ' ' LYS . . . . . 0.444 ' HA ' ' CE ' ' B' ' 7' ' ' LYS . 0.0 OUTLIER -71.77 -25.87 62.21 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 114.781 1.4 . . . . 5.1399999999999997 114.781 178.965 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.31 -51.57 59.75 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 117.685 -1.15 . . . . 1.1000000000000001 111.439 165.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.2 mp -59.41 -40.64 87.33 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 121.05 1.75 . . . . 2.6699999999999999 111.898 173.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 40.3 m -53.78 -51.63 62.81 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.455 1.102 . . . . 1.54 110.001 173.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 90.8 m -53.48 -37.43 62.69 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.516 1.126 . . . . 1.4199999999999999 112.638 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 11.5 mtp -61.49 -47.04 87.44 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.105 0.562 . . . . 3.8599999999999999 111.671 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 4.0 p -76.02 -32.4 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-O 118.438 -0.791 . . . . 2.23 113.008 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 89.1 m -54.86 -56.72 16.43 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.171 1.35 . . . . 1.1599999999999999 110.547 175.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.43 -37.21 77.3 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.543 -0.753 . . . . 2.6800000000000002 109.705 -175.172 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -60.68 -52.93 63.05 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.626 0.77 . . . . 2.3500000000000001 112.673 175.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' HIS . . . . . 0.407 ' CE1' HD21 ' A' ' 84' ' ' ASN . 9.3 t60 -66.23 -38.0 86.86 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.75 0.82 . . . . 2.25 111.312 -178.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.563 ' HZ3' ' HB3' ' B' ' 18' ' ' LYS . 3.7 ttpm? -56.19 -58.94 5.8 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.86 1.264 . . . . 5.2300000000000004 112.069 170.582 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -67.36 -25.91 66.21 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 121.259 -0.901 . . . . 1.8400000000000001 112.699 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 61.1 m -63.33 -10.08 14.78 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.839 1.051 . . . . 1.6299999999999999 113.839 171.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -88.11 -7.4 73.68 Favored Glycine 0 CA--C 1.536 1.399 0 CA-C-O 118.347 -1.252 . . . . 1.4299999999999999 115.216 170.063 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 7.0 mmt180 -70.26 -3.59 17.86 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 120.406 2.103 . . . . 3.75 114.489 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -175.0 174.0 2.56 Favored 'General case' 0 C--O 1.247 0.94 0 C-N-CA 129.328 3.051 . . . . 3.6400000000000001 108.39 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -40.28 153.69 0.06 OUTLIER Glycine 0 N--CA 1.468 0.822 0 C-N-CA 126.469 1.985 . . . . 3.02 114.459 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 35.6 m 63.76 124.53 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.245 1.418 . . . . 3.5600000000000001 111.753 -176.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 24.1 tttt -102.08 -4.19 26.34 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 114.05 1.13 . . . . 7.4800000000000004 114.05 -178.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.506 ' H ' HD23 ' B' ' 27' ' ' LEU . 1.9 pt? -103.49 0.12 30.62 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.105 1.762 . . . . 3.6200000000000001 112.94 169.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 9.6 p -132.16 153.84 50.13 Favored 'General case' 0 C--O 1.249 1.052 0 C-N-CA 125.609 1.563 . . . . 1.3700000000000001 109.155 173.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.406 HD12 ' HB ' ' B' ' 67' ' ' ILE . 0.2 OUTLIER -110.42 124.56 51.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.375 -1.284 . . . . 1.76 109.537 158.527 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 9.7 p -59.25 165.63 2.57 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.015 0.526 . . . . 2.1600000000000001 111.225 167.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 23.4 ttt180 -52.5 -29.74 26.63 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 120.562 -1.336 . . . . 5.5899999999999999 114.117 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 tmtt? -79.34 -36.36 39.56 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.716 -1.24 . . . . 5.3200000000000003 112.863 177.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -63.85 -53.79 45.14 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.589 0.709 . . . . 1.9099999999999999 109.512 169.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 20.2 tp -51.74 -41.21 61.39 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 128.058 2.543 . . . . 2.2000000000000002 112.427 176.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 15.8 mttt -56.37 -46.85 79.84 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 121.079 -1.013 . . . . 3.25 112.476 -178.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -60.91 -53.22 59.91 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 117.761 -1.114 . . . . 3.8300000000000001 111.718 173.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -51.98 -53.47 41.1 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.429 1.013 . . . . 2.5 111.48 177.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 96.4 mt -60.35 -55.49 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-N 119.575 1.08 . . . . 1.22 109.12 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 25.6 ttpt -69.15 -15.19 63.35 Favored 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 113.281 0.845 . . . . 4.4500000000000002 113.281 -169.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 18.3 mmtp -85.77 -63.11 1.38 Allowed 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 127.49 2.316 . . . . 4.0700000000000003 112.402 170.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -75.41 -9.03 58.21 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.856 0.862 . . . . 4.8700000000000001 112.584 -171.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 89.6 mt -125.83 42.3 3.33 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.416 1.486 . . . . 3.2400000000000002 110.727 165.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 19.5 p -68.13 11.59 0.15 Allowed 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 115.444 1.646 . . . . 3.04 115.444 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -103.49 -6.3 21.94 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.005 1.722 . . . . 3.0299999999999998 113.843 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -131.87 -171.43 12.82 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 124.395 0.998 . . . . 3.0499999999999998 115.07 -170.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -74.65 53.78 0.58 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.213 1.805 . . . . 5.29 112.583 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.91 19.16 9.32 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.327 1.851 . . . . 3.3999999999999999 113.219 -179.218 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.0 ptmt -52.44 152.42 3.53 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.898 1.679 . . . . 3.9700000000000002 112.886 165.571 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -39.29 -54.77 1.8 Allowed 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 116.41 2.004 . . . . 3.79 116.41 -163.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 8.7 m -67.53 -23.19 65.42 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 114.458 1.281 . . . . 3.3700000000000001 114.458 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 8.2 t -65.79 -26.16 67.57 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 120.757 -1.214 . . . . 2.4500000000000002 111.125 169.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 74.7 mt -88.21 -8.75 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.988 1.315 . . . . 1.97 111.449 175.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -72.94 -44.93 60.59 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.051 -1.031 . . . . 3.4300000000000002 109.03 160.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.575 ' HA ' ' HE3' ' B' ' 57' ' ' LYS . 9.9 t0 -71.17 -47.34 58.21 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.508 0.594 . . . . 3.3700000000000001 112.355 176.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -59.17 -39.74 83.45 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 118.169 -0.919 . . . . 2.8399999999999999 111.05 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 27.6 tpp -53.79 -65.11 0.62 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.866 0.866 . . . . 2.48 109.26 169.322 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 57' ' ' LYS . . . . . 0.575 ' HE3' ' HA ' ' B' ' 54' ' ' ASP . 12.1 ttpp -48.16 -34.78 10.47 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.845 1.658 . . . . 4.5800000000000001 114.034 177.077 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 52.4 m -87.14 -30.57 20.96 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.312 1.045 . . . . 2.77 113.595 -174.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.1 pp -90.99 -36.27 14.18 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.211 -0.931 . . . . 2.6000000000000001 112.087 174.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 60' ' ' ASP . . . . . 0.426 ' O ' ' HE3' ' B' ' 61' ' ' LYS . 30.5 t70 -76.06 153.66 36.22 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.412 1.485 . . . . 2.7400000000000002 112.404 171.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 61' ' ' LYS . . . . . 0.426 ' HE3' ' O ' ' B' ' 60' ' ' ASP . 6.4 mmtp -130.36 15.35 5.56 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.401 1.26 . . . . 3.5299999999999998 114.401 -171.487 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -161.4 -3.42 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 117.028 2.233 . . . . 2.5499999999999998 117.028 -165.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 74.0 m 60.65 41.81 14.7 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.077 2.151 . . . . 2.6200000000000001 112.877 179.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 59.0 p30 -95.39 -17.98 21.11 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.495 1.518 . . . . 2.5699999999999998 112.76 -174.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 62.76 -12.31 0.08 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 129.85 3.26 . . . . 5.5700000000000003 115.806 -172.182 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -79.46 131.35 36.04 Favored 'General case' 0 C--O 1.249 1.07 0 CA-C-N 120.906 1.685 . . . . 3.8500000000000001 111.224 161.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 67' ' ' ILE . . . . . 0.406 ' HB ' HD12 ' B' ' 29' ' ' LEU . 33.6 mm -107.09 94.18 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 115.131 -0.94 . . . . 1.24 109.579 174.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -60.11 154.9 18.33 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.355 1.862 . . . . 2.96 112.262 168.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -46.55 -38.0 8.81 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.99 1.716 . . . . 2.6400000000000001 113.418 178.479 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -78.81 -38.22 38.79 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 120.648 -1.282 . . . . 3.2599999999999998 112.568 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -56.18 -52.56 63.93 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 119.237 0.926 . . . . 2.3399999999999999 108.749 168.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -52.09 -41.86 62.76 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.932 1.293 . . . . 2.5 113.454 174.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.7 -24.61 65.41 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.681 -1.262 . . . . 2.6000000000000001 113.514 176.336 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 79.7 t -73.67 -35.52 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 119.148 0.885 . . . . 1.76 110.666 172.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -59.98 -51.2 70.68 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.728 0.695 . . . . 1.8200000000000001 111.191 167.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 93.4 mt -58.87 -36.18 74.2 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 118.865 -0.588 . . . . 1.3600000000000001 112.329 176.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 95.1 m -59.88 -47.4 85.91 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.313 1.045 . . . . 0.75 111.109 173.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 57.4 mtm -58.17 -42.74 86.68 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.467 1.03 . . . . 1.5700000000000001 112.437 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 70.6 mt -65.6 -48.41 72.4 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.191 0.596 . . . . 1.6299999999999999 112.182 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 69.0 m -59.55 -43.14 93.63 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.284 0.634 . . . . 1.9299999999999999 111.839 176.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 23.8 mtp -64.97 -34.94 79.62 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.253 0.933 . . . . 2.0899999999999999 112.577 175.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.9 -45.51 77.74 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.808 0.731 . . . . 0.70999999999999996 112.154 176.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -67.65 -25.26 65.63 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.305 0.854 . . . . 2.4500000000000002 113.305 175.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -66.0 -47.25 75.12 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 119.066 0.848 . . . . 2.3799999999999999 111.058 176.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -67.2 -37.77 84.22 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.591 1.156 . . . . 2.71 112.23 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.16 -48.98 77.38 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.811 1.244 . . . . 2.1000000000000001 111.036 174.263 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -57.01 -33.03 66.75 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.07 0.948 . . . . 2.4199999999999999 113.008 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.86 -42.61 97.52 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.394 0.997 . . . . 3.5699999999999998 112.08 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -72.76 -32.25 65.51 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 114.777 1.399 . . . . 3.71 114.777 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 -75.22 -29.43 60.27 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.347 1.859 . . . . 4.3399999999999999 114.062 -177.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -105.83 10.1 32.67 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.362 1.065 . . . . 3.54 112.926 -172.242 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 3.3 ttpm? . . . . . 0 C--O 1.249 1.079 0 C-N-CA 129.584 3.154 . . . . 5.2000000000000002 116.69 -177.227 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 . . . . . 0 CA--C 1.549 0.905 0 N-CA-C 107.497 -1.298 . . . . 6.2199999999999998 107.497 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 35.3 p -70.94 166.88 33.37 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 126.441 1.896 . . . . 1.5800000000000001 111.835 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -59.61 -25.02 77.58 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 121.961 1.774 . . . . 1.3700000000000001 113.567 169.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tt -85.42 -38.07 19.09 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.521 1.055 . . . . 2.3999999999999999 112.272 178.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.2 tm-20 -54.34 -46.48 72.93 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.619 1.1 . . . . 4.7400000000000002 109.639 161.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.3 mtpt -64.91 -23.19 67.15 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 121.477 -0.765 . . . . 5.0999999999999996 111.991 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.06 -46.55 56.46 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.575 1.15 . . . . 0.91000000000000003 110.997 173.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -70.0 -39.61 75.78 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.793 1.237 . . . . 2.8900000000000001 112.942 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.3 m -58.88 -43.5 90.92 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.431 1.492 . . . . 1.95 110.793 168.242 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 53.5 m -60.32 -47.57 85.45 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.614 1.097 . . . . 1.3899999999999999 109.531 169.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.1 ttm -57.6 -49.61 75.85 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 117.316 -1.325 . . . . 2.9500000000000002 111.915 -175.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.9 p -69.68 -25.41 28.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 CA-C-N 119.992 1.269 . . . . 2.2799999999999998 112.978 174.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.8 m -66.58 -53.35 35.49 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 117.537 -1.221 . . . . 0.88 110.104 174.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -53.48 -42.78 67.61 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.822 0.737 . . . . 2.4900000000000002 109.113 167.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -63.31 -44.03 96.13 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 119.588 -0.845 . . . . 2.5 111.326 -170.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.3 m80 -73.19 -34.8 66.18 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 115.03 1.493 . . . . 1.98 115.03 171.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -67.86 -24.74 65.28 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.632 1.106 . . . . 4.9500000000000002 113.301 175.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -102.95 -42.66 5.75 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.769 1.628 . . . . 2.2999999999999998 113.048 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.0 m -67.58 -15.28 63.57 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 120.173 1.351 . . . . 2.7000000000000002 113.122 172.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.93 14.94 60.54 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 125.69 1.614 . . . . 1.8899999999999999 114.68 168.189 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.5 mmp_? -94.28 -3.16 51.08 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 119.627 1.714 . . . . 5.71 113.465 176.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 177.23 176.1 0.38 Allowed 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 129.39 3.076 . . . . 4.5599999999999996 110.558 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.65 -147.55 36.31 Favored Glycine 0 N--CA 1.47 0.944 0 C-N-CA 126.0 1.762 . . . . 2.0600000000000001 113.595 167.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.9 t -66.68 155.95 36.59 Favored 'General case' 0 C--O 1.25 1.085 0 O-C-N 120.718 -1.46 . . . . 3.6099999999999999 110.751 163.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.7 pttp -65.8 -24.11 66.84 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.745 1.218 . . . . 6.7000000000000002 112.165 169.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.3 tp -70.61 -52.54 20.74 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.192 1.397 . . . . 3.7200000000000002 109.339 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 65.4 p -96.12 155.97 16.53 Favored 'General case' 0 C--O 1.253 1.269 0 C-N-CA 124.719 1.208 . . . . 0.96999999999999997 112.948 -165.196 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -89.91 116.25 27.84 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 112.122 -2.308 . . . . 2.73 108.827 153.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.4 p -75.47 170.44 16.11 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.163 0.585 . . . . 2.1800000000000002 110.751 158.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.37 -45.31 3.03 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 125.51 1.524 . . . . 3.7599999999999998 113.195 178.024 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? -70.07 -45.01 67.94 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 119.943 -1.723 . . . . 6.2300000000000004 113.102 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -61.07 -41.46 96.65 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.951 0.9 . . . . 1.5900000000000001 110.693 -176.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.52 -40.86 98.16 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.303 1.841 . . . . 2.4500000000000002 112.077 -179.548 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.6 ttmt -64.74 -43.08 94.5 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.028 -1.045 . . . . 3.6099999999999999 112.277 171.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -64.24 -36.25 83.46 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.848 0.859 . . . . 4.1600000000000001 111.738 176.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.1 tp -65.88 -69.59 0.29 Allowed 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 128.058 2.543 . . . . 2.5699999999999998 111.608 177.058 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.3 mt -56.81 -51.35 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 CA-C-N 119.641 1.109 . . . . 1.03 110.32 -174.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -72.55 -4.35 30.09 Favored 'General case' 0 CA--C 1.555 1.156 0 O-C-N 121.279 -0.888 . . . . 4.0300000000000002 112.11 -173.458 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -96.56 -45.31 6.78 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-O 117.155 -1.402 . . . . 3.9300000000000002 112.715 159.433 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -51.81 -44.61 63.57 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 119.897 1.226 . . . . 4.2800000000000002 111.76 175.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.2 mt -139.19 66.5 1.41 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.632 2.773 . . . . 2.5499999999999998 108.798 -169.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.6 t -70.91 21.52 0.04 OUTLIER 'General case' 0 CA--C 1.559 1.304 0 O-C-N 120.534 -1.354 . . . . 4.29 114.556 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -83.51 162.2 20.99 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 120.186 -1.571 . . . . 4.0700000000000003 113.169 -174.014 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.38 -0.68 24.31 Favored Glycine 0 N--CA 1.477 1.381 0 N-CA-C 116.451 1.34 . . . . 3.3599999999999999 116.451 -171.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -75.4 -32.09 60.63 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 118.599 1.199 . . . . 7.1699999999999999 110.971 166.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.53 151.41 27.76 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.597 1.159 . . . . 3.0800000000000001 111.083 174.614 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.88 176.83 0.52 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 130.413 3.485 . . . . 4.5300000000000002 108.639 178.321 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -55.58 -51.4 67.26 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 120.942 1.701 . . . . 6.2199999999999998 110.344 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.0 m -67.34 60.26 0.06 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.799 2.04 . . . . 3.73 113.302 168.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.6 t 172.63 -54.53 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 129.311 3.045 . . . . 2.3399999999999999 108.877 -176.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 13.9 mm -61.72 -39.57 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.376 1.47 . . . . 1.54 111.802 174.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -69.9 -26.63 64.26 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.276 0.843 . . . . 3.3300000000000001 113.276 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -85.63 -32.25 22.13 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.286 0.948 . . . . 2.1800000000000002 112.266 173.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.54 -43.67 76.04 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.4 0.68 . . . . 2.9100000000000001 109.941 163.502 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.7 tpt -54.33 -29.71 48.88 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 119.526 1.057 . . . . 1.52 113.374 173.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.0 mttm -83.49 -31.71 26.35 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.617 1.167 . . . . 5.29 112.703 174.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 46.3 t -81.69 -32.94 31.49 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 126.217 1.807 . . . . 2.4199999999999999 113.699 -177.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -68.59 -39.04 81.1 Favored 'General case' 0 C--N 1.334 -0.065 0 C-N-CA 126.223 1.809 . . . . 2.2200000000000002 111.178 173.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -84.67 144.41 28.58 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.24 1.416 . . . . 2.2400000000000002 111.225 -176.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.7 ttmt -116.25 -27.75 6.75 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.256 1.206 . . . . 4.3499999999999996 114.256 -163.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -96.84 -67.42 0.85 Allowed 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.224 1.81 . . . . 3.0499999999999998 113.243 165.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 53.1 m 137.56 38.78 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.489 1 C-N-CA 133.071 4.548 . . . . 2.6699999999999999 110.71 -172.474 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.9 p30 -91.36 -15.8 28.44 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.205 -1.56 . . . . 2.3199999999999998 112.784 -177.213 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 61.4 5.49 1.18 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 128.324 2.65 . . . . 5.4800000000000004 115.287 -168.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -102.12 129.39 48.46 Favored 'General case' 0 C--O 1.24 0.599 0 C-N-CA 125.188 1.395 . . . . 3.6800000000000002 110.929 164.099 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 10.7 mm -99.69 105.91 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 124.467 1.107 . . . . 1.1000000000000001 110.908 175.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -79.94 154.1 28.51 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.721 2.409 . . . . 3.2000000000000002 109.366 166.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.02 -39.18 62.98 Favored 'General case' 0 CA--C 1.547 0.833 0 O-C-N 120.172 -1.58 . . . . 2.5899999999999999 113.867 -178.393 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.3 pttm -71.51 -12.96 61.65 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.393 1.257 . . . . 3.1099999999999999 114.393 175.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 73.2 mt-10 -79.67 -63.37 1.43 Allowed 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 108.299 -1.0 . . . . 1.72 108.299 158.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -49.97 -33.44 17.79 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 126.915 2.086 . . . . 2.3799999999999999 115.618 -171.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.2 t -58.14 -22.56 51.66 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.721 -1.237 . . . . 3.0 112.597 176.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 5.5 p -58.23 -46.22 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 CA-C-N 119.108 0.867 . . . . 2.2599999999999998 111.137 173.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -70.27 -48.23 57.71 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 125.783 1.633 . . . . 2.71 111.93 178.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.5 mt -53.85 -37.61 63.82 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 122.924 0.49 . . . . 1.8100000000000001 111.384 175.187 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 42.8 m -68.21 -51.31 46.99 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.733 1.213 . . . . 1.3 111.751 173.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 40.1 mtm -54.88 -42.58 72.26 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.803 1.183 . . . . 1.8 112.668 177.051 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.97 -47.53 82.77 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.403 0.681 . . . . 1.25 111.653 174.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 88.4 m -62.72 -35.7 80.59 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.511 0.93 . . . . 1.3999999999999999 113.511 175.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 58.9 mtp -62.25 -43.65 98.33 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 118.797 0.726 . . . . 2.4300000000000002 111.267 174.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.29 -41.26 85.72 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 122.844 0.458 . . . . 0.89000000000000001 111.522 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -72.3 -29.23 63.66 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.634 -0.666 . . . . 2.8599999999999999 111.868 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -65.15 -44.22 89.28 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.292 0.951 . . . . 1.8999999999999999 111.753 171.127 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -61.01 -45.31 95.31 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.258 1.023 . . . . 2.6800000000000002 111.515 174.031 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -53.29 -48.24 68.52 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.56 1.544 . . . . 2.4399999999999999 111.991 176.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -61.8 -34.47 75.97 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.78 1.232 . . . . 2.4399999999999999 112.275 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 79.9 mt -72.33 -16.86 61.88 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.62 0.97 . . . . 1.6000000000000001 113.62 178.34 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -95.16 -11.66 27.77 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.336 1.236 . . . . 3.1099999999999999 114.336 172.304 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.7 t70 . . . . . 0 N--CA 1.471 0.617 0 C-N-CA 125.818 1.647 . . . . 2.8399999999999999 113.034 -168.886 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.7 p . . . . . 0 N--CA 1.47 0.545 0 CA-C-O 119.516 -0.278 . . . . 1.8799999999999999 111.238 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -67.91 -16.69 45.98 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 122.211 1.941 . . . . 1.3899999999999999 111.742 173.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.26 -46.65 27.02 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-O 118.143 -0.932 . . . . 2.48 110.576 173.496 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -57.6 -48.13 80.26 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.708 1.14 . . . . 4.6600000000000001 109.612 172.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -62.5 -29.62 70.68 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.351 -0.843 . . . . 4.21 112.978 178.27 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.04 -43.31 79.02 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.491 1.117 . . . . 0.81999999999999995 111.822 171.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 32.8 mt -66.3 -40.83 90.26 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 119.346 0.975 . . . . 1.75 111.3 173.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 90.3 m -59.95 -42.51 94.21 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.993 1.317 . . . . 1.3100000000000001 111.686 172.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 92.2 m -59.47 -43.77 93.18 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.139 0.976 . . . . 1.3400000000000001 110.654 171.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -59.99 -51.82 68.04 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.605 0.762 . . . . 3.52 111.286 177.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 48.5 t -56.94 -31.6 36.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 125.078 1.351 . . . . 1.79 113.15 175.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 33.3 m -65.47 -55.26 18.92 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.406 1.082 . . . . 0.77000000000000002 110.491 175.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.8 -39.58 71.51 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.347 0.659 . . . . 1.6699999999999999 110.9 170.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -59.91 -53.84 53.11 Favored 'General case' 0 C--O 1.225 -0.196 0 O-C-N 123.778 0.674 . . . . 2.1200000000000001 109.285 -174.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -56.39 -49.25 75.01 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.598 -0.689 . . . . 2.4100000000000001 112.522 172.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.39 -26.44 67.84 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 114.13 1.159 . . . . 6.1399999999999997 114.13 -176.18 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -107.04 -32.42 7.86 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 120.438 -1.414 . . . . 2.2400000000000002 113.162 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 42.3 t -72.34 -38.22 68.67 Favored 'General case' 0 C--O 1.247 0.935 0 C-N-CA 125.191 1.396 . . . . 1.6699999999999999 113.167 176.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.69 2.86 81.63 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 125.58 1.562 . . . . 1.74 114.299 176.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -43.96 25.98 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.498 1.149 . . . . 3.1899999999999999 111.782 -171.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -159.97 -163.0 1.06 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.865 1.666 . . . . 3.9500000000000002 110.787 177.237 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 58.48 -135.94 51.48 Favored Glycine 0 N--CA 1.468 0.768 0 N-CA-C 109.301 -1.52 . . . . 2.3900000000000001 109.301 -171.031 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 5.3 t -82.84 162.08 21.74 Favored 'General case' 0 C--O 1.248 0.985 0 CA-C-O 124.4 2.048 . . . . 3.1600000000000001 112.105 152.127 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -91.65 143.31 26.69 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.543 1.537 . . . . 6.7000000000000002 108.674 171.136 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.3 tp 82.31 -15.04 0.72 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 128.174 2.59 . . . . 2.9500000000000002 112.868 -164.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 54.8 p -112.38 144.62 41.52 Favored 'General case' 0 C--O 1.246 0.874 0 C-N-CA 125.859 1.664 . . . . 1.0900000000000001 114.542 169.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 52.5 mt -94.11 101.41 13.43 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.069 2.148 . . . . 2.04 109.514 167.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.2 t -71.59 162.0 30.13 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 120.69 -1.257 . . . . 1.99 111.452 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 tmm_? -53.93 -14.28 0.97 Allowed 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 116.345 1.98 . . . . 5.0499999999999998 116.345 -174.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.01 -45.74 8.16 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.318 -1.488 . . . . 5.8700000000000001 113.302 164.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -52.36 -45.62 65.82 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.488 1.115 . . . . 1.6399999999999999 109.893 175.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -61.15 -56.62 18.74 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.5 1.52 . . . . 2.5299999999999998 111.924 -178.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -69.93 -27.45 64.78 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 119.933 -1.73 . . . . 3.5 112.935 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -70.78 -26.02 63.15 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.992 0.738 . . . . 3.3399999999999999 112.992 169.11 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 34.5 tp -72.66 -58.16 3.57 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-O 117.339 -1.315 . . . . 2.0299999999999998 110.813 172.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 38.2 mt -53.03 -49.24 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 CA-C-N 119.864 1.211 . . . . 1.1399999999999999 110.423 -178.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 22.6 mtpp -64.45 -12.15 40.64 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.262 1.208 . . . . 4.5099999999999998 114.262 -175.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -109.12 -27.15 9.76 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.524 1.53 . . . . 3.5899999999999999 113.256 172.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -72.22 -38.84 68.88 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 127.878 2.471 . . . . 4.96 113.22 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 43.1 mt -147.56 79.78 1.49 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.505 1.522 . . . . 3.6099999999999999 109.215 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 15.7 p -90.19 -16.48 29.38 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.397 1.258 . . . . 2.7799999999999998 114.397 -172.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -57.93 -2.24 0.15 Allowed 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 119.228 3.047 . . . . 3.71 119.228 -170.344 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 163.65 161.98 13.78 Favored Glycine 0 N--CA 1.472 1.056 0 CA-C-N 120.562 1.528 . . . . 3.9199999999999999 114.45 174.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 73.97 -45.69 0.6 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 127.504 2.321 . . . . 5.96 113.534 172.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 33.4 tpp -78.12 71.68 4.6 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 124.19 1.948 . . . . 2.1600000000000001 115.41 -148.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -84.84 168.77 14.79 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.555 2.342 . . . . 4.8799999999999999 111.879 170.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -52.96 -48.42 67.39 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.688 0.795 . . . . 3.54 112.085 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 53.3 p -68.14 -4.2 12.97 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.495 1.665 . . . . 4.3399999999999999 115.495 178.037 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 16.4 m -97.73 -26.71 14.64 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.641 1.11 . . . . 2.5699999999999998 112.229 165.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 81.2 mt -82.09 -49.0 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 125.27 1.428 . . . . 1.95 111.713 -177.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -75.82 -15.4 60.24 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.042 0.386 . . . . 4.04 112.042 -165.193 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -75.33 -41.95 55.55 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.436 0.695 . . . . 4.0300000000000002 112.021 160.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.34 -43.89 79.51 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.041 0.936 . . . . 3.1000000000000001 110.621 172.406 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 9.7 tpt -56.87 -47.87 79.43 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.951 2.1 . . . . 1.97 111.495 172.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.6 tmtt? -66.23 -24.91 66.69 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.409 1.084 . . . . 5.1799999999999997 113.487 173.534 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.7 t -84.06 -41.2 17.43 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 120.695 -1.253 . . . . 2.6000000000000001 112.086 -178.304 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 14.1 mt -57.01 -59.55 4.9 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 127.395 2.278 . . . . 2.71 111.155 164.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -85.64 56.29 3.89 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 123.139 1.447 . . . . 1.7 110.856 -171.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -58.05 -19.62 33.03 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.535 1.534 . . . . 6.5599999999999996 114.026 -169.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -95.55 -10.7 28.91 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 116.441 2.015 . . . . 1.75 116.441 174.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 23.0 t 62.2 32.69 17.17 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.2 1.4 . . . . 2.5499999999999998 114.4 -178.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 46.2 p30 -73.56 -18.5 61.07 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 121.106 -0.996 . . . . 2.2000000000000002 111.388 172.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 78.63 6.64 2.35 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 131.572 3.949 . . . . 4.3099999999999996 115.918 179.229 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -131.21 140.43 49.88 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.865 1.666 . . . . 2.3500000000000001 111.278 175.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 28.7 mt -110.15 118.96 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 O-C-N 121.152 -0.967 . . . . 1.23 111.988 -173.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -93.6 164.3 13.22 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 127.136 2.174 . . . . 3.1800000000000002 111.032 165.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -49.06 -32.52 9.72 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.016 1.726 . . . . 2.25 115.142 -176.78 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.92 -45.95 69.53 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.121 -0.987 . . . . 3.4399999999999999 111.164 179.34 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -58.25 -48.95 78.81 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.66 1.184 . . . . 1.76 109.326 171.304 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -56.54 -24.51 47.33 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 114.785 1.402 . . . . 2.1099999999999999 114.785 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 29.3 t -55.86 -27.83 53.53 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 120.422 -1.424 . . . . 2.6200000000000001 114.003 170.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 89.5 t -64.45 -50.53 75.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-N 119.244 0.929 . . . . 1.54 109.981 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -61.28 -45.58 93.9 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.107 0.963 . . . . 1.79 111.853 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 87.9 mt -56.26 -41.93 76.57 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 122.966 0.506 . . . . 2.0499999999999998 112.014 174.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 39.0 m -62.05 -46.72 87.89 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.91 0.884 . . . . 1.3700000000000001 111.34 174.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 88.5 mtp -61.17 -42.55 98.77 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.002 0.819 . . . . 2.3199999999999998 112.324 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 79.4 mt -61.36 -54.1 48.04 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.511 0.724 . . . . 1.8300000000000001 111.171 174.014 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 52.5 m -56.19 -40.95 74.76 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 114.048 1.129 . . . . 1.76 114.048 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 50.4 mtp -74.3 -31.06 62.34 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 118.666 -0.683 . . . . 2.5099999999999998 111.927 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.13 -36.46 72.1 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.73 0.696 . . . . 0.85999999999999999 111.411 172.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -65.23 -26.85 68.3 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 121.389 -0.82 . . . . 2.5299999999999998 112.784 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -61.53 -44.02 97.81 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 120.264 1.393 . . . . 2.5800000000000001 112.013 171.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -74.21 -35.16 63.9 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.92 0.888 . . . . 3.48 111.982 178.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -56.29 -45.9 79.99 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.829 1.251 . . . . 2.4100000000000001 111.094 170.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -63.38 -15.72 58.36 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.476 1.51 . . . . 2.1299999999999999 112.677 175.136 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 56.9 mt -98.92 -5.11 31.35 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.824 1.65 . . . . 2.6400000000000001 114.216 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -84.38 -32.72 24.04 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.655 1.182 . . . . 4.6200000000000001 112.809 161.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -75.35 -47.35 28.06 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.954 1.302 . . . . 3.0099999999999998 112.936 -174.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -83.44 28.65 0.54 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 125.255 1.422 . . . . 3.48 113.627 -176.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 44.1 mttp . . . . . 0 C--O 1.251 1.184 0 CA-C-O 115.01 -2.424 . . . . 5.5800000000000001 115.145 173.321 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 . . . . . 0 C--O 1.241 0.606 0 N-CA-C 106.658 -1.608 . . . . 4.96 106.658 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 75.9 p -55.9 161.33 3.58 Favored Pre-proline 0 N--CA 1.475 0.807 0 C-N-CA 126.657 1.983 . . . . 1.8300000000000001 112.166 175.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.44 -14.84 47.0 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 122.07 1.847 . . . . 1.9199999999999999 113.258 173.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -80.32 -48.37 13.09 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.893 1.224 . . . . 3.2599999999999998 111.375 173.364 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -55.55 -37.17 67.63 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 121.854 0.835 . . . . 4.2800000000000002 110.432 168.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.84 -37.51 87.86 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.719 -1.238 . . . . 3.3399999999999999 113.149 170.615 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.6 -44.05 91.82 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.228 1.011 . . . . 1.6399999999999999 112.026 174.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.0 mt -63.83 -45.31 90.14 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.692 0.797 . . . . 2.1099999999999999 110.711 175.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 49.2 m -52.61 -53.47 46.31 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.22 1.408 . . . . 2.0299999999999998 111.514 170.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.3 t -69.99 -31.52 69.24 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 118.051 -0.976 . . . . 2.8900000000000001 112.123 -177.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 37.8 mtt -60.59 -44.77 95.88 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.193 0.997 . . . . 3.0899999999999999 112.092 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 33.6 m -75.27 -25.7 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 119.571 1.078 . . . . 2.6499999999999999 112.812 175.663 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.3 m -69.29 -50.2 48.94 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.385 1.474 . . . . 1.23 111.555 177.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.4 p -60.53 -41.94 95.45 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.155 -0.684 . . . . 2.4100000000000001 109.155 172.114 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -65.0 -49.46 70.14 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 118.563 -0.732 . . . . 2.9700000000000002 111.236 -173.007 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.6 m80 -59.61 -43.96 93.59 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 120.301 1.409 . . . . 2.5099999999999998 113.276 172.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -63.45 -44.49 94.37 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.228 1.011 . . . . 3.7999999999999998 112.712 -175.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -76.55 -43.59 38.45 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.978 0.911 . . . . 2.1400000000000001 112.343 172.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.7 t -62.94 -26.0 68.61 Favored 'General case' 0 C--O 1.242 0.669 0 N-CA-C 115.347 1.61 . . . . 2.2200000000000002 115.347 -163.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.37 2.85 75.6 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 125.053 1.311 . . . . 2.2599999999999998 114.913 173.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.61 63.95 7.82 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.18 1.49 . . . . 6.7199999999999998 108.167 169.094 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 78.71 -171.37 0.06 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.927 1.691 . . . . 4.1200000000000001 112.984 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.84 -149.66 29.32 Favored Glycine 0 C--N 1.341 0.833 0 N-CA-C 109.363 -1.495 . . . . 2.5899999999999999 109.363 -159.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 63.7 m -76.98 166.83 22.79 Favored 'General case' 0 C--O 1.248 1.005 0 O-C-N 121.286 -1.126 . . . . 2.6499999999999999 112.017 151.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.8 ptmt -85.94 4.87 35.69 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 126.364 1.866 . . . . 4.9100000000000001 113.923 169.447 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 40.8 tp -96.93 -5.14 38.67 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.463 1.905 . . . . 3.4900000000000002 110.73 167.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.2 p -146.45 149.73 34.25 Favored 'General case' 0 C--O 1.253 1.263 0 N-CA-C 114.799 1.407 . . . . 0.97999999999999998 114.799 -161.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.2 mt -107.99 102.35 11.53 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 113.512 -1.676 . . . . 1.5600000000000001 110.137 173.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.3 t -75.85 173.24 11.42 Favored 'General case' 0 CA--C 1.552 1.031 0 O-C-N 120.884 -1.135 . . . . 2.79 112.764 173.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -55.52 -9.82 0.55 Allowed 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 127.615 2.366 . . . . 3.3900000000000001 117.272 -171.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.471 ' HG2' ' H ' ' A' ' 33' ' ' GLU . 7.0 ptmt -93.39 -50.39 5.47 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.741 1.385 . . . . 4.0300000000000002 114.741 164.022 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.471 ' H ' ' HG2' ' A' ' 32' ' ' LYS . 22.2 mt-10 -54.2 -41.12 68.26 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.663 1.985 . . . . 2.4199999999999999 108.933 176.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.455 ' CD1' HD11 ' A' ' 38' ' ' ILE . 0.9 OUTLIER -67.79 -47.94 67.72 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 114.333 -1.303 . . . . 2.3500000000000001 110.78 -175.635 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.632 ' HG2' HG21 ' A' ' 52' ' ' ILE . 68.3 mttt -55.24 -49.53 71.77 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.165 -0.959 . . . . 4.4000000000000004 112.108 171.415 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -66.78 -10.29 45.92 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.263 1.425 . . . . 3.4199999999999999 114.437 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.7 tt -94.27 -54.27 3.62 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.887 1.221 . . . . 1.9199999999999999 111.402 165.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.545 HD13 HD23 ' A' ' 55' ' ' LEU . 36.6 mt -53.52 -50.83 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 CA-C-N 119.978 1.263 . . . . 0.96999999999999997 110.999 -175.53 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.5 mtpt -71.99 -2.57 18.67 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.599 0.963 . . . . 3.9399999999999999 113.599 -177.173 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -101.97 -15.74 16.71 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.45 1.9 . . . . 3.1200000000000001 113.63 167.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -94.45 -55.07 3.29 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.423 1.489 . . . . 4.4199999999999999 112.544 178.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -68.69 91.04 0.42 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.806 2.042 . . . . 2.1899999999999999 110.332 -177.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.4 t -62.58 -17.04 59.26 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.876 1.27 . . . . 5.7599999999999998 112.5 173.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 28.0 mt -59.13 -25.74 64.12 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 127.908 2.483 . . . . 3.8500000000000001 113.765 171.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.67 -34.72 0.85 Allowed Glycine 0 CA--C 1.538 1.479 0 C-N-CA 125.233 1.397 . . . . 3.3700000000000001 116.456 170.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -67.17 -4.62 10.77 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.19 1.796 . . . . 5.25 114.762 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.5 tpt -69.89 78.71 0.47 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 123.514 1.626 . . . . 2.4500000000000002 109.795 167.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.6 ttmp? -94.53 147.65 23.06 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 127.894 2.478 . . . . 4.8499999999999996 111.658 -160.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -47.64 -44.39 26.92 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.984 2.113 . . . . 4.6100000000000003 115.463 -160.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.4 m -71.91 -35.46 69.7 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.002 1.274 . . . . 2.4700000000000002 113.36 176.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.7 m -74.36 -9.38 58.54 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.871 1.269 . . . . 2.3100000000000001 112.608 173.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.632 HG21 ' HG2' ' A' ' 35' ' ' LYS . 7.2 mm -79.75 -29.51 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-O 118.447 -0.787 . . . . 2.3700000000000001 110.908 166.681 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.36 -33.73 75.83 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.848 1.204 . . . . 2.5099999999999998 110.726 173.039 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -70.54 -43.42 69.57 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.174 0.897 . . . . 3.3100000000000001 112.507 168.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.545 HD23 HD13 ' A' ' 38' ' ' ILE . 37.1 tp -62.67 -46.42 88.29 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.387 -0.816 . . . . 1.95 111.559 178.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.09 -53.92 36.63 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 124.199 1.0 . . . . 2.7000000000000002 110.768 166.38 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 tmpt? -56.59 -28.81 61.16 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 120.243 1.383 . . . . 4.6100000000000003 113.25 177.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.2 m -83.76 -37.29 22.82 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.119 1.767 . . . . 1.8300000000000001 112.642 -177.424 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 11.0 mp -65.0 -49.87 68.54 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.538 0.735 . . . . 2.6000000000000001 110.661 163.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -88.97 59.69 5.13 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 127.406 2.283 . . . . 1.5700000000000001 112.139 -170.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.9 mtmp? -40.57 -32.69 0.22 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 127.456 2.302 . . . . 3.6499999999999999 115.764 -177.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -98.94 -6.51 28.66 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 115.651 1.722 . . . . 2.3599999999999999 115.651 -178.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.8 t 57.87 31.54 20.67 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.852 1.661 . . . . 2.7599999999999998 114.331 -178.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -69.07 -16.82 63.78 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.969 0.907 . . . . 2.2000000000000002 111.397 173.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.58 15.37 2.13 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 130.214 3.405 . . . . 3.98 114.368 178.459 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -131.18 133.84 45.92 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 127.841 2.456 . . . . 2.52 110.48 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.2 mm -107.34 99.45 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.129 0.972 . . . . 1.73 111.097 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -68.32 157.11 36.35 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.531 1.933 . . . . 2.8599999999999999 110.343 170.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.5 -35.23 52.56 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 120.13 1.332 . . . . 2.0299999999999998 113.001 179.404 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -63.91 -30.2 71.3 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.238 -0.914 . . . . 3.4100000000000001 113.182 174.021 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -83.56 -45.83 13.1 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.862 1.265 . . . . 2.6000000000000001 110.434 175.249 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -49.7 -44.16 47.97 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 126.19 1.796 . . . . 3.3900000000000001 111.812 176.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.5 t -60.56 -22.75 64.02 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 120.594 -1.317 . . . . 2.3500000000000001 114.121 176.139 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.7 t -68.89 -32.91 56.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 O-C-N 120.015 -1.678 . . . . 2.4399999999999999 110.882 176.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -60.55 -57.15 13.95 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.993 0.917 . . . . 1.8600000000000001 110.961 171.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -53.59 -43.49 68.61 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.965 0.906 . . . . 2.3599999999999999 111.344 176.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 58.9 m -51.97 -54.97 23.43 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.615 1.166 . . . . 0.93000000000000005 111.291 173.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 78.8 mtm -63.44 -43.04 98.57 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 118.817 -0.611 . . . . 1.72 112.412 -177.032 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 63.1 mt -63.21 -39.37 94.45 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.492 0.587 . . . . 1.3300000000000001 112.182 176.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.45 ' HB3' ' CZ ' ' B' ' 69' ' ' PHE . 87.9 m -65.06 -38.1 89.71 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 118.674 -0.679 . . . . 1.49 112.514 172.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 15.1 mtp -64.75 -36.07 83.13 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.453 1.024 . . . . 2.29 113.165 171.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.66 -53.08 53.06 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.295 0.952 . . . . 0.90000000000000002 111.946 174.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -65.04 -25.97 68.06 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.573 0.953 . . . . 2.46 113.573 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -60.31 -43.07 96.68 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.52 1.128 . . . . 3.0099999999999998 113.074 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -75.23 -45.02 42.97 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.014 1.326 . . . . 2.8100000000000001 111.358 178.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -49.76 -48.68 50.17 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.346 1.859 . . . . 2.0099999999999998 110.939 175.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -56.11 -27.12 52.67 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.462 1.505 . . . . 2.1099999999999999 113.386 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 43.6 mt -80.12 -27.87 39.08 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.184 -0.947 . . . . 1.53 112.432 178.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -87.36 -20.04 27.29 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.747 1.219 . . . . 2.73 113.888 175.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 26.6 t70 . . . . . 0 CA--C 1.54 0.572 0 C-N-CA 128.401 2.68 . . . . 2.8199999999999998 113.669 -178.741 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 41.3 p . . . . . 0 N--CA 1.471 0.607 0 CA-C-O 119.528 -0.272 . . . . 2.52 110.41 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -63.96 -23.9 67.68 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.341 2.027 . . . . 1.72 112.218 173.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 73.7 mt -75.07 -43.21 54.54 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.187 0.995 . . . . 3.3100000000000001 111.895 174.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -66.99 -28.57 68.36 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.011 1.278 . . . . 3.8700000000000001 112.086 168.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -36.07 82.88 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.188 -1.57 . . . . 4.9900000000000002 112.551 167.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.0 -44.79 68.64 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.287 1.035 . . . . 0.93000000000000005 112.371 171.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 50.2 mt -60.82 -42.36 97.54 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.86 1.209 . . . . 1.72 111.838 175.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 20.8 p -68.81 -37.48 79.25 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 117.776 -1.107 . . . . 2.0299999999999998 111.904 173.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 85.3 m -59.09 -42.81 91.37 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.944 1.247 . . . . 1.24 111.45 169.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 8.4 mtt -58.24 -51.44 69.77 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.678 0.791 . . . . 3.4300000000000002 110.61 175.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.32 -36.58 64.52 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 113.883 1.068 . . . . 1.76 113.883 173.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 90.7 m -63.22 -52.66 61.31 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.443 1.497 . . . . 0.70999999999999996 110.928 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.16 -39.1 65.92 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 114.878 -1.056 . . . . 2.5899999999999999 108.525 -175.681 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -57.53 -45.65 84.79 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.039 0.535 . . . . 2.1899999999999999 111.019 176.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 6.7 m80 -68.7 -29.46 67.9 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.776 1.028 . . . . 2.4100000000000001 113.776 177.155 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 18.7 ttmm -68.04 -28.31 67.28 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.35 1.06 . . . . 3.6099999999999999 113.475 176.225 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -85.79 -45.83 11.24 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.927 0.891 . . . . 2.7000000000000002 112.08 166.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 38.3 t -60.69 -27.25 67.73 Favored 'General case' 0 C--O 1.249 1.054 0 N-CA-C 114.524 1.305 . . . . 1.6699999999999999 114.524 -175.039 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.96 -2.25 90.28 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 116.637 -2.201 . . . . 1.46 115.268 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.4 mtp85 -75.11 -110.71 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.559 1.544 . . . . 3.75 110.207 172.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -44.37 129.55 6.49 Favored 'General case' 0 C--O 1.248 1.0 0 CA-C-N 120.48 1.491 . . . . 4.1699999999999999 111.201 171.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.43 -35.41 91.67 Favored Glycine 0 N--CA 1.469 0.848 0 CA-C-N 114.533 -1.212 . . . . 2.4300000000000002 115.64 -132.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 2.0 t -62.25 138.27 58.39 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.089 1.756 . . . . 4.1600000000000001 111.754 172.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -130.95 155.87 46.06 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.836 1.654 . . . . 6.1500000000000004 111.861 -169.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.0 mp 76.16 3.44 3.67 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 128.877 2.871 . . . . 4.1699999999999999 111.921 -157.158 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 10.9 p -143.47 149.03 36.98 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 131.322 3.849 . . . . 1.98 112.082 -166.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 50.4 mt -118.65 121.21 39.62 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.182 1.793 . . . . 2.0800000000000001 111.799 -176.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 4.7 t -91.77 -178.72 5.12 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.089 1.356 . . . . 2.2599999999999998 113.926 166.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 29.8 ttp85 -60.5 -23.91 64.9 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.144 2.177 . . . . 5.4299999999999997 116.597 -161.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 mptt -110.47 -19.44 12.93 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 115.095 1.517 . . . . 8.1199999999999992 115.095 172.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -54.8 -59.59 4.52 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.093 0.957 . . . . 2.3100000000000001 109.32 160.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -61.86 -39.66 92.64 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 127.101 2.16 . . . . 2.3300000000000001 110.963 -177.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -39.67 82.04 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.177 -1.577 . . . . 5.7699999999999996 113.993 178.489 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 32.7 tp10 -90.31 -21.46 22.04 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 118.003 -0.999 . . . . 4.0 112.611 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 37' ' ' LEU . . . . . 0.42 HD23 ' C ' ' B' ' 37' ' ' LEU . 5.7 tt -54.46 -62.37 1.7 Allowed 'General case' 0 C--N 1.343 0.315 0 CA-C-O 118.086 -0.959 . . . . 2.4300000000000002 109.499 164.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 35.1 mt -47.61 -57.62 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 C-N-CA 123.892 0.877 . . . . 1.29 110.479 -175.141 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -72.96 -2.39 20.78 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 113.894 1.072 . . . . 4.9900000000000002 113.894 -168.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 24.9 mttp -117.7 -33.6 4.48 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 120.358 -1.464 . . . . 3.1299999999999999 114.331 170.029 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -60.32 -41.32 93.24 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.839 1.255 . . . . 5.25 110.151 170.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -102.0 117.23 34.38 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 106.281 -1.748 . . . . 2.4500000000000002 106.281 158.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 9.2 t -110.1 -9.71 14.7 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.3 1.04 . . . . 3.8399999999999999 112.811 -171.139 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -54.61 -2.76 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 117.915 2.561 . . . . 3.9199999999999999 117.915 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.37 17.32 59.04 Favored Glycine 0 N--CA 1.476 1.307 0 CA-C-N 120.116 1.325 . . . . 4.6699999999999999 115.208 174.03 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.7 -163.4 1.02 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.359 1.464 . . . . 6.46 111.652 177.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 78.18 178.04 0.14 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.515 2.726 . . . . 3.2599999999999998 114.713 176.276 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -165.58 139.95 4.74 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.182 1.793 . . . . 7.3300000000000001 108.517 -175.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -61.56 -31.88 71.93 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 121.057 1.753 . . . . 4.7400000000000002 111.643 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.3 m -70.44 24.81 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.263 1.825 . . . . 3.0899999999999999 115.285 165.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -139.77 15.54 2.5 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.411 1.485 . . . . 2.6099999999999999 111.939 154.115 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 71.7 mt -112.28 -46.59 5.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.612 1.165 . . . . 1.3999999999999999 111.204 -176.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.83 -30.03 71.02 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.055 0.843 . . . . 3.71 111.586 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -78.6 -46.38 19.45 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 128.696 2.798 . . . . 5.3499999999999996 113.967 171.097 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 48.9 tp -58.25 -35.98 72.54 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.18 0.446 . . . . 2.5600000000000001 111.157 173.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.4 mmm -49.29 -46.24 46.24 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.899 1.28 . . . . 2.3199999999999998 111.194 171.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.3 mptt -68.72 -39.78 80.26 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.745 -1.222 . . . . 7.2000000000000002 112.129 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.5 t -64.98 -29.57 70.5 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-O 122.229 1.014 . . . . 1.8999999999999999 113.303 -176.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.2 mp -76.66 -21.35 55.56 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.594 1.158 . . . . 2.9399999999999999 112.717 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -89.14 127.67 35.74 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.968 1.307 . . . . 2.3399999999999999 110.133 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.32 11.53 21.05 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 120.616 -1.302 . . . . 3.8199999999999998 112.753 -170.286 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 33.4 p30 -163.45 -27.01 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.69 1.737 . . . . 2.3799999999999999 115.69 -165.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 29.9 t 70.38 51.96 0.36 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.436 1.495 . . . . 2.7999999999999998 110.603 -170.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 11.7 p30 -82.86 -54.57 5.0 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.48 1.512 . . . . 3.8999999999999999 109.871 -174.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 171.74 -25.5 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 131.656 3.982 . . . . 8.4299999999999997 113.881 169.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -154.96 154.54 32.74 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 125.331 1.452 . . . . 2.27 110.49 -163.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 3.1 mm -92.99 105.37 16.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 126.072 1.749 . . . . 1.6599999999999999 109.037 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.1 165.32 20.54 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.41 -0.806 . . . . 3.1499999999999999 110.631 167.091 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 69' ' ' PHE . . . . . 0.45 ' CZ ' ' HB3' ' A' ' 80' ' ' CYS . 0.4 OUTLIER -54.1 -38.57 65.51 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 120.421 -1.424 . . . . 3.73 112.997 178.642 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -76.67 -21.7 55.06 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.75 -1.219 . . . . 4.3899999999999997 113.69 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -69.75 -61.45 1.78 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.182 0.993 . . . . 2.2999999999999998 109.507 160.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.04 -32.85 70.13 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 128.504 2.721 . . . . 2.3100000000000001 114.866 -172.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 60.2 p -61.85 -14.75 36.34 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 119.482 -2.011 . . . . 1.76 113.299 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 5.1 p -60.67 -29.37 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 O-C-N 121.06 -1.025 . . . . 2.5499999999999998 112.486 170.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 75' ' ' PHE . . . . . 0.436 ' CZ ' HD11 ' B' ' 79' ' ' LEU . 67.7 t80 -75.77 -47.72 24.72 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.506 1.522 . . . . 2.25 111.33 175.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 93.8 mt -54.67 -35.7 63.82 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.225 0.61 . . . . 1.49 111.555 169.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 19.3 m -63.14 -53.81 47.5 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.199 0.999 . . . . 1.03 111.312 172.346 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 19.8 mtm -56.45 -49.7 73.85 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.93 0.892 . . . . 1.6599999999999999 112.191 177.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.436 HD11 ' CZ ' ' B' ' 75' ' ' PHE . 85.2 mt -60.94 -43.83 98.12 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.33 1.052 . . . . 1.5 111.589 178.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.6 t -72.59 -28.79 63.01 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 113.08 0.77 . . . . 2.1499999999999999 113.08 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 86.2 mtp -67.22 -42.74 83.57 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 118.996 0.816 . . . . 2.5499999999999998 111.074 170.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.06 -27.25 69.27 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 118.711 0.687 . . . . 1.1299999999999999 112.706 173.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -73.31 -28.62 62.18 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.311 1.226 . . . . 2.79 114.311 170.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -65.65 -44.79 85.28 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 120.275 1.398 . . . . 2.7599999999999998 109.804 170.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -67.67 -31.84 72.1 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.135 0.974 . . . . 2.9199999999999999 110.614 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.11 -50.88 70.14 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.763 1.225 . . . . 2.8700000000000001 111.852 167.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -59.61 -33.08 71.04 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.501 1.52 . . . . 2.0099999999999998 112.243 -177.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 94.2 mt -79.27 -18.62 52.39 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.836 1.254 . . . . 1.6799999999999999 113.782 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -95.13 -11.79 27.56 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 114.381 1.252 . . . . 3.54 114.381 176.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -94.23 -50.21 5.38 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.556 1.542 . . . . 3.1899999999999999 112.798 174.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -82.0 52.63 2.01 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.274 1.43 . . . . 2.6600000000000001 111.792 -174.404 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 57.2 mmtt . . . . . 0 C--O 1.248 1.021 0 C-N-CA 128.558 2.743 . . . . 4.9299999999999997 114.609 171.515 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 C--O 1.239 0.511 0 N-CA-C 106.126 -1.805 . . . . 3.7400000000000002 106.126 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.9 p -62.64 163.6 14.92 Favored Pre-proline 0 CA--C 1.54 0.561 0 C-N-CA 126.334 1.853 . . . . 1.4299999999999999 113.547 -167.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -67.86 -12.76 36.41 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 122.406 2.071 . . . . 1.29 113.342 169.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.08 -38.08 32.48 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.718 1.145 . . . . 2.3100000000000001 110.891 174.386 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -55.7 -53.97 49.98 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 108.473 -0.936 . . . . 4.7000000000000002 108.473 166.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.6 mttp -64.38 -25.08 67.87 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 112.316 0.488 . . . . 3.5099999999999998 112.316 -176.232 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.41 -47.02 58.65 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.203 0.91 . . . . 0.93000000000000005 111.722 171.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 43.5 mt -62.83 -44.53 95.9 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.02 0.928 . . . . 1.54 111.387 176.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 88.1 m -61.51 -46.4 90.14 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.459 1.903 . . . . 1.45 111.908 173.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.8 m -61.67 -45.48 93.83 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.215 0.916 . . . . 1.47 110.468 177.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -60.49 -52.61 64.46 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.618 0.645 . . . . 3.7599999999999998 110.937 -177.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.7 p -63.95 -23.63 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 O-C-N 120.96 -1.088 . . . . 2.2000000000000002 113.318 177.623 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.9 m -65.87 -58.3 5.91 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 117.721 -1.133 . . . . 1.03 109.826 172.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -40.3 66.57 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.822 0.849 . . . . 2.1299999999999999 110.291 175.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -57.31 -49.59 75.61 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 124.718 1.261 . . . . 2.1699999999999999 110.433 -174.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -61.97 -42.22 98.88 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.274 -0.892 . . . . 2.2200000000000002 112.633 175.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -69.5 -36.41 76.46 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.838 -1.164 . . . . 6.8899999999999997 112.764 -176.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -85.12 -20.08 30.85 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.414 1.486 . . . . 2.3700000000000001 114.567 172.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.7 p -55.84 -32.23 63.43 Favored 'General case' 0 N--CA 1.485 1.303 0 O-C-N 119.79 -1.819 . . . . 2.4399999999999999 113.509 171.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 109.72 -131.31 10.41 Favored Glycine 0 C--N 1.34 0.792 0 CA-C-N 114.255 -1.339 . . . . 2.6699999999999999 114.298 126.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -123.32 -14.64 7.39 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 127.112 2.165 . . . . 5.1200000000000001 111.85 -171.56 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -131.59 153.3 50.03 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 126.96 2.104 . . . . 4.2199999999999998 111.705 -170.664 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.64 -124.32 34.19 Favored Glycine 0 C--N 1.337 0.625 0 CA-C-N 113.302 -1.772 . . . . 2.1800000000000002 109.75 -169.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 42.2 t -98.08 168.99 9.93 Favored 'General case' 0 C--O 1.252 1.19 0 CA-C-O 122.651 1.215 . . . . 2.9700000000000002 111.434 160.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -107.95 22.37 16.06 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 129.594 3.157 . . . . 4.96 111.987 175.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.4 tp -96.0 -5.02 42.12 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.463 1.105 . . . . 3.4900000000000002 110.386 153.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.1 p -150.6 135.69 17.68 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 113.173 0.805 . . . . 1.0800000000000001 113.173 -151.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.5 mp -98.53 108.91 21.72 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.783 1.233 . . . . 2.21 112.297 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.1 p -64.26 158.15 24.03 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 124.562 1.145 . . . . 3.04 112.54 167.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.7 tpt180 -44.39 -43.52 7.7 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.479 0.918 . . . . 4.6900000000000004 113.479 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.77 -33.53 66.36 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.039 1.125 . . . . 4.0599999999999996 114.039 179.599 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -64.86 -51.46 61.91 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.518 1.527 . . . . 2.21 108.589 173.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.3 tp -58.34 -41.64 85.07 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.027 0.931 . . . . 2.3300000000000001 112.732 175.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tmpt? -53.79 -33.68 56.74 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.41 0.684 . . . . 6.9000000000000004 112.385 177.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -79.51 -48.76 13.33 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 118.538 -0.744 . . . . 3.9700000000000002 111.191 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.3 tp -49.15 -59.84 3.31 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.306 1.042 . . . . 1.95 111.263 177.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.5 mt -57.99 -35.0 50.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 123.242 0.617 . . . . 1.1799999999999999 110.556 -177.286 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -72.71 -2.88 21.99 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.563 1.32 . . . . 4.2199999999999998 114.563 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt -133.1 -28.34 1.54 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 127.124 2.17 . . . . 3.1400000000000001 112.476 -172.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -68.54 -123.29 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 107.701 -1.222 . . . . 4.1200000000000001 107.701 144.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -56.98 -53.12 61.69 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 115.869 1.803 . . . . 2.3999999999999999 115.869 -158.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 17.0 t 62.07 -4.06 0.22 Allowed 'General case' 0 CA--C 1.558 1.269 0 N-CA-C 116.59 2.07 . . . . 3.9199999999999999 116.59 172.527 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -42.82 -49.56 5.76 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 115.911 1.819 . . . . 4.9299999999999997 115.911 -151.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.81 -37.13 0.43 Allowed Glycine 0 N--CA 1.468 0.78 0 C-N-CA 124.781 1.181 . . . . 3.6899999999999999 112.98 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -61.87 -35.36 78.07 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.214 1.006 . . . . 7.3099999999999996 111.834 172.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -71.37 63.53 0.38 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 127.027 2.131 . . . . 2.3100000000000001 114.347 -178.091 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.6 mmmt -92.26 165.23 13.21 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 129.285 3.034 . . . . 7.7800000000000002 109.788 161.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.509 ' CD ' ' H ' ' A' ' 49' ' ' GLU . 3.0 mp0 -42.38 -51.41 4.91 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.106 1.762 . . . . 4.7599999999999998 114.654 -168.803 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.1 m -71.99 -28.21 63.26 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 114.964 1.468 . . . . 2.9300000000000002 114.964 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.4 t -76.22 -27.52 56.85 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 120.316 -1.49 . . . . 1.8899999999999999 111.004 170.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 74.8 mt -74.11 -22.94 18.39 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 O-C-N 121.327 -0.858 . . . . 1.74 111.039 169.067 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.27 -51.28 54.87 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.91 1.284 . . . . 3.73 110.488 168.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.472 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 3.4 t70 -69.15 -39.74 78.62 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.269 0.47 . . . . 2.3199999999999998 112.269 178.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 57.4 tp -63.78 -50.9 67.19 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 116.524 -1.703 . . . . 2.0499999999999998 110.757 173.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.1 ttt -53.81 -48.53 69.78 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-N 121.305 1.866 . . . . 1.5700000000000001 110.31 174.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.472 ' HE2' ' HA ' ' A' ' 54' ' ' ASP . 2.4 tmmm? -56.37 -29.47 61.47 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.191 0.996 . . . . 3.4100000000000001 113.502 174.166 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 24.4 t -77.24 -33.2 56.1 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 120.215 -1.553 . . . . 2.1200000000000001 112.912 174.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 18.9 mt -80.56 -47.57 14.0 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.793 0.724 . . . . 2.1299999999999999 111.821 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -79.14 79.07 5.58 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 127.964 2.505 . . . . 2.1800000000000002 111.918 -163.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -68.32 -18.35 64.48 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 116.516 2.043 . . . . 3.7999999999999998 116.516 -177.253 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.84 -26.99 49.77 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 120.641 1.564 . . . . 2.6699999999999999 111.669 161.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.3 m 58.77 76.21 0.36 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.79 2.036 . . . . 3.5 111.413 177.125 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -146.27 -109.0 0.1 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.305 -0.861 . . . . 3.2000000000000002 110.082 -151.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -139.49 -20.7 0.93 Allowed 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 115.522 1.675 . . . . 5.6100000000000003 115.522 168.543 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -130.82 153.08 49.46 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 122.95 1.357 . . . . 3.8500000000000001 113.651 174.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 27.3 mt -90.2 113.9 27.02 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 C-N-CA 126.863 2.065 . . . . 2.3500000000000001 110.55 173.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -64.77 156.99 28.77 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.579 1.151 . . . . 3.6299999999999999 110.662 163.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -57.15 -28.98 63.22 Favored 'General case' 0 CA--C 1.549 0.937 0 O-C-N 120.897 -1.127 . . . . 2.9100000000000001 110.859 165.51 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.81 -25.88 63.98 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 120.097 -1.627 . . . . 6.2599999999999998 113.746 174.2 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -80.97 -53.21 6.64 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.672 1.189 . . . . 2.4199999999999999 109.288 170.465 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -48.67 -23.93 1.19 Allowed 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 127.273 2.229 . . . . 2.46 114.573 176.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 47.0 m -52.9 -36.22 59.11 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.647 1.579 . . . . 2.27 112.537 171.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 p -79.65 -30.24 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 121.621 -0.674 . . . . 2.1899999999999999 111.696 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -60.23 -56.91 15.76 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.749 0.82 . . . . 1.79 110.611 173.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.1 mt -58.84 -34.62 71.76 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.678 0.791 . . . . 1.6100000000000001 112.625 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 84.1 m -62.71 -54.27 41.84 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.459 1.104 . . . . 0.87 111.173 173.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 46.6 mtp -54.58 -47.02 73.83 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.243 0.928 . . . . 1.78 111.364 177.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.74 -50.21 71.96 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.401 1.08 . . . . 1.46 112.392 178.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 93.1 m -63.82 -33.95 76.83 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.192 0.906 . . . . 1.72 113.429 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 92.5 mtp -64.16 -43.89 93.79 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.221 0.918 . . . . 1.8400000000000001 111.129 175.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.53 -39.73 92.13 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.07 0.548 . . . . 0.72999999999999998 112.272 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -62.44 -31.64 72.38 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.387 0.884 . . . . 2.2799999999999998 113.387 174.087 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 15.2 t30 -73.29 -37.18 66.31 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.631 1.105 . . . . 1.79 112.134 178.097 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.88 -37.99 89.48 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.195 0.998 . . . . 3.0600000000000001 112.123 167.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.05 -43.38 91.7 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.865 0.866 . . . . 1.95 111.267 174.451 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -63.35 -32.2 73.56 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.367 1.467 . . . . 2.3599999999999999 112.007 176.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 35.0 mt -74.94 -17.97 60.47 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.189 -0.944 . . . . 1.4199999999999999 113.025 175.162 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -94.61 4.24 54.09 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.969 1.707 . . . . 2.6299999999999999 113.779 169.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 11.0 t70 . . . . . 0 N--CA 1.474 0.753 0 C-N-CA 124.889 1.276 . . . . 4.04 110.975 164.068 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 2.6 p . . . . . 0 N--CA 1.476 0.871 0 CA-C-O 119.732 -0.175 . . . . 2.5600000000000001 111.175 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -73.93 -10.65 23.2 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.393 2.062 . . . . 1.8100000000000001 112.744 169.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -67.9 -54.58 17.69 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.693 1.197 . . . . 2.75 111.662 -177.631 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -57.37 -30.85 65.21 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 118.996 0.816 . . . . 4.0899999999999999 111.979 175.182 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -74.89 -33.92 62.12 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 120.522 -1.361 . . . . 5.4000000000000004 111.848 176.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.22 -46.19 65.01 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.472 1.509 . . . . 0.81999999999999995 111.304 173.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.3 mp -66.65 -36.73 83.26 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.14 0.882 . . . . 2.4399999999999999 111.381 176.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 54.5 m -56.21 -48.36 76.58 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 121.592 -0.692 . . . . 1.55 111.07 166.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 90.4 m -62.46 -35.46 79.38 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.629 1.172 . . . . 1.1699999999999999 111.766 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -54.84 -59.9 4.1 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 118.439 -0.791 . . . . 3.5600000000000001 110.607 166.612 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 17.8 m -67.83 -17.89 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 CA-C-N 120.332 1.424 . . . . 2.1800000000000002 113.588 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 62.3 m -71.83 -48.87 43.19 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.752 1.621 . . . . 0.78000000000000003 111.171 171.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 64.5 p -58.07 -33.35 68.95 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 118.202 -0.904 . . . . 2.1800000000000002 110.101 166.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -72.76 -49.54 30.23 Favored 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 119.713 1.142 . . . . 2.4900000000000002 111.834 -175.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -72.63 -17.45 61.67 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 120.171 -1.58 . . . . 2.4100000000000001 114.459 178.109 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -82.72 -66.46 0.89 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.392 0.677 . . . . 4.6100000000000003 111.77 166.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -69.69 -29.98 67.54 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.591 1.087 . . . . 1.97 113.633 -175.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 19.9 p -70.91 -19.31 62.61 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 122.445 2.384 . . . . 1.8 111.986 172.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -94.04 17.69 58.28 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 126.886 2.184 . . . . 2.2000000000000002 113.477 168.161 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 51.2 tpt85 -72.9 -28.89 62.74 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.207 1.004 . . . . 3.5499999999999998 111.193 169.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -157.63 153.81 27.38 Favored 'General case' 0 C--O 1.251 1.149 0 C-N-CA 125.866 1.667 . . . . 3.4900000000000002 111.952 170.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.66 -136.35 36.89 Favored Glycine 0 C--N 1.335 0.528 0 C-N-CA 125.559 1.552 . . . . 2.79 112.014 168.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 11.4 m -58.02 128.42 37.0 Favored 'General case' 0 C--O 1.246 0.915 0 O-C-N 122.292 -0.534 . . . . 3.0 111.181 174.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -76.46 111.79 12.3 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 126.134 1.773 . . . . 7.6799999999999997 107.315 148.353 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 35.4 tp 141.72 -41.69 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 130.038 3.335 . . . . 3.9700000000000002 106.925 -161.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 71.0 p -121.6 141.71 50.83 Favored 'General case' 0 C--O 1.255 1.36 0 CA-C-O 123.22 1.486 . . . . 1.53 112.903 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 22.0 mt -93.72 95.98 9.51 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 111.83 -2.441 . . . . 1.75 107.267 157.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 6.6 m -65.58 155.97 34.15 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 120.721 -1.237 . . . . 2.3399999999999999 110.441 169.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 25.2 ttt180 -41.54 -29.1 0.15 Allowed 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 117.43 2.381 . . . . 4.2400000000000002 117.43 -174.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -85.88 -38.04 18.49 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 115.229 1.566 . . . . 4.5800000000000001 115.229 172.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -56.78 -48.53 77.7 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.049 0.94 . . . . 1.77 108.918 167.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 14.4 tp -63.52 -43.9 95.83 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.055 0.942 . . . . 1.8999999999999999 111.899 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 35' ' ' LYS . . . . . 0.544 ' HE2' HG21 ' B' ' 52' ' ' ILE . 23.4 ttmt -56.5 -47.17 79.88 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 119.268 -0.396 . . . . 3.0800000000000001 111.738 179.084 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.438 ' HG2' ' CE ' ' B' ' 40' ' ' LYS . 33.8 tt0 -59.61 -44.2 93.49 Favored 'General case' 0 CA--C 1.553 1.08 0 N-CA-C 113.452 0.908 . . . . 3.3500000000000001 113.452 174.522 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 31.3 tp -61.18 -55.67 29.61 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.812 1.245 . . . . 1.9099999999999999 111.186 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 19.7 mt -59.07 -52.57 59.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 108.889 -0.782 . . . . 1.0600000000000001 108.889 -178.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.3 -27.15 67.07 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 113.937 1.088 . . . . 5.79 113.937 -173.543 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 40' ' ' LYS . . . . . 0.438 ' CE ' ' HG2' ' B' ' 36' ' ' GLU . 35.9 mtmt -85.49 -53.81 4.96 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 120.093 1.315 . . . . 3.9100000000000001 114.516 170.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -72.73 -31.21 64.8 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 118.245 0.475 . . . . 4.79 110.937 -171.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -110.27 72.56 0.8 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.078 1.351 . . . . 2.4300000000000002 108.911 161.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.7 t -71.39 61.81 0.34 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.971 1.308 . . . . 3.5899999999999999 112.306 174.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.25 166.84 11.21 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 127.337 2.255 . . . . 4.4400000000000004 112.402 -173.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -85.9 -72.64 1.29 Allowed Glycine 0 C--N 1.338 0.649 0 C-N-CA 125.291 1.424 . . . . 3.5800000000000001 109.676 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 46' ' ' GLU . . . . . 0.519 ' H ' ' CD ' ' B' ' 46' ' ' GLU . 1.2 pm0 -40.27 -30.61 0.11 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 128.831 2.852 . . . . 6.0499999999999998 115.258 164.652 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -72.99 53.37 0.35 Allowed 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.792 -1.193 . . . . 2.3999999999999999 111.431 163.192 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.465 ' HA ' ' HE2' ' B' ' 48' ' ' LYS . 2.7 mmpt? -59.09 159.81 6.91 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 123.157 1.456 . . . . 5.3200000000000003 111.443 172.144 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -76.87 -8.52 57.5 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.381 -0.825 . . . . 6.1299999999999999 113.103 -156.011 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 12.3 t -102.6 -14.76 16.62 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.022 1.729 . . . . 3.1600000000000001 113.872 162.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 4.5 m -62.44 -28.48 69.84 Favored 'General case' 0 N--CA 1.482 1.157 0 CA-C-N 121.259 1.845 . . . . 2.6200000000000001 110.493 166.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 52' ' ' ILE . . . . . 0.544 HG21 ' HE2' ' B' ' 35' ' ' LYS . 14.0 mm -52.36 -37.24 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 126.461 1.904 . . . . 1.3100000000000001 113.253 165.389 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -82.92 -27.22 30.75 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.164 0.985 . . . . 3.7200000000000002 112.592 -173.375 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.76 -46.94 67.49 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 118.428 -0.796 . . . . 2.5 110.461 161.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -54.56 -49.04 71.3 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.407 1.083 . . . . 2.46 110.558 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.42 -48.89 79.2 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.982 0.913 . . . . 1.9099999999999999 111.765 174.226 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -18.58 62.13 Favored 'General case' 0 CA--C 1.555 1.144 0 N-CA-C 114.634 1.346 . . . . 3.4700000000000002 114.634 172.123 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.9 m -94.13 -29.79 14.97 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.41 1.884 . . . . 2.7999999999999998 112.483 -179.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 96.2 mt -74.91 -49.14 21.3 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.475 1.11 . . . . 2.1499999999999999 111.082 165.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -82.84 63.92 7.19 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 125.998 1.719 . . . . 2.3100000000000001 111.643 -172.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 27.7 mttm -56.09 -20.47 17.35 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.084 1.754 . . . . 4.04 112.194 175.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -72.42 -32.58 66.46 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.511 1.924 . . . . 2.1600000000000001 113.877 174.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 21.2 t 62.93 29.38 16.51 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.675 1.19 . . . . 3.04 113.227 -161.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 10.0 p30 -86.44 -14.53 43.0 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.4 1.48 . . . . 2.1699999999999999 112.462 -177.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 69.46 2.06 3.58 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 128.979 2.911 . . . . 5.0300000000000002 116.923 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -100.53 147.34 26.03 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 127.783 2.433 . . . . 2.8300000000000001 110.923 167.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 43.3 mm -106.4 103.52 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 108.128 -1.064 . . . . 1.1200000000000001 108.128 160.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.26 165.51 23.51 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.578 1.551 . . . . 2.5 110.738 165.323 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -52.59 -26.21 12.78 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 115.222 1.564 . . . . 2.2400000000000002 115.222 -175.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.3 -43.84 16.99 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 120.649 -1.282 . . . . 3.3700000000000001 111.647 177.267 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -55.92 -35.53 66.71 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.29 1.036 . . . . 2.3100000000000001 110.133 169.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -76.87 -38.55 53.45 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.365 1.866 . . . . 3.3199999999999998 113.498 176.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 51.9 p -73.05 -34.61 66.39 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 119.767 -1.833 . . . . 1.8600000000000001 111.72 176.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.8 p -69.28 -29.81 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.143 0.883 . . . . 2.46 112.352 172.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 75' ' ' PHE . . . . . 0.568 ' CZ ' HD11 ' B' ' 79' ' ' LEU . 15.8 t80 -59.06 -57.79 11.5 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.179 -0.951 . . . . 1.7 111.382 166.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 96.6 mt -62.03 -29.47 70.3 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.462 0.705 . . . . 1.8899999999999999 112.321 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 45.5 m -63.37 -53.34 53.99 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.856 1.262 . . . . 1.46 111.622 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 74.1 mtm -59.41 -39.74 84.44 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 119.173 0.897 . . . . 2.0499999999999998 111.471 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.568 HD11 ' CZ ' ' B' ' 75' ' ' PHE . 95.8 mt -61.83 -56.43 19.54 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.12 0.568 . . . . 2.02 111.608 173.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 5.1 t -60.3 -32.45 71.22 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.218 0.917 . . . . 1.6599999999999999 112.592 -177.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 76.9 mtp -71.63 -33.15 68.7 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.841 1.052 . . . . 2.46 113.841 170.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.19 -35.51 81.03 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 120.535 1.516 . . . . 1.0900000000000001 112.391 172.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -64.25 -19.6 65.49 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.215 -0.928 . . . . 2.8100000000000001 112.947 171.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -66.72 -45.21 79.45 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.771 1.169 . . . . 1.8899999999999999 112.063 170.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.88 -46.3 78.87 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.565 1.146 . . . . 3.8500000000000001 110.244 177.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -53.08 -47.38 68.56 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.942 1.697 . . . . 2.73 112.19 175.31 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -61.15 -27.74 68.61 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.476 1.51 . . . . 2.3399999999999999 113.163 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 43.8 mt -79.38 -13.57 59.53 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.208 1.003 . . . . 1.98 112.949 178.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 89' ' ' GLU . . . . . 0.419 ' OE2' ' HE2' ' B' ' 92' ' ' LYS . 44.7 mm-40 -108.21 8.53 27.95 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.161 1.785 . . . . 3.6499999999999999 113.081 168.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -107.03 -54.77 2.42 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.849 1.259 . . . . 3.6800000000000002 112.145 174.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.28 31.75 0.51 Allowed 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 124.904 1.282 . . . . 3.0600000000000001 112.678 176.556 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 92' ' ' LYS . . . . . 0.419 ' HE2' ' OE2' ' B' ' 89' ' ' GLU . 2.1 ptmm? . . . . . 0 C--O 1.257 1.469 0 N-CA-C 117.314 2.338 . . . . 4.5599999999999996 117.314 -157.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 . . . . . 0 N--CA 1.461 0.101 0 N-CA-C 113.267 0.84 . . . . 5.4900000000000002 113.267 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 44.2 p -111.62 160.02 31.08 Favored Pre-proline 0 N--CA 1.468 0.474 0 CA-C-N 116.002 -0.545 . . . . 1.3799999999999999 111.845 -156.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -59.37 -21.22 59.94 Favored 'Trans proline' 0 CA--C 1.536 0.588 0 C-N-CA 121.771 1.648 . . . . 1.23 111.63 166.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.79 -49.9 14.78 Favored 'General case' 0 C--N 1.344 0.361 0 CA-C-O 118.333 -0.842 . . . . 2.4300000000000002 110.525 174.376 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -62.93 -33.02 74.47 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 120.792 1.633 . . . . 3.4700000000000002 111.875 176.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -67.92 -25.12 65.32 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.665 -1.272 . . . . 4.25 113.04 172.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.49 -44.53 34.99 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.827 0.851 . . . . 0.96999999999999997 111.936 172.052 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.7 mt -64.13 -40.53 96.37 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 121.107 -0.996 . . . . 1.48 111.962 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.6 p -61.97 -45.16 94.87 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 117.511 -1.233 . . . . 2.4700000000000002 111.162 171.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 54.3 m -53.91 -38.22 64.6 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 119.16 0.891 . . . . 1.29 111.54 173.527 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.1 tpp -56.3 -48.46 76.62 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 118.766 -0.635 . . . . 3.25 111.89 175.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.7 m -72.27 -29.53 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 119.462 1.028 . . . . 2.2200000000000002 112.67 175.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.8 m -57.43 -57.87 10.77 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.827 1.194 . . . . 0.93999999999999995 111.472 175.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.92 -24.51 58.52 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.62 0.768 . . . . 2.6600000000000001 110.311 -178.238 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -65.33 -59.23 4.26 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-O 117.982 -1.008 . . . . 2.0699999999999998 111.535 170.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -58.78 -42.23 88.51 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 120.782 1.628 . . . . 3.1800000000000002 112.656 -175.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.5 tttt -39.55 -53.71 2.06 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.246 2.218 . . . . 5.7300000000000004 113.937 168.161 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -95.95 -29.47 14.14 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.31 1.226 . . . . 2.5099999999999998 114.31 -178.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.8 t -73.43 -34.12 65.28 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 127.073 2.149 . . . . 2.0 113.181 -177.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -73.57 -22.04 78.86 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 124.319 0.961 . . . . 2.04 112.338 170.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -86.21 68.74 10.36 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.188 1.395 . . . . 5.0199999999999996 110.206 -177.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.493 ' HG2' ' H ' ' A' ' 24' ' ' GLY . 8.8 tt0 102.78 -176.76 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 129.638 3.175 . . . . 3.9900000000000002 111.588 173.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.493 ' H ' ' HG2' ' A' ' 23' ' ' GLU . . . 57.93 -145.12 40.87 Favored Glycine 0 N--CA 1.47 0.926 0 C-N-CA 124.895 1.236 . . . . 2.0899999999999999 110.7 -170.267 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -79.51 169.49 17.96 Favored 'General case' 0 CA--C 1.553 1.066 0 O-C-N 121.504 -0.998 . . . . 2.4900000000000002 111.054 153.001 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.5 ptpp? -94.66 -5.65 45.11 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.66 1.584 . . . . 5.5499999999999998 115.161 -173.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 25.8 tp -100.96 4.54 42.6 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.609 1.564 . . . . 3.5800000000000001 111.012 169.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 55.0 p -142.6 144.94 33.06 Favored 'General case' 0 C--O 1.246 0.911 0 C-N-CA 125.991 1.717 . . . . 0.92000000000000004 112.397 -165.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 26.1 tp -113.72 88.12 2.77 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.787 1.635 . . . . 2.8199999999999998 108.891 -172.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -59.93 160.98 7.07 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.531 1.533 . . . . 2.0 114.922 -176.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.59 -20.32 1.16 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 128.374 2.669 . . . . 3.21 114.744 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.81 -26.09 13.89 Favored 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 119.98 1.264 . . . . 3.6899999999999999 113.629 167.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -66.16 -53.7 34.41 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.499 1.045 . . . . 1.6799999999999999 109.348 175.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 35.6 tp -50.82 -44.54 59.22 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.712 2.005 . . . . 2.0299999999999998 113.363 -176.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tmpt? -56.17 -34.99 66.72 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.137 1.375 . . . . 5.4000000000000004 113.012 -177.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -99.77 13.53 33.38 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.951 1.3 . . . . 4.3200000000000003 114.32 177.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.9 tp -96.69 -56.04 2.71 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.096 0.862 . . . . 2.6800000000000002 110.296 152.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 23.5 mt -60.46 -61.97 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 119.194 0.906 . . . . 0.93000000000000005 110.161 -168.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -68.31 -11.05 58.86 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.354 1.062 . . . . 4.54 111.982 -177.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.64 -42.12 29.58 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.741 1.616 . . . . 4.9900000000000002 111.303 173.305 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -103.28 -72.53 0.69 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.956 0.902 . . . . 6.9500000000000002 109.283 -178.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.1 mt -72.91 22.61 0.06 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 128.637 2.775 . . . . 3.6899999999999999 114.84 -171.097 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 26.6 p -51.8 -35.7 45.03 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.637 1.975 . . . . 3.5899999999999999 115.151 -175.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -62.03 -19.59 63.04 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.301 1.84 . . . . 4.29 114.941 -173.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -78.58 25.25 2.47 Favored Glycine 0 CA--C 1.532 1.12 0 CA-C-O 118.869 -0.962 . . . . 5.0199999999999996 113.308 172.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 56.93 20.33 5.24 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 126.54 1.936 . . . . 5.46 113.004 -170.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.4 ttm -82.21 37.88 0.52 Allowed 'General case' 0 N--CA 1.471 0.609 0 O-C-N 120.521 -1.362 . . . . 2.5099999999999998 113.151 -174.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.9 pttt -73.27 162.88 28.86 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.147 1.379 . . . . 4.8799999999999999 111.714 170.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -25.44 -60.8 0.07 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 128.677 2.791 . . . . 5.1500000000000004 116.39 -162.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.2 t -70.86 -10.11 58.95 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 115.029 1.492 . . . . 3.1699999999999999 115.029 -173.091 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.3 t -84.13 -13.83 51.91 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.593 1.157 . . . . 2.2000000000000002 112.594 168.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 12.3 mm -79.64 -32.59 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 O-C-N 120.212 -1.555 . . . . 1.5800000000000001 112.794 -173.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.18 -44.03 85.15 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.854 0.862 . . . . 3.0600000000000001 111.736 -175.421 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -72.12 -38.44 69.27 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 122.77 0.428 . . . . 2.3900000000000001 111.387 176.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.98 -49.18 78.68 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 118.679 -0.677 . . . . 2.52 110.134 174.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.42 -44.44 89.07 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.396 1.478 . . . . 1.8700000000000001 111.753 177.505 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -55.93 -30.82 62.25 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.033 0.933 . . . . 4.0800000000000001 112.751 172.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.65 -23.57 42.46 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.52 1.128 . . . . 1.6899999999999999 113.181 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.5 mt -89.19 -34.14 16.78 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 114.866 1.432 . . . . 1.9099999999999999 114.866 -173.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -82.07 154.65 25.49 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 120.787 1.631 . . . . 1.74 112.582 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -127.84 10.65 6.55 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.067 1.747 . . . . 3.5600000000000001 113.137 175.7 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -121.69 -33.28 3.63 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.699 1.2 . . . . 2.4300000000000002 114.151 -165.32 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.5 t 76.66 23.07 1.1 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.938 2.495 . . . . 3.96 112.602 -167.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.9 p30 -76.91 -24.57 52.48 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.833 1.653 . . . . 2.3799999999999999 111.59 177.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 67.39 19.82 10.04 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 128.652 2.781 . . . . 4.3099999999999996 113.784 -166.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . 0.432 25.9 pt-20 -132.61 132.36 42.41 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 126.207 2.908 . . . . 2.1099999999999999 115.978 167.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 20.1 mm -74.59 107.31 5.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-N 112.072 -2.331 . . . . 1.0900000000000001 106.868 177.461 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -62.15 152.57 32.68 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.478 -1.237 . . . . 4.5099999999999998 108.899 172.378 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -58.38 -25.88 62.56 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 120.652 -1.28 . . . . 2.1499999999999999 113.371 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -69.69 -34.65 74.22 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.1 0.96 . . . . 3.9700000000000002 113.403 171.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -79.22 -36.91 39.33 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.318 1.447 . . . . 1.8799999999999999 110.229 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -53.69 -35.71 61.4 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.012 1.325 . . . . 2.04 112.201 174.14 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.9 m -56.03 -30.09 61.36 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 120.799 -1.188 . . . . 2.0699999999999998 113.458 170.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.5 t -71.37 -35.92 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.924 0.889 . . . . 2.1600000000000001 110.565 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -59.95 -50.29 74.32 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.75 0.82 . . . . 1.75 111.925 176.048 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.03 -49.98 74.14 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.28 0.632 . . . . 2.7000000000000002 110.544 175.203 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.9 m -52.9 -52.65 56.88 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.302 1.441 . . . . 0.69999999999999996 112.091 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 40.4 mtp -55.41 -48.27 74.65 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.388 1.075 . . . . 1.9099999999999999 112.284 178.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.3 mt -66.6 -43.28 85.24 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.461 0.704 . . . . 1.47 111.721 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 68.6 m -60.73 -33.72 73.34 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 118.293 -0.86 . . . . 1.8100000000000001 113.013 173.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 89.9 mtp -68.11 -34.97 77.38 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.627 1.103 . . . . 1.9199999999999999 112.481 172.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.47 -43.85 84.34 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 119.645 1.111 . . . . 1.21 111.818 170.574 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -64.49 -24.03 67.48 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.555 0.946 . . . . 2.2999999999999998 113.555 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -67.41 -44.71 78.12 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.309 0.959 . . . . 2.7000000000000002 112.333 174.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -70.67 -46.01 63.99 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.584 1.554 . . . . 2.7799999999999998 111.393 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -51.55 -50.07 60.78 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.998 1.719 . . . . 2.1099999999999999 110.763 174.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -60.09 -29.02 68.31 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.197 1.399 . . . . 2.3700000000000001 112.906 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.8 mt -76.59 -15.47 59.84 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 118.207 -0.902 . . . . 1.52 113.12 178.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -104.31 -20.32 13.8 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 114.849 1.425 . . . . 3.0099999999999998 114.849 172.154 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 7.3 t70 . . . . . 0 N--CA 1.472 0.644 0 C-N-CA 126.973 2.109 . . . . 3.6200000000000001 113.45 -171.998 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.9 p . . . . . 0 C--O 1.238 0.488 0 CA-C-O 120.624 0.25 . . . . 1.9399999999999999 110.405 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -62.64 -20.85 72.05 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 121.784 1.656 . . . . 1.54 111.943 167.435 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -76.47 -50.89 12.9 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.262 0.937 . . . . 2.6499999999999999 111.143 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -52.89 -45.81 67.69 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 122.327 1.06 . . . . 4.5099999999999998 110.398 169.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 13.8 ttpt -63.0 -25.12 68.24 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.594 0.961 . . . . 5.1600000000000001 113.594 176.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.6 -49.8 43.9 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.938 1.245 . . . . 1.3 110.953 177.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 6.4 mp -61.65 -39.16 90.35 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.81 0.844 . . . . 2.6099999999999999 111.263 174.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 58.9 m -59.18 -50.76 72.79 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.412 1.485 . . . . 1.24 110.954 174.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 89.1 m -61.43 -36.31 80.01 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.218 1.407 . . . . 1.3400000000000001 110.706 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 1.6 ttp -56.24 -59.22 5.26 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.608 1.163 . . . . 3.77 111.82 167.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 78.2 t -60.89 -31.79 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 CA-C-N 120.828 1.649 . . . . 1.9399999999999999 112.684 178.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 87.4 m -72.0 -49.87 33.46 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.337 1.455 . . . . 0.83999999999999997 111.895 -176.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 7.4 p -62.8 -38.09 89.32 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 118.377 -0.82 . . . . 1.8799999999999999 109.302 169.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -58.3 -57.77 11.42 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 118.936 -0.554 . . . . 2.2000000000000002 110.74 -176.234 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -63.2 -36.67 84.42 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.582 1.083 . . . . 2.1600000000000001 112.599 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -76.77 -24.08 52.91 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.506 1.299 . . . . 5.0599999999999996 114.506 -176.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -91.34 -37.88 12.97 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 120.024 1.284 . . . . 2.0299999999999998 112.167 166.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 34.3 t -65.09 -28.64 69.59 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.416 -1.428 . . . . 1.8100000000000001 112.53 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.2 6.92 82.49 Favored Glycine 0 CA--C 1.534 1.252 0 C-N-CA 125.615 1.579 . . . . 1.3600000000000001 114.828 176.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 45.7 mmt-85 -57.57 -41.98 82.18 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 119.455 1.627 . . . . 5.1900000000000004 111.76 170.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -145.12 136.93 25.56 Favored 'General case' 0 C--O 1.256 1.418 0 C-N-CA 126.568 1.947 . . . . 4.2199999999999998 111.405 178.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.03 -118.45 6.56 Favored Glycine 0 C--N 1.34 0.802 0 C-N-CA 127.479 2.466 . . . . 2.6099999999999999 113.148 162.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.5 m -47.72 122.45 4.92 Favored 'General case' 0 C--O 1.246 0.878 0 C-N-CA 125.093 1.357 . . . . 3.48 112.057 170.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 15.1 pttm -106.64 4.14 27.61 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.023 1.729 . . . . 7.2699999999999996 114.811 -178.28 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.493 ' H ' HD23 ' B' ' 27' ' ' LEU . 1.6 pt? -102.19 -2.09 29.97 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.589 1.555 . . . . 3.9700000000000002 113.011 169.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 28' ' ' THR . . . . . 0.438 HG22 ' HA ' ' B' ' 68' ' ' ASP . 7.7 p -137.89 147.02 44.06 Favored 'General case' 0 C--O 1.244 0.812 0 C-N-CA 128.677 2.791 . . . . 1.3600000000000001 111.539 -173.618 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -96.64 107.94 20.47 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.505 0.722 . . . . 2.4199999999999999 109.936 166.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.75 145.01 55.14 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.144 -0.687 . . . . 2.71 109.144 167.324 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 5.9 ttt-85 -41.69 -40.54 2.0 Allowed 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.654 1.581 . . . . 3.77 114.748 -173.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.427 ' HG2' ' H ' ' B' ' 33' ' ' GLU . 2.9 ptmt -61.07 -43.56 98.7 Favored 'General case' 0 CA--C 1.555 1.148 0 N-CA-C 115.247 1.573 . . . . 4.9699999999999998 115.247 173.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.427 ' H ' ' HG2' ' B' ' 32' ' ' LYS . 17.8 mt-10 -65.13 -49.6 69.3 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 127.58 2.352 . . . . 1.6299999999999999 107.697 176.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -55.04 -49.37 71.76 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.103 1.361 . . . . 2.3500000000000001 111.214 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -13.91 61.95 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 114.904 1.446 . . . . 4.7599999999999998 114.904 -175.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -84.21 -40.84 17.6 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 112.475 0.546 . . . . 3.1800000000000002 112.475 169.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 tt -50.9 -57.93 7.26 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.04 1.336 . . . . 1.8899999999999999 110.498 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 24.2 mt -59.1 -48.16 87.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 123.994 0.918 . . . . 1.1799999999999999 110.038 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.464 ' HZ3' ' CD ' ' B' ' 46' ' ' GLU . 16.4 tppt? -57.67 -21.51 40.56 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.966 1.306 . . . . 3.8300000000000001 112.986 -175.251 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 mttm -98.74 -42.62 7.13 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 114.32 1.23 . . . . 3.4199999999999999 114.32 165.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -50.83 -48.75 59.82 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 126.348 1.859 . . . . 5.0999999999999996 112.191 -177.098 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 73.1 mt -125.17 120.22 30.73 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.291 1.437 . . . . 2.54 109.213 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 44.2 t -84.21 -76.0 0.32 Allowed 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 107.733 -1.21 . . . . 4.4199999999999999 107.733 160.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 76.6 mt 52.68 -105.14 0.22 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.468 1.107 . . . . 3.3300000000000001 111.531 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -102.05 7.22 54.6 Favored Glycine 0 N--CA 1.484 1.851 0 C-N-CA 125.537 1.541 . . . . 3.1600000000000001 114.828 172.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 46' ' ' GLU . . . . . 0.464 ' CD ' ' HZ3' ' B' ' 39' ' ' LYS . 0.7 OUTLIER 70.34 110.95 0.06 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 130.965 3.706 . . . . 8.4299999999999997 109.736 -170.942 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 84.6 mmm -58.73 -38.87 79.3 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.497 1.295 . . . . 2.8300000000000001 114.497 -174.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.412 ' HB2' ' HZ3' ' B' ' 48' ' ' LYS . 1.4 ttpm? 71.16 141.27 0.05 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.481 1.912 . . . . 3.8399999999999999 114.428 157.721 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -58.57 -31.47 68.03 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 119.922 -1.736 . . . . 3.73 112.043 -172.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 22.7 t -70.18 1.46 4.74 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 115.409 1.633 . . . . 3.3399999999999999 115.409 173.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 2.7 p -124.71 -41.62 2.12 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.259 0.936 . . . . 2.2599999999999998 111.959 157.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 84.6 mt -54.22 -41.91 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 124.434 1.094 . . . . 1.5 112.696 -176.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -63.53 -34.54 78.01 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 119.429 1.013 . . . . 3.2000000000000002 111.733 -173.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -93.82 -35.13 12.88 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.878 1.671 . . . . 4.6900000000000004 113.585 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 7.1 tt -53.37 -42.4 66.83 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.702 1.201 . . . . 2.6499999999999999 110.146 169.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.7 -48.42 72.48 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.639 1.576 . . . . 1.6399999999999999 111.44 171.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 13.4 mttm -59.73 -37.32 78.63 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 119.527 1.058 . . . . 7.0300000000000002 111.641 173.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 5.0 t -65.66 -22.62 66.66 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.018 0.927 . . . . 1.95 113.154 175.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 29.0 mt -77.64 -42.96 32.98 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.981 0.913 . . . . 2.0600000000000001 110.845 168.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -76.2 78.57 3.0 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.886 2.474 . . . . 1.8100000000000001 114.527 -162.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 65.6 mmtt -61.15 -13.1 15.21 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 115.505 1.669 . . . . 3.75 115.505 -170.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -120.05 2.62 10.96 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.862 1.43 . . . . 2.3399999999999999 114.862 176.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 23.0 t 62.96 18.94 11.28 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.702 1.371 . . . . 2.5699999999999998 114.702 172.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 47.5 p-10 -79.7 -11.29 59.86 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.924 1.689 . . . . 2.1400000000000001 112.337 -177.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 67.43 16.98 10.09 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 130.565 3.546 . . . . 4.8700000000000001 113.613 -175.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -111.51 141.5 45.0 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.653 1.981 . . . . 2.27 107.846 165.043 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 50.4 mm -108.33 102.59 14.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 O-C-N 120.152 -1.592 . . . . 1.25 107.791 172.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 68' ' ' ASP . . . . . 0.526 ' HB3' ' H ' ' B' ' 70' ' ' LYS . 88.9 m-20 -47.38 153.78 0.48 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.074 0.549 . . . . 3.3300000000000001 110.661 168.221 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -47.47 -25.8 1.19 Allowed 'General case' 0 CA--C 1.555 1.138 0 CA-C-O 121.839 0.828 . . . . 2.3100000000000001 112.75 158.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.526 ' H ' ' HB3' ' B' ' 68' ' ' ASP . 6.7 ttpm? -86.85 -25.31 24.58 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 129.108 2.963 . . . . 4.0300000000000002 114.952 176.549 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -80.81 -43.71 19.64 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 119.935 1.243 . . . . 1.8200000000000001 108.57 169.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -50.65 -31.32 15.87 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 129.812 3.245 . . . . 1.9299999999999999 115.659 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 30.9 t -53.23 -38.38 62.9 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.98 -1.075 . . . . 2.0299999999999998 112.124 171.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 57.4 t -67.24 -34.13 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 O-C-N 121.378 -0.826 . . . . 1.52 111.294 -177.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -59.76 -62.74 1.65 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 118.35 0.523 . . . . 1.8200000000000001 110.892 175.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 52.4 mt -62.31 -30.53 71.21 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.202 0.601 . . . . 1.8100000000000001 112.327 -176.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 91.1 m -58.32 -47.8 82.57 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.741 0.816 . . . . 0.81999999999999995 111.029 172.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 79.6 mtm -62.99 -38.21 90.26 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.017 0.826 . . . . 1.55 112.803 177.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 62.9 mt -61.28 -46.09 91.77 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.422 0.555 . . . . 1.55 110.503 173.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 97.1 m -60.84 -38.47 85.63 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.692 0.797 . . . . 1.8700000000000001 112.858 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 28.1 mmt -60.22 -41.41 93.02 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 118.854 0.752 . . . . 3.2799999999999998 111.941 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.91 -38.37 79.55 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.409 0.55 . . . . 0.87 112.054 177.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -71.84 -24.28 61.67 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.025 1.12 . . . . 3.1600000000000001 114.025 177.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -65.05 -46.13 82.51 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.509 0.724 . . . . 2.77 112.015 170.085 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.33 -44.49 91.38 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.58 1.552 . . . . 3.29 112.149 177.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -50.39 -48.96 55.71 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.025 1.73 . . . . 2.3500000000000001 111.734 177.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -64.83 -21.04 66.71 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.336 1.454 . . . . 2.5299999999999998 113.653 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 44.3 mt -84.24 -20.57 32.02 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.199 1.0 . . . . 1.6899999999999999 112.057 173.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -97.41 -10.15 26.02 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 115.074 1.509 . . . . 3.7599999999999998 115.074 174.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -88.36 -33.44 17.95 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.34 1.456 . . . . 2.8900000000000001 113.652 -177.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -80.05 -6.59 57.89 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 115.086 1.513 . . . . 5.25 115.086 -174.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 114.902 -2.475 . . . . 5.0499999999999998 117.469 -158.189 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 . . . . . 0 N--CA 1.432 -1.334 0 N-CA-C 106.982 -1.488 . . . . 4.0999999999999996 106.982 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.543 HG21 ' O ' ' B' ' 40' ' ' LYS . 70.6 p -49.03 149.38 3.37 Favored Pre-proline 0 N--CA 1.47 0.537 0 C-N-CA 125.989 1.716 . . . . 1.4199999999999999 111.467 178.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -64.68 -23.13 63.73 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.25 1.966 . . . . 1.28 111.939 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.29 -44.25 46.69 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.858 1.263 . . . . 2.3799999999999999 111.865 174.454 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -53.24 -53.05 56.37 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.998 1.272 . . . . 4.7000000000000002 110.083 174.386 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 33.9 mtmt -61.98 -21.11 64.56 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 113.186 0.81 . . . . 4.3700000000000001 113.186 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.54 -45.24 31.51 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.82 0.848 . . . . 0.90000000000000002 111.369 170.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.6 mt -58.23 -47.28 84.02 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.474 1.033 . . . . 1.54 110.832 173.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -66.81 -37.49 84.62 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 116.348 -1.787 . . . . 2.2999999999999998 112.462 175.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 42.1 m -55.65 -42.97 75.79 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 121.415 1.916 . . . . 1.29 110.875 170.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 57.5 mtp -63.88 -47.03 82.27 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.996 1.319 . . . . 3.1499999999999999 112.033 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.517 HG21 ' HB3' ' B' ' 83' ' ' TYR . 58.3 t -65.69 -31.65 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 O-C-N 121.075 -1.016 . . . . 2.25 111.531 175.307 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 93.3 m -67.42 -56.58 9.07 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.565 1.146 . . . . 1.01 110.617 -179.138 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.0 p -57.97 -42.54 85.26 Favored 'General case' 0 CA--C 1.512 -0.512 0 O-C-N 123.737 0.648 . . . . 2.3399999999999999 109.461 178.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -67.74 -55.29 13.67 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.779 0.674 . . . . 2.54 111.412 -176.276 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -65.48 -29.7 70.39 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.382 -0.824 . . . . 2.27 112.353 -177.015 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp -70.76 -57.08 5.02 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.33 0.968 . . . . 5.6799999999999997 112.493 171.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 -67.71 -23.25 65.25 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.623 1.101 . . . . 2.1600000000000001 113.135 -178.065 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.3 t -62.99 -19.77 64.65 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.402 1.26 . . . . 2.0800000000000001 114.402 172.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.04 33.55 6.35 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 126.709 2.099 . . . . 1.3600000000000001 113.428 171.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -114.05 28.92 8.39 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.821 1.648 . . . . 6.1900000000000004 112.57 173.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.408 ' HG2' ' H ' ' A' ' 24' ' ' GLY . 4.1 tt0 126.8 -159.83 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.091 1 C-N-CA 132.666 4.387 . . . . 4.3399999999999999 110.26 171.968 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.408 ' H ' ' HG2' ' A' ' 23' ' ' GLU . . . 51.26 -141.24 21.84 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 124.876 1.227 . . . . 2.21 111.622 -170.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.8 t -86.86 179.7 6.68 Favored 'General case' 0 C--O 1.249 1.04 0 CA-C-O 122.203 1.001 . . . . 2.3500000000000001 111.786 158.12 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -104.44 140.88 37.31 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.434 2.294 . . . . 4.5899999999999999 108.705 166.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 9.7 tp 90.72 -18.26 0.17 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 131.063 3.745 . . . . 3.6699999999999999 110.98 -159.056 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.6 p -112.45 152.94 28.12 Favored 'General case' 0 C--O 1.246 0.898 0 C-N-CA 125.745 1.618 . . . . 1.3 114.957 177.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.9 mt -107.58 105.83 15.91 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.177 1.391 . . . . 1.45 111.687 163.219 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.9 t -62.0 160.98 11.42 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.78 1.232 . . . . 2.0899999999999999 111.227 163.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.4 ttm-85 -46.56 -21.88 0.23 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 126.465 1.906 . . . . 3.4700000000000002 114.906 -178.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.88 -38.65 10.18 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.126 1.37 . . . . 3.9900000000000002 112.854 -178.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -61.11 -46.46 90.51 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.693 1.197 . . . . 1.4399999999999999 109.559 172.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.7 tp -66.38 -49.43 66.9 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.53 0.732 . . . . 1.9399999999999999 111.398 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.1 ttmt -61.66 -37.17 83.06 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 113.15 0.796 . . . . 3.4900000000000002 113.15 -177.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -57.63 -58.53 7.94 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.764 0.825 . . . . 3.75 112.317 164.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.4 tp -53.29 -54.67 33.01 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.744 1.217 . . . . 2.1699999999999999 112.909 -174.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.3 mt -60.17 -33.65 54.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 118.332 0.515 . . . . 1.0700000000000001 110.896 -174.103 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.497 ' HZ2' ' CD ' ' A' ' 46' ' ' GLU . 23.9 mmmt -67.52 -12.27 59.94 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 121.096 -1.002 . . . . 3.3900000000000001 113.138 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 59.3 mmtt -92.66 -19.65 21.64 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.12 1.368 . . . . 2.6200000000000001 111.757 173.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -91.69 -93.12 0.14 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.632 1.973 . . . . 4.3600000000000003 106.589 178.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -75.52 24.99 0.11 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 128.901 2.88 . . . . 2.5299999999999998 114.544 -161.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 18.4 t -54.81 -25.68 29.83 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.64 -1.287 . . . . 3.0699999999999998 113.237 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.11 -21.43 66.35 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.83 1.652 . . . . 4.2400000000000002 115.332 178.546 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -108.51 -28.28 4.64 Favored Glycine 0 N--CA 1.476 1.305 0 C-N-CA 124.752 1.168 . . . . 3.79 112.236 163.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.497 ' CD ' ' HZ2' ' A' ' 39' ' ' LYS . 0.2 OUTLIER 83.72 139.59 0.06 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 129.411 3.085 . . . . 7.9299999999999997 111.644 170.001 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.6 mmt -109.07 105.51 15.03 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.51 1.524 . . . . 2.8500000000000001 111.151 -173.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -89.91 164.18 14.68 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.146 1.378 . . . . 4.9900000000000002 110.891 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.25 -50.06 51.22 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 120.997 -1.064 . . . . 5.9100000000000001 111.41 167.416 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.1 t -72.23 41.13 0.08 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.438 1.495 . . . . 3.6699999999999999 113.136 168.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.0 m -160.29 -41.42 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.884 1.674 . . . . 2.3199999999999998 112.66 177.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 33.8 mt -72.3 -38.73 62.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 119.367 0.985 . . . . 2.2999999999999998 112.086 -174.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -80.56 -23.1 40.18 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.757 0.823 . . . . 3.8100000000000001 112.016 -175.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -78.62 -38.99 38.51 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.283 0.633 . . . . 2.7000000000000002 111.673 165.36 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.79 -44.97 86.65 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.601 -0.714 . . . . 2.6800000000000002 109.509 169.451 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.2 ttt -58.94 -41.97 88.65 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.306 0.957 . . . . 1.53 112.039 173.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.98 -24.63 67.79 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 119.363 0.983 . . . . 4.2699999999999996 112.77 172.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 t -74.06 -33.18 63.61 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 120.48 -1.388 . . . . 2.3199999999999998 112.37 170.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.7 mp -80.75 -51.75 8.3 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 125.111 1.365 . . . . 2.73 112.816 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -72.69 135.55 45.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.753 0.787 . . . . 1.72 111.886 -178.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.51 -40.45 5.11 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.568 1.547 . . . . 3.5 111.939 178.07 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 43.4 p-10 -92.93 -11.16 34.06 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 116.389 1.996 . . . . 2.5499999999999998 116.389 -169.123 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.7 t 76.02 29.96 0.75 Allowed 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.881 1.672 . . . . 3.02 113.556 174.027 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.9 p-10 -90.31 -14.28 33.51 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 126.578 1.951 . . . . 2.3500000000000001 112.691 -176.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 76.27 13.08 2.61 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 128.71 2.804 . . . . 4.3099999999999996 115.674 -174.505 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -133.91 132.08 39.84 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.557 2.343 . . . . 2.8199999999999998 109.355 -176.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 18.1 mm -98.99 107.84 21.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 120.572 -1.33 . . . . 1.1599999999999999 109.979 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -63.59 161.53 14.55 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.97 0.805 . . . . 3.8100000000000001 112.782 170.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -48.78 -37.39 18.98 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 122.519 1.152 . . . . 2.48 112.21 169.144 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.17 -22.84 48.06 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 116.181 1.919 . . . . 6.71 116.181 174.344 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -78.91 -51.12 10.11 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.398 1.454 . . . . 1.8799999999999999 109.07 170.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -50.25 -22.58 1.81 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 128.055 2.542 . . . . 1.8799999999999999 113.418 175.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.3 m -53.59 -32.51 51.34 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.58 -1.325 . . . . 2.6200000000000001 113.309 170.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 p -75.46 -25.79 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 122.967 0.507 . . . . 2.1400000000000001 111.856 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -63.36 -60.65 3.1 Favored 'General case' 0 C--N 1.343 0.299 0 CA-C-O 118.426 -0.797 . . . . 1.9299999999999999 109.968 172.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -51.93 -46.65 64.76 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.999 0.92 . . . . 2.7799999999999998 111.328 -178.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 56.3 m -55.06 -58.81 6.12 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.906 1.282 . . . . 1.0900000000000001 112.239 176.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 61.0 ttp -59.07 -43.82 91.81 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.633 0.773 . . . . 2.3999999999999999 111.217 -178.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.22 -46.59 80.01 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.535 1.134 . . . . 2.6699999999999999 111.647 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 67.8 m -63.92 -40.92 97.58 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.157 0.583 . . . . 1.8700000000000001 112.307 176.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 59.5 mtp -62.88 -39.33 94.12 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.631 0.65 . . . . 1.8600000000000001 112.029 172.306 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.01 -37.04 86.31 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.373 0.669 . . . . 1.22 112.554 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -64.03 -28.03 69.52 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.847 1.054 . . . . 2.3199999999999998 113.847 173.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -65.86 -40.5 91.73 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 120.167 1.349 . . . . 2.2400000000000002 111.971 172.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -72.7 -39.52 66.92 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.687 0.795 . . . . 3.2999999999999998 111.697 178.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -52.78 -46.16 67.46 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.037 1.335 . . . . 3.8700000000000001 111.298 172.081 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -62.97 -27.25 69.27 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.488 1.515 . . . . 2.9399999999999999 113.228 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 37.5 mt -80.96 -21.43 40.38 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.543 1.137 . . . . 3.0699999999999998 112.452 176.138 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -91.12 -10.24 42.66 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 115.142 1.534 . . . . 3.77 115.142 172.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.9 t70 . . . . . 0 N--CA 1.47 0.566 0 C-N-CA 125.737 1.615 . . . . 3.7799999999999998 112.719 169.344 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 3' ' ' THR . . . . . 0.413 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 6.4 p . . . . . 0 C--O 1.237 0.417 0 CA-C-O 119.09 -0.481 . . . . 2.8799999999999999 110.26 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 4' ' ' PRO . . . . . 0.413 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 42.1 Cg_endo -69.83 -33.14 16.93 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 121.215 1.277 . . . . 1.8799999999999999 112.907 -172.127 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.01 -39.88 68.88 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.085 0.857 . . . . 2.5699999999999998 112.222 -172.485 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.93 -33.78 67.34 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.595 1.089 . . . . 4.1100000000000003 112.279 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -68.51 -32.28 72.13 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 120.678 -1.264 . . . . 4.7699999999999996 112.522 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -69.04 -51.58 37.55 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.421 1.088 . . . . 0.89000000000000001 110.201 175.08 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 57.5 mt -54.28 -46.19 72.66 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.584 1.154 . . . . 1.9199999999999999 111.769 174.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 64.4 m -56.65 -52.39 65.08 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.04 0.936 . . . . 1.28 111.181 172.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 51.7 m -55.49 -44.23 76.33 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.659 1.184 . . . . 1.22 111.471 -175.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 9.7 mtt -57.68 -51.77 68.18 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.062 0.945 . . . . 3.27 111.731 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 76.3 t -64.29 -43.59 97.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 124.204 1.001 . . . . 2.0 112.067 178.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 31.3 m -55.6 -58.04 9.44 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.787 1.635 . . . . 1.21 110.248 178.368 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 15' ' ' THR . . . . . 0.403 ' HG1' ' HE2' ' B' ' 19' ' ' TYR . 0.7 OUTLIER -70.48 -37.85 74.29 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 117.406 -1.283 . . . . 2.6800000000000002 109.571 -174.747 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -57.34 -48.0 80.11 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 118.945 0.793 . . . . 2.1499999999999999 111.003 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.12 -31.97 71.92 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 118.684 0.674 . . . . 2.8300000000000001 111.337 178.158 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 39.0 tttm -69.74 -32.67 71.34 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.304 1.224 . . . . 4.6200000000000001 114.304 173.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.403 ' HE2' ' HG1' ' B' ' 15' ' ' THR . 69.5 m-85 -71.52 -31.55 67.19 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.763 1.225 . . . . 3.3999999999999999 111.569 166.104 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 40.3 t -70.82 -35.16 72.37 Favored 'General case' 0 C--O 1.244 0.785 0 C-N-CA 125.793 1.637 . . . . 1.97 114.86 -176.085 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.17 7.41 67.47 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 125.375 1.464 . . . . 2.2000000000000002 113.774 167.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.43 -14.9 59.6 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.224 1.512 . . . . 3.8700000000000001 113.496 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 23' ' ' GLU . . . . . 0.563 ' HG2' ' H ' ' B' ' 24' ' ' GLY 0.281 3.5 tm-20 164.0 -167.46 0.01 OUTLIER 'General case' 0 CA--C 1.564 1.502 0 C-N-CA 130.666 3.586 . . . . 3.46 109.712 -176.868 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 24' ' ' GLY . . . . . 0.563 ' H ' ' HG2' ' B' ' 23' ' ' GLU . . . 58.47 -149.07 36.8 Favored Glycine 0 N--CA 1.467 0.751 0 C-N-CA 126.17 1.843 . . . . 3.1200000000000001 112.316 -174.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 41.4 t -66.92 154.73 40.32 Favored 'General case' 0 C--O 1.249 1.071 0 O-C-N 121.27 -1.135 . . . . 2.98 110.274 153.019 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.0 1.09 37.19 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.415 1.486 . . . . 6.2800000000000002 112.67 177.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 57.8 tp -92.61 -30.11 15.78 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.365 1.466 . . . . 3.6400000000000001 112.239 174.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 16.6 p -128.32 167.38 17.02 Favored 'General case' 0 C--O 1.252 1.202 0 C-N-CA 128.703 2.801 . . . . 1.48 113.679 -163.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 10.5 mt -101.35 114.03 27.64 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.07 1.748 . . . . 1.5700000000000001 110.972 167.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 2.0 p -69.58 165.58 20.79 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.138 -0.976 . . . . 2.9300000000000002 112.935 166.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -41.8 -30.4 0.25 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.905 1.282 . . . . 3.8900000000000001 114.271 169.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.1 -42.96 10.8 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 119.92 -1.738 . . . . 6.1500000000000004 113.082 178.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -52.65 -44.17 65.96 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.621 0.769 . . . . 1.8899999999999999 110.663 167.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.93 -42.99 97.22 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.427 1.891 . . . . 2.3300000000000001 112.404 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -56.45 -40.94 75.64 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 120.274 -1.516 . . . . 3.02 112.457 170.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -68.28 -43.53 77.53 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 117.974 -1.012 . . . . 3.1400000000000001 112.127 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.0 tp -51.41 -61.22 2.38 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 125.294 1.438 . . . . 2.4199999999999999 108.665 173.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 24.5 mt -54.3 -45.23 67.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 CA-C-N 118.739 0.7 . . . . 1.25 109.85 -173.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -72.65 -31.72 65.32 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.223 0.609 . . . . 4.9400000000000004 111.751 -172.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 40' ' ' LYS . . . . . 0.543 ' O ' HG21 ' A' ' 3' ' ' THR . 36.6 mttp -89.25 -28.16 20.11 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 120.624 -1.298 . . . . 3.4199999999999999 113.696 178.226 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -65.83 -61.42 2.07 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.768 1.627 . . . . 5.7199999999999998 110.654 166.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.49 101.46 5.63 Favored 'General case' 0 C--N 1.342 0.253 0 C-N-CA 124.601 1.16 . . . . 2.23 108.454 -178.449 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 5.2 t -70.4 30.82 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 114.557 1.318 . . . . 4.5899999999999999 114.557 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 70.1 mt -118.25 -15.53 9.76 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.158 1.783 . . . . 3.4300000000000002 112.959 -163.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 104.24 -118.84 6.08 Favored Glycine 0 C--N 1.34 0.761 0 C-N-CA 124.454 1.026 . . . . 4.6600000000000001 112.62 177.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -92.5 111.3 22.84 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 113.328 0.862 . . . . 8.4299999999999997 113.328 -164.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 84.0 mmm -65.5 -28.52 69.25 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.823 0.82 . . . . 4.1900000000000004 112.07 155.101 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 tptt 72.3 144.09 0.07 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.875 2.87 . . . . 6.1200000000000001 111.303 -174.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 20.4 tp10 -49.61 -43.84 46.8 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.268 1.027 . . . . 4.5 113.55 -168.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 24.8 t -66.95 -7.95 25.98 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.316 1.598 . . . . 3.4300000000000002 115.316 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 12.3 t -105.5 -6.49 19.37 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 120.072 1.306 . . . . 2.2400000000000002 113.228 167.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 45.0 mm -73.55 -44.4 53.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 CA-C-N 120.172 1.351 . . . . 1.8500000000000001 110.718 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -71.13 -29.88 65.79 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.812 0.845 . . . . 2.98 112.632 -178.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -71.81 -44.58 63.69 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.847 1.203 . . . . 3.6899999999999999 111.396 167.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.78 -49.61 70.5 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.832 0.742 . . . . 2.1800000000000002 109.266 176.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 14.8 tpt -54.01 -51.32 64.35 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.794 1.638 . . . . 1.8 112.806 173.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -55.8 -39.33 71.17 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.571 1.548 . . . . 5.3099999999999996 112.195 173.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 30.5 m -74.48 -22.72 58.94 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.466 1.506 . . . . 2.04 110.664 -177.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 9.1 mt -83.17 -56.68 3.64 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.317 0.962 . . . . 1.75 113.212 169.061 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -70.82 139.57 50.96 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.877 0.695 . . . . 1.6599999999999999 112.877 -165.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 37.6 mmtm -135.02 -9.72 2.3 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.623 1.569 . . . . 3.8999999999999999 114.35 -175.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.23 -20.83 50.97 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.913 0.779 . . . . 2.5800000000000001 110.884 164.235 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 22.7 t 72.48 41.13 0.6 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.563 1.945 . . . . 2.7000000000000002 110.82 -178.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -114.43 -125.52 0.28 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.421 1.488 . . . . 3.2400000000000002 108.54 -167.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -144.04 -2.52 0.91 Allowed 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 116.753 2.131 . . . . 4.4500000000000002 116.753 165.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -113.66 141.82 46.76 Favored 'General case' 0 C--O 1.244 0.812 0 C-N-CA 125.853 1.661 . . . . 2.8500000000000001 111.291 177.027 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 45.1 mm -89.9 111.17 22.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 127.948 2.499 . . . . 1.04 109.846 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.94 159.27 33.01 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 128.092 2.557 . . . . 2.54 111.278 162.061 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -54.08 -35.39 62.03 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.256 1.206 . . . . 2.1299999999999999 114.256 -176.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -71.85 -36.38 70.12 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.71 -1.244 . . . . 3.6200000000000001 111.42 177.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -64.11 -51.78 62.32 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 124.344 1.058 . . . . 1.6799999999999999 109.259 171.146 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -52.05 -43.4 63.78 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.531 1.532 . . . . 2.23 113.309 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 35.8 m -62.91 -21.08 65.77 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.354 -0.841 . . . . 2.6400000000000001 113.098 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 21.2 t -64.24 -40.11 87.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 CA-C-N 119.496 1.044 . . . . 1.6599999999999999 110.661 170.542 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -59.19 -55.43 35.02 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 118.753 0.706 . . . . 1.8899999999999999 110.665 177.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 66.9 mt -57.77 -38.28 75.16 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.581 1.152 . . . . 1.3899999999999999 110.781 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 99.8 m -61.91 -50.06 73.71 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.179 0.992 . . . . 0.81000000000000005 112.303 173.498 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.9 mtm -64.57 -37.39 87.4 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 119.559 1.072 . . . . 1.52 112.18 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -60.93 -52.63 64.23 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.63 0.772 . . . . 2.6600000000000001 111.953 172.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 93.8 m -63.86 -35.89 82.14 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.389 0.514 . . . . 1.8300000000000001 112.389 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 49.2 mmm -60.73 -42.92 98.27 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.721 0.808 . . . . 2.1600000000000001 112.834 170.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.6 -33.64 71.26 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.518 1.053 . . . . 0.77000000000000002 112.003 176.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 83' ' ' TYR . . . . . 0.517 ' HB3' HG21 ' A' ' 13' ' ' VAL . 4.4 m-85 -69.82 -23.67 63.35 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.022 1.119 . . . . 2.1699999999999999 114.022 175.387 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -55.29 -49.6 71.71 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 120.561 1.528 . . . . 2.4399999999999999 111.056 166.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.16 -36.44 58.72 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.103 1.761 . . . . 3.04 112.196 -174.137 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -54.82 -47.14 74.44 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.217 1.407 . . . . 2.3700000000000001 111.281 166.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -67.18 -25.82 66.33 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.474 1.11 . . . . 2.0299999999999998 112.941 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 71.6 mt -78.2 -26.83 47.71 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 118.112 -0.947 . . . . 1.72 112.824 174.34 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -97.39 10.94 38.34 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.561 1.544 . . . . 3.71 114.263 174.363 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -93.56 -54.36 3.69 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.739 1.215 . . . . 3.1200000000000001 112.047 162.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -82.66 37.73 0.54 Allowed 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 125.866 1.666 . . . . 3.1400000000000001 112.721 -176.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.26 1.607 0 N-CA-C 118.896 2.924 . . . . 5.25 118.896 -145.735 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 . . . . . 0 C--O 1.238 0.48 0 N-CA-C 105.787 -1.931 . . . . 4.0 105.787 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 79.4 p -60.93 162.7 11.68 Favored Pre-proline 0 C--N 1.325 -0.483 0 C-N-CA 126.077 1.751 . . . . 1.4399999999999999 113.869 -170.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -61.8 -18.52 61.19 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.421 2.081 . . . . 1.3400000000000001 112.504 164.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.12 -45.37 34.05 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.508 1.049 . . . . 2.3199999999999998 110.562 175.521 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -61.32 -37.9 84.93 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.905 -1.122 . . . . 4.5599999999999996 111.148 172.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -69.79 -31.54 69.52 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.019 -1.05 . . . . 3.4199999999999999 112.971 172.446 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.67 -48.52 66.41 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.743 1.217 . . . . 0.90000000000000002 111.603 173.202 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 74.6 mt -57.85 -47.38 82.86 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.89 1.276 . . . . 1.5800000000000001 110.66 172.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 89.2 m -54.13 -48.48 70.76 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.113 1.365 . . . . 1.6200000000000001 111.8 172.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 92.1 m -66.55 -35.82 81.16 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.968 1.307 . . . . 1.3300000000000001 111.553 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -45.69 66.94 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.717 0.807 . . . . 4.0599999999999996 111.699 176.345 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.2 p -65.31 -29.72 48.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 119.355 0.98 . . . . 2.1000000000000001 112.234 171.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 55.3 m -63.83 -54.77 29.88 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 117.654 -1.165 . . . . 0.87 111.074 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.6 p -60.01 -36.64 77.66 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 119.525 1.057 . . . . 2.1299999999999999 110.481 174.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -68.06 -54.55 17.47 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 119.379 -0.928 . . . . 2.1800000000000002 110.928 -175.605 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -64.67 -29.44 70.44 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.921 0.888 . . . . 2.5 113.276 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 58.4 tttt -62.95 -70.84 0.18 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 127.537 2.335 . . . . 5.04 112.579 166.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -65.68 -24.85 67.11 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.136 -0.978 . . . . 2.0899999999999999 112.099 -172.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.7 t -60.21 -26.68 66.58 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 114.9 1.444 . . . . 1.8700000000000001 114.9 170.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -95.37 5.86 67.99 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 125.802 1.668 . . . . 1.3600000000000001 114.083 175.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.43 -44.74 92.83 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.96 1.38 . . . . 3.8999999999999999 111.462 172.298 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -146.69 161.05 41.4 Favored 'General case' 0 C--O 1.253 1.28 0 CA-C-O 123.49 1.614 . . . . 4.6799999999999997 113.24 176.386 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.18 -128.57 47.73 Favored Glycine 0 C--N 1.34 0.77 0 C-N-CA 126.944 2.211 . . . . 2.04 111.733 164.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.0 m -52.72 125.27 16.17 Favored 'General case' 0 C--O 1.245 0.822 0 C-N-CA 123.189 0.595 . . . . 2.8799999999999999 110.33 166.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -83.33 -2.88 56.79 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.223 1.009 . . . . 5.3200000000000003 113.328 176.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 9.8 mp -89.88 -34.13 16.2 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.878 2.071 . . . . 4.2000000000000002 111.691 174.155 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -126.98 163.52 23.51 Favored 'General case' 0 C--O 1.254 1.313 0 C-N-CA 127.661 2.384 . . . . 1.3 114.874 -167.042 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -109.35 105.63 15.1 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 127.582 2.353 . . . . 2.5899999999999999 112.097 -171.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.7 t -84.42 164.45 18.87 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.789 2.036 . . . . 1.96 112.057 175.086 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.1 tmm_? -60.96 -22.15 64.16 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 116.509 2.04 . . . . 4.8600000000000003 116.509 -161.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.62 -41.27 16.54 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 120.635 -1.291 . . . . 6.0 111.901 166.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -54.46 -49.97 68.81 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 120.302 1.41 . . . . 1.4299999999999999 110.532 175.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -65.64 -45.84 81.5 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.956 1.703 . . . . 2.6400000000000001 112.452 -177.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.255 1.1 ptmt -73.0 -32.69 65.31 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 118.111 -1.436 . . . . 3.6800000000000002 112.67 176.635 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -61.9 -44.34 96.99 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.434 1.47 . . . . 3.5299999999999998 112.97 171.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.9 tp -51.64 -64.96 0.65 Allowed 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 126.292 1.837 . . . . 2.1099999999999999 110.161 170.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 84.6 mt -55.44 -45.56 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-O 118.349 -0.834 . . . . 0.94999999999999996 111.641 -176.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.428 ' HZ3' ' CD ' ' A' ' 49' ' ' GLU . 24.2 mmmt -55.32 -28.74 55.68 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 118.69 0.677 . . . . 3.7400000000000002 112.69 -174.235 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -97.52 -34.42 11.0 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.472 1.909 . . . . 3.4399999999999999 113.286 -173.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -85.28 -50.43 7.36 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.357 0.663 . . . . 5.3399999999999999 111.616 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.9 mp -92.76 54.89 2.31 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.678 1.591 . . . . 3.3100000000000001 109.518 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.5 t -79.67 35.92 0.31 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.506 1.122 . . . . 2.9900000000000002 113.586 -166.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -91.9 -8.59 45.93 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 116.76 2.133 . . . . 3.9199999999999999 116.76 -161.174 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 97.86 1.71 58.55 Favored Glycine 0 N--CA 1.474 1.202 0 CA-C-N 119.179 0.899 . . . . 2.9199999999999999 114.437 -176.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.7 -152.4 0.29 Allowed 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 107.941 -1.133 . . . . 6.6500000000000004 107.941 143.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.88 39.48 20.35 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 124.165 1.936 . . . . 2.0499999999999998 110.736 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -74.52 141.71 44.83 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 112.396 -2.184 . . . . 4.6500000000000004 109.586 174.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.428 ' CD ' ' HZ3' ' A' ' 39' ' ' LYS . 2.0 mm-40 -52.1 -39.92 60.51 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.799 1.778 . . . . 4.46 115.799 -148.451 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.1 p -78.4 -28.87 46.95 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 115.337 1.606 . . . . 2.6600000000000001 115.337 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.3 t -56.25 -30.77 62.85 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.999 1.32 . . . . 1.8300000000000001 110.99 172.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 3.1 mt -74.68 -25.56 19.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 C-N-CA 124.141 0.976 . . . . 1.8 112.497 -176.067 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -86.81 -30.33 21.59 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.627 0.649 . . . . 3.6099999999999999 111.642 178.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -71.82 -34.51 69.38 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.193 0.906 . . . . 2.8199999999999998 111.621 167.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 53.8 tp -61.28 -52.59 64.1 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 117.34 -1.314 . . . . 1.72 110.15 165.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.2 ttt -53.33 -48.87 68.1 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 121.421 1.919 . . . . 1.54 112.112 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.69 -29.83 8.14 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.779 1.632 . . . . 3.52 113.361 174.403 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 50.2 m -93.49 -29.01 15.76 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.278 1.831 . . . . 2.6899999999999999 112.486 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.4 mt -78.66 -30.45 46.25 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.253 1.021 . . . . 2.2999999999999998 112.596 175.352 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -73.02 70.63 1.05 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.394 1.477 . . . . 1.3799999999999999 110.769 175.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.3 ttmp? -50.97 -29.61 12.74 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 115.602 1.705 . . . . 4.2199999999999998 115.602 -162.384 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -95.15 -18.98 20.47 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 115.495 1.665 . . . . 3.0899999999999999 115.495 175.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 59.96 108.94 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.363 1.465 . . . . 3.8500000000000001 112.221 -153.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.4 p30 -140.0 -78.73 0.31 Allowed 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.962 -1.086 . . . . 2.8399999999999999 110.405 173.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -166.81 -28.79 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 130.615 3.566 . . . . 5.8399999999999999 112.218 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -154.4 166.79 32.13 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.564 1.145 . . . . 2.2599999999999998 112.81 -173.269 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 6.9 mm -98.07 108.78 22.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 125.275 1.43 . . . . 0.98999999999999999 112.376 -170.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -74.67 159.13 32.47 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.814 1.646 . . . . 2.7000000000000002 111.665 165.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -46.38 -45.99 18.17 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.124 -1.61 . . . . 2.6400000000000001 113.281 170.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.4 pttm -72.53 -6.59 45.01 Favored 'General case' 0 CA--C 1.55 0.964 0 O-C-N 121.329 -0.857 . . . . 3.1800000000000002 113.282 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -91.42 -61.26 1.69 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.359 1.464 . . . . 1.5900000000000001 109.34 163.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -54.84 -22.96 16.23 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 128.019 2.528 . . . . 2.8500000000000001 115.497 -175.159 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.45 -30.68 20.51 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 124.986 1.315 . . . . 2.6400000000000001 112.484 167.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.2 p -69.16 -36.26 72.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 119.083 0.856 . . . . 2.4199999999999999 112.184 176.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -60.98 -48.14 83.2 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 118.966 0.803 . . . . 2.1299999999999999 111.317 174.058 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 73.0 mt -63.21 -36.13 82.61 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.78 0.832 . . . . 1.9399999999999999 111.573 177.117 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 57.8 m -66.2 -47.12 74.93 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.573 1.149 . . . . 0.83999999999999997 111.228 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.9 mtp -57.41 -43.35 83.7 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.826 1.25 . . . . 1.79 111.705 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 72.8 mt -67.8 -45.02 75.95 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.595 0.758 . . . . 1.4099999999999999 111.725 178.038 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 5.4 m -59.84 -34.79 73.56 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.547 1.067 . . . . 1.3400000000000001 113.749 174.177 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 56.3 mtp -72.44 -34.19 67.62 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.438 0.563 . . . . 2.27 112.026 174.012 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.34 -47.07 68.47 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.591 -0.693 . . . . 0.80000000000000004 112.499 175.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -68.83 -26.63 65.26 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.361 -0.837 . . . . 2.3100000000000001 113.147 176.053 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -63.86 -49.75 71.54 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.679 0.791 . . . . 2.73 111.902 168.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -60.84 -46.4 90.72 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.319 1.048 . . . . 3.29 111.878 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -50.26 -50.87 48.81 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.559 1.544 . . . . 2.1800000000000002 111.494 175.158 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -64.28 -26.58 68.56 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.197 1.399 . . . . 2.0600000000000001 113.201 -177.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 32.5 mt -78.01 -18.91 55.35 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.812 0.845 . . . . 1.5 111.926 175.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -91.9 -36.76 13.29 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.165 1.386 . . . . 3.4100000000000001 113.811 173.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 . . . . . 0 CA--C 1.542 0.636 0 C-N-CA 126.399 1.88 . . . . 3.46 113.607 177.021 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 3' ' ' THR . . . . . 0.414 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 80.5 p . . . . . 0 N--CA 1.472 0.656 0 N-CA-C 113.733 1.012 . . . . 1.6599999999999999 113.733 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 4' ' ' PRO . . . . . 0.414 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 17.6 Cg_endo -52.0 -23.14 16.09 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 124.529 3.486 . . . . 1.53 114.954 163.101 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 56.1 tp -70.41 -48.64 55.13 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 120.092 1.314 . . . . 2.7200000000000002 110.29 174.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.09 -30.65 70.48 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.308 0.504 . . . . 4.8399999999999999 111.203 172.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 21.9 mmtt -66.27 -25.57 66.93 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 119.717 -1.864 . . . . 4.5199999999999996 113.126 169.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.28 -45.32 73.42 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 119.9 1.227 . . . . 0.98999999999999999 111.613 172.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -60.56 -43.2 97.51 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.711 1.204 . . . . 2.8999999999999999 111.655 170.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 25.9 m -57.32 -47.15 82.29 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.192 1.397 . . . . 1.28 111.496 173.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 87.0 m -58.68 -44.29 90.18 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.223 1.009 . . . . 1.3799999999999999 109.867 175.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 3.0 tpp -53.83 -51.47 63.44 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.292 1.037 . . . . 3.3700000000000001 112.61 177.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 10.6 m -67.6 -27.65 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 CA-C-N 118.801 0.728 . . . . 2.1800000000000002 112.511 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 66.2 m -68.34 -47.13 68.31 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.538 1.135 . . . . 0.75 110.93 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.91 -40.63 89.5 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.159 0.584 . . . . 1.73 110.007 166.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -63.66 -55.75 21.06 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 120.276 -0.57 . . . . 1.95 111.355 -169.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 18.7 m170 -62.35 -35.39 78.97 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.454 0.701 . . . . 3.5800000000000001 112.344 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -74.59 -29.85 61.48 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.489 0.922 . . . . 4.1900000000000004 113.489 -175.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -94.95 -37.55 11.1 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.994 1.318 . . . . 2.1099999999999999 112.426 175.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 84.1 p -57.65 -33.27 68.11 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.777 1.171 . . . . 1.9099999999999999 112.666 176.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.88 -3.4 73.75 Favored Glycine 0 CA--C 1.528 0.901 0 CA-C-O 116.378 -2.345 . . . . 1.3400000000000001 116.282 -170.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -65.29 -39.65 92.83 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.779 2.29 . . . . 4.9500000000000002 112.338 178.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -122.0 126.87 49.5 Favored 'General case' 0 C--O 1.254 1.298 0 C-N-CA 129.074 2.949 . . . . 3.3599999999999999 110.46 176.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.98 -128.55 42.6 Favored Glycine 0 C--N 1.337 0.61 0 C-N-CA 126.059 1.79 . . . . 2.1899999999999999 113.646 166.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -52.04 148.11 6.52 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.373 2.669 . . . . 3.3599999999999999 114.194 172.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -106.82 -6.32 17.79 Favored 'General case' 0 CA--C 1.553 1.059 0 N-CA-C 114.45 1.278 . . . . 6.4299999999999997 114.45 -175.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 97.0 mt -99.49 3.56 45.66 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.926 1.29 . . . . 3.3900000000000001 113.005 175.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 2.0 p -145.64 137.95 25.6 Favored 'General case' 0 C--O 1.246 0.871 0 C-N-CA 125.667 1.587 . . . . 1.23 111.938 -166.134 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 48.4 mt -84.45 126.97 33.74 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 114.605 -1.18 . . . . 1.97 109.926 173.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 3.1 m -105.92 150.34 25.75 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 127.037 2.135 . . . . 3.4500000000000002 110.291 -168.011 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 31' ' ' ARG . . . . . 0.494 HH11 ' HG3' ' B' ' 31' ' ' ARG . 5.6 mmm-85 -37.61 -46.69 0.88 Allowed 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 117.095 2.258 . . . . 4.3300000000000001 117.095 -165.47 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.71 -34.23 22.97 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 119.604 1.093 . . . . 4.0300000000000002 112.635 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -50.02 -36.54 29.07 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.386 0.994 . . . . 1.8300000000000001 111.087 165.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.404 ' CD1' HD11 ' B' ' 38' ' ' ILE . 0.3 OUTLIER -70.34 -37.98 74.77 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 112.606 0.595 . . . . 2.2999999999999998 112.606 -174.827 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 26.7 mmtm -63.91 -44.08 94.02 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.646 1.178 . . . . 5.6399999999999997 111.777 171.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 36.2 tp10 -74.5 -15.24 60.88 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 125.56 1.544 . . . . 3.0600000000000001 112.812 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 44.7 tp -96.85 -52.17 3.99 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 120.964 1.711 . . . . 2.1299999999999999 111.831 175.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 0.404 HD11 ' CD1' ' B' ' 34' ' ' LEU . 36.6 mt -52.03 -52.04 26.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 CA-C-N 121.306 1.866 . . . . 1.2 109.995 -179.044 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 tttp -71.8 10.96 0.58 Allowed 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 125.394 1.478 . . . . 4.7999999999999998 113.528 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -128.43 -39.7 1.66 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.43 2.292 . . . . 3.4399999999999999 113.941 175.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -70.98 -13.7 62.1 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 119.505 1.048 . . . . 5.1100000000000003 112.514 169.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -134.45 114.46 12.91 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.925 1.69 . . . . 2.3199999999999998 108.292 175.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 12.3 p -85.66 -11.37 53.98 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.548 1.684 . . . . 4.5899999999999999 115.548 -166.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -58.49 -11.99 3.5 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 117.659 2.466 . . . . 3.9399999999999999 117.659 -163.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.36 -49.56 2.67 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 125.188 1.375 . . . . 3.5600000000000001 113.617 177.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -71.13 66.64 0.42 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.7 2.4 . . . . 5.3300000000000001 110.24 174.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.58 -26.3 8.72 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.866 1.666 . . . . 4.0800000000000001 111.558 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 20.0 mtpp 72.54 84.5 0.12 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.869 2.068 . . . . 4.6900000000000004 113.287 159.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -27.76 -52.2 0.08 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 128.856 2.862 . . . . 5.0199999999999996 116.445 -178.22 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 3.0 m -57.83 -28.8 64.42 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.857 1.208 . . . . 2.8199999999999998 114.215 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 15.0 t -77.75 -8.2 57.64 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.368 1.067 . . . . 3.1400000000000001 113.765 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 49.3 mt -85.2 -40.06 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 120.322 1.419 . . . . 1.8700000000000001 113.804 -165.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.24 -23.41 61.22 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 118.981 0.81 . . . . 3.1899999999999999 111.221 172.411 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -76.15 -44.52 37.92 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.451 0.7 . . . . 2.73 111.504 169.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 51.4 tp -55.01 -45.65 75.13 Favored 'General case' 0 C--N 1.344 0.355 0 O-C-N 121.039 -1.038 . . . . 2.21 110.045 168.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 56' ' ' MET . . . . . 0.415 ' SD ' ' HD2' ' B' ' 31' ' ' ARG . 4.6 ttt -58.26 -51.12 71.12 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.951 0.796 . . . . 1.9199999999999999 111.463 175.396 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -54.97 -28.39 51.2 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.649 1.179 . . . . 4.0999999999999996 113.311 173.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.0 t -81.2 -30.3 34.34 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.31 1.044 . . . . 2.0 112.933 177.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 96.1 mt -86.25 -35.89 19.71 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.0 1.32 . . . . 2.3100000000000001 112.798 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -75.94 70.99 2.72 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.489 1.915 . . . . 1.6599999999999999 111.129 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.91 -8.91 2.49 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.475 1.51 . . . . 3.21 114.996 -173.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -110.07 -0.63 17.93 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 120.05 1.295 . . . . 2.5800000000000001 113.71 172.008 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 73.8 m 55.81 33.93 22.46 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.176 1.39 . . . . 2.7799999999999998 113.628 -178.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -102.37 3.8 38.27 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 129.799 3.24 . . . . 2.46 112.033 -168.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 67.26 -10.3 0.35 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 131.117 3.767 . . . . 4.0599999999999996 115.454 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -109.74 144.88 37.52 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 126.163 1.785 . . . . 2.6499999999999999 110.391 175.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 19.8 mt -114.22 106.7 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 O-C-N 121.161 -0.962 . . . . 1.25 111.241 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -68.91 159.99 31.59 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.989 2.116 . . . . 2.8799999999999999 110.923 172.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.6 -35.48 54.42 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 120.145 -1.597 . . . . 2.5800000000000001 112.829 170.284 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -63.53 -25.05 68.07 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.623 0.769 . . . . 3.8999999999999999 113.059 173.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -89.47 -54.77 3.94 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 125.835 1.654 . . . . 1.8300000000000001 110.17 174.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -58.42 -32.19 68.42 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 127.0 2.12 . . . . 1.76 113.908 -176.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 9.1 p -53.88 -28.01 33.69 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.199 -1.563 . . . . 1.8999999999999999 113.587 168.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 59.7 t -72.31 -31.23 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 120.265 1.393 . . . . 1.6399999999999999 111.25 177.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -63.43 -54.51 35.47 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.556 -0.715 . . . . 2.4399999999999999 110.192 173.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 72.1 mt -54.33 -40.1 67.68 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.552 1.141 . . . . 1.3300000000000001 111.366 174.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.4 m -59.94 -53.97 51.58 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.047 0.939 . . . . 0.80000000000000004 111.544 176.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.9 mtm -60.55 -40.04 90.15 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.373 0.533 . . . . 1.6000000000000001 112.222 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 98.1 mt -59.27 -52.43 65.68 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.356 0.662 . . . . 1.5 110.685 174.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 93.2 m -59.28 -33.55 71.19 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.537 1.31 . . . . 1.6399999999999999 114.537 177.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 81.6 mtp -70.19 -33.72 72.07 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.71 0.804 . . . . 1.99 112.74 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.73 -34.76 58.09 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.42 1.009 . . . . 0.92000000000000004 112.079 171.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -62.03 -27.53 68.95 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.133 0.973 . . . . 2.29 112.926 175.023 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -60.9 -51.72 68.08 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.738 0.815 . . . . 2.23 111.154 170.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.7 -30.64 64.39 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 126.142 1.777 . . . . 3.2200000000000002 111.913 -176.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.68 -51.19 70.43 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.492 1.517 . . . . 2.1299999999999999 110.793 166.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -61.29 -28.32 69.11 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.786 0.834 . . . . 2.2799999999999998 112.336 178.21 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 63.8 mt -70.64 -39.72 73.5 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.5 -0.75 . . . . 2.1499999999999999 112.083 171.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -75.55 -19.13 59.51 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 115.087 1.514 . . . . 3.3500000000000001 115.087 177.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -78.43 -32.61 48.66 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.143 1.377 . . . . 4.1200000000000001 112.547 171.101 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -83.6 -8.55 59.29 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.696 0.999 . . . . 3.75 113.696 -173.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.892 0 CA-C-O 116.335 -1.793 . . . . 5.96 115.462 -167.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 106.856 -1.535 . . . . 4.0 106.856 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 81.2 p -113.12 155.09 44.85 Favored Pre-proline 0 N--CA 1.466 0.343 0 C-N-CA 124.661 1.184 . . . . 2.0299999999999998 110.316 165.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -67.7 -16.23 46.05 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 121.95 1.766 . . . . 2.27 111.339 165.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.37 -50.44 65.55 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 123.871 0.868 . . . . 2.3700000000000001 111.02 -178.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -58.95 -43.58 91.3 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 118.778 0.717 . . . . 3.6299999999999999 111.777 173.118 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.37 -24.16 65.67 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.246 -0.909 . . . . 5.6900000000000004 111.428 -175.36 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.52 -49.94 23.97 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.789 0.836 . . . . 1.8 111.094 166.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.5 mt -53.64 -32.11 50.05 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.48 1.036 . . . . 2.4399999999999999 112.176 175.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.27 -40.8 62.21 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 117.571 -1.204 . . . . 2.4500000000000002 112.137 173.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.5 t -61.81 -26.09 67.89 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 120.288 1.403 . . . . 3.0899999999999999 112.187 -177.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 13.4 mtm -65.23 -37.43 87.23 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.798 0.839 . . . . 3.1299999999999999 111.026 174.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 67.1 t -76.81 -32.7 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.076 1.351 . . . . 1.98 111.357 173.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 51.6 m -64.04 -49.41 72.48 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.295 1.038 . . . . 1.1799999999999999 110.65 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.4 p -64.72 -33.31 75.66 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.691 0.678 . . . . 2.3999999999999999 110.108 173.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.41 -56.5 19.61 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 118.411 0.55 . . . . 2.3300000000000001 109.627 178.339 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -45.67 84.37 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 120.48 -1.387 . . . . 2.6099999999999999 111.68 -178.318 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -68.23 -49.1 62.94 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.151 -0.968 . . . . 6.29 113.373 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -76.97 -28.17 55.04 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.875 1.216 . . . . 2.1600000000000001 112.427 178.276 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.8 p -68.97 -25.57 64.6 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-N 120.955 1.707 . . . . 2.1600000000000001 112.274 170.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -82.91 3.7 82.85 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 125.96 1.743 . . . . 1.9299999999999999 114.298 167.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.6 ttt-85 -64.21 -31.7 73.0 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.865 1.832 . . . . 6.2300000000000004 111.25 171.642 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -157.41 147.39 20.61 Favored 'General case' 0 C--O 1.249 1.075 0 C-N-CA 124.226 1.01 . . . . 3.8900000000000001 112.878 178.571 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.49 -123.63 30.78 Favored Glycine 0 C--N 1.338 0.694 0 C-N-CA 126.129 1.823 . . . . 2.7000000000000002 112.636 160.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.0 m -47.13 112.5 0.53 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.83 1.252 . . . . 3.3599999999999999 110.752 169.348 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.16 24.85 2.36 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.582 1.553 . . . . 4.6399999999999997 114.372 -169.647 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.5 tp -143.44 -43.23 0.28 Allowed 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 124.971 1.308 . . . . 4.1200000000000001 110.559 -177.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 16.9 p -79.83 144.52 33.42 Favored 'General case' 0 C--O 1.248 0.996 0 CA-C-O 122.859 1.314 . . . . 0.93000000000000005 110.849 172.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 28.0 mt -88.26 92.17 9.06 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 105.916 -1.883 . . . . 1.7 105.916 165.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.1 t -60.5 149.77 33.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 119.009 -0.52 . . . . 2.04 109.994 169.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -37.61 -49.7 1.11 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.507 1.923 . . . . 3.9199999999999999 113.26 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.492 ' H ' ' HD3' ' A' ' 32' ' ' LYS . 0.8 OUTLIER -70.06 -28.58 65.56 Favored 'General case' 0 CA--C 1.554 1.121 0 O-C-N 119.51 -1.994 . . . . 5.4900000000000002 115.032 -179.837 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -74.91 -38.37 61.84 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.42 1.488 . . . . 1.5800000000000001 109.921 174.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.7 tp -63.4 -39.63 95.02 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.878 0.871 . . . . 1.8300000000000001 111.462 173.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.2 ttmt -55.25 -40.41 70.88 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 119.094 0.861 . . . . 3.8199999999999998 112.005 175.3 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -60.6 -59.03 6.04 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.963 0.905 . . . . 3.5099999999999998 111.647 170.365 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.7 tp -56.34 -48.77 76.09 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.412 1.485 . . . . 2.0699999999999998 113.641 -172.309 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.2 mt -53.57 -61.32 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 CA-C-N 118.64 0.655 . . . . 0.93000000000000005 110.246 -174.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.87 1.04 28.59 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 113.608 0.966 . . . . 5.1299999999999999 113.608 -172.372 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 43.6 mmtt -91.77 -33.58 14.94 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.012 1.325 . . . . 2.9300000000000002 112.859 174.248 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -89.24 -51.66 5.46 Favored 'General case' 0 CA--C 1.532 0.25 0 O-C-N 124.265 0.978 . . . . 5.2400000000000002 110.303 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 46.7 mt -78.96 67.27 4.62 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.714 1.206 . . . . 2.6899999999999999 111.33 -176.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 98.9 m -63.78 -12.95 39.82 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.349 1.611 . . . . 3.8799999999999999 115.349 -163.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.503 HD23 ' H ' ' A' ' 44' ' ' LEU . 1.6 pt? -99.69 0.59 42.21 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 126.789 2.036 . . . . 3.5099999999999998 114.733 178.042 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -82.51 121.77 5.54 Favored Glycine 0 CA--C 1.531 1.088 0 O-C-N 121.595 -0.691 . . . . 3.79 114.109 -168.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -72.78 60.17 0.5 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.008 1.723 . . . . 6.2599999999999998 111.347 165.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.3 mmt -78.19 68.99 4.33 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 124.054 1.883 . . . . 3.4199999999999999 110.793 173.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -58.84 113.87 2.27 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 113.083 -1.871 . . . . 5.04 108.301 174.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -52.35 -35.98 52.48 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 117.097 2.258 . . . . 4.7199999999999998 117.097 -136.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.9 t -57.62 -25.56 60.29 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 120.541 1.519 . . . . 3.6600000000000001 113.597 177.288 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.1 t -69.34 -17.92 63.75 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.991 -1.068 . . . . 2.98 113.611 174.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 17.8 mm -61.08 -41.74 90.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 119.897 1.226 . . . . 1.55 109.679 168.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -77.59 -39.05 46.9 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.61 1.164 . . . . 3.4300000000000002 111.89 -169.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.46 ' CG ' ' HE2' ' A' ' 57' ' ' LYS . 1.2 m-20 -79.33 -26.93 42.1 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.589 1.156 . . . . 3.9700000000000002 112.888 175.529 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 43.9 tp -59.88 -52.99 63.07 Favored 'General case' 0 C--N 1.344 0.326 0 CA-C-N 118.858 0.754 . . . . 1.97 109.116 159.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -55.99 -48.62 75.52 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.295 1.038 . . . . 2.1899999999999999 111.544 -176.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.46 ' HE2' ' CG ' ' A' ' 54' ' ' ASP . 16.3 mtmm -51.92 -36.98 50.89 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.838 1.255 . . . . 5.0 114.304 171.563 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 50.8 m -84.27 -18.82 35.17 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.177 1.391 . . . . 2.5699999999999998 113.882 -178.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 97.8 mt -83.93 -54.54 4.8 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 124.412 1.085 . . . . 2.1299999999999999 109.973 170.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -78.72 90.22 4.61 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.438 1.095 . . . . 1.6799999999999999 112.482 175.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -78.91 -2.39 39.72 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.95 0.722 . . . . 3.2200000000000002 112.95 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -83.03 -30.46 28.06 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 114.299 1.222 . . . . 2.0800000000000001 114.299 173.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 28.6 t 64.63 23.93 12.9 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.998 0.919 . . . . 3.02 113.131 -159.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 55.3 p-10 -81.8 -10.41 59.34 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.039 1.336 . . . . 2.3999999999999999 111.813 176.421 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 63.57 4.61 1.85 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 129.545 3.138 . . . . 3.6899999999999999 114.247 -171.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -106.52 131.03 54.17 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 128.508 2.723 . . . . 2.5099999999999998 110.002 175.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 35.0 mm -87.9 113.97 25.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 O-C-N 120.62 -1.3 . . . . 1.51 108.936 168.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -76.87 162.37 27.67 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.462 1.505 . . . . 2.6499999999999999 109.485 167.12 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.37 -43.3 79.06 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 119.91 -1.744 . . . . 3.1000000000000001 112.944 -176.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.1 pttm -70.19 -14.51 62.66 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.023 1.329 . . . . 3.1099999999999999 114.435 174.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -85.41 -41.76 15.14 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.506 1.123 . . . . 1.9399999999999999 110.666 168.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -57.48 -29.85 64.59 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.637 -1.289 . . . . 2.3100000000000001 112.637 174.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.0 m -51.49 -32.42 27.37 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.678 1.191 . . . . 1.6699999999999999 113.738 166.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 32.7 t -70.06 -39.91 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-N 119.652 1.115 . . . . 1.8700000000000001 109.597 179.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -64.76 -54.13 36.21 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 123.458 0.703 . . . . 2.1000000000000001 109.368 177.174 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.1 mt -58.58 -35.43 72.4 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.232 1.013 . . . . 1.8500000000000001 112.075 178.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 86.3 m -63.99 -55.65 20.82 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.378 0.99 . . . . 0.80000000000000004 110.509 175.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 77.2 mtm -59.75 -43.88 94.09 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 118.921 0.782 . . . . 1.51 112.193 -175.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.01 -51.97 64.76 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.928 0.891 . . . . 2.4300000000000002 112.215 174.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 8.9 t -63.06 -32.3 73.64 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.38 0.511 . . . . 1.3899999999999999 112.38 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 80.6 mtp -69.55 -32.67 71.61 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.11 0.782 . . . . 1.54 113.11 171.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.64 -43.09 94.78 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.81 1.186 . . . . 0.90000000000000002 111.776 172.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -63.68 -28.17 69.72 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.077 1.14 . . . . 2.2400000000000002 114.077 176.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -61.12 -47.56 85.68 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.805 0.73 . . . . 1.77 111.673 171.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -66.85 -43.94 82.36 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.322 0.649 . . . . 3.1899999999999999 111.414 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -51.08 61.71 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.73 1.612 . . . . 2.1400000000000001 111.609 175.754 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -66.55 -35.03 79.22 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.192 -0.942 . . . . 3.5299999999999998 111.789 -178.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.1 mt -68.55 -33.05 73.43 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.299 0.64 . . . . 2.3799999999999999 112.092 175.578 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -75.87 -35.62 59.83 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 114.054 1.131 . . . . 2.8199999999999998 114.054 177.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 . . . . . 0 CA--C 1.543 0.686 0 C-N-CA 126.17 1.788 . . . . 3.6299999999999999 112.678 178.367 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 3' ' ' THR . . . . . 0.486 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 72.3 p . . . . . 0 N--CA 1.482 1.168 0 N-CA-C 113.677 0.992 . . . . 1.6399999999999999 113.677 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 4' ' ' PRO . . . . . 0.486 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 24.6 Cg_endo -59.07 -31.02 94.81 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.47 2.113 . . . . 1.5 113.404 167.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.99 -48.41 71.31 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 119.642 1.11 . . . . 2.6600000000000001 111.409 178.414 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -64.77 -39.65 93.96 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 118.773 0.715 . . . . 3.7200000000000002 111.891 174.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -58.09 -31.14 66.83 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.354 -1.466 . . . . 4.6200000000000001 112.632 172.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.35 -31.36 72.1 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.977 0.808 . . . . 1.02 112.631 175.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 58.0 mt -65.82 -52.32 51.56 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.334 1.054 . . . . 2.1400000000000001 110.033 175.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 90.4 m -52.46 -43.64 65.06 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.998 1.319 . . . . 1.8799999999999999 111.51 172.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 59.7 m -64.58 -40.67 95.95 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.764 1.226 . . . . 1.5800000000000001 112.534 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 1.5 tmm? -74.48 -43.81 54.32 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 118.624 0.647 . . . . 3.75 112.598 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 16.4 m -61.76 -20.48 23.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 O-C-N 120.636 -1.29 . . . . 2.3999999999999999 112.065 174.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 98.4 m -63.59 -55.5 23.27 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 117.388 -1.291 . . . . 1.6599999999999999 111.782 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 17.0 p -66.79 -33.46 75.67 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 120.048 1.295 . . . . 1.9399999999999999 110.188 175.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -65.0 -46.52 81.06 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 120.803 -0.359 . . . . 2.1099999999999999 111.917 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 23.8 m-70 -64.21 -49.56 71.48 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.096 0.958 . . . . 4.3799999999999999 111.343 171.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -56.15 -43.5 78.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.664 0.785 . . . . 4.5300000000000002 112.763 -175.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -91.66 -31.42 15.85 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.611 1.164 . . . . 2.71 113.174 -177.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 72.9 m -65.81 -42.07 91.09 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 121.271 1.85 . . . . 1.8999999999999999 111.469 172.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.74 -3.39 90.35 Favored Glycine 0 CA--C 1.531 1.073 0 C-N-CA 126.632 2.063 . . . . 1.7 114.555 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -26.18 67.42 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.871 1.668 . . . . 3.3500000000000001 112.053 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 23' ' ' GLU . . . . . 0.561 ' HG2' ' HE3' ' B' ' 32' ' ' LYS . 0.0 OUTLIER -149.91 167.53 26.38 Favored 'General case' 0 C--O 1.245 0.846 0 C-N-CA 125.676 1.59 . . . . 5.3200000000000003 113.107 159.673 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.11 -105.14 0.42 Allowed Glycine 0 N--CA 1.473 1.161 0 O-C-N 126.227 2.204 . . . . 3.2799999999999998 115.698 128.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -61.4 89.92 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 107.056 -1.461 . . . . 4.9100000000000001 107.056 163.198 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 37.7 mttm -93.09 -26.53 17.42 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 120.315 -1.491 . . . . 6.71 114.695 -158.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.429 ' H ' HD23 ' B' ' 27' ' ' LEU . 2.0 pt? -80.62 -26.2 37.9 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.904 0.882 . . . . 4.4400000000000004 112.242 172.511 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.1 p -103.76 151.23 23.28 Favored 'General case' 0 C--O 1.246 0.903 0 C-N-CA 126.932 2.093 . . . . 1.1399999999999999 113.18 -177.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 20.7 mt -76.65 101.54 5.79 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 106.189 -1.782 . . . . 1.6399999999999999 106.189 154.141 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.422 ' HB3' ' HE2' ' B' ' 32' ' ' LYS . 17.9 t -62.61 147.41 49.36 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.777 -0.823 . . . . 2.0899999999999999 108.777 165.494 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -41.75 -41.68 2.39 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.801 1.64 . . . . 4.1500000000000004 113.674 -174.245 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.561 ' HE3' ' HG2' ' B' ' 23' ' ' GLU . 0.2 OUTLIER -60.37 -49.26 78.3 Favored 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 117.167 2.284 . . . . 6.2699999999999996 117.167 168.439 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -64.69 -35.67 81.8 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.801 1.637 . . . . 2.3599999999999999 110.86 173.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 40.3 tp -62.6 -51.09 68.67 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.179 0.592 . . . . 2.0899999999999999 110.531 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 35' ' ' LYS . . . . . 0.511 ' HA ' HG21 ' B' ' 52' ' ' ILE . 20.4 mmtt -52.32 -39.77 61.02 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.782 1.233 . . . . 4.0800000000000001 113.183 177.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -68.29 -57.64 5.64 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.147 1.379 . . . . 3.73 111.855 172.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 24.4 tp -52.6 -58.93 5.21 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.457 1.903 . . . . 2.5299999999999998 111.585 -174.285 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 0.417 ' CD1' HG23 ' B' ' 52' ' ' ILE . 54.0 mt -53.98 -42.82 55.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 CA-C-O 121.626 0.727 . . . . 1.3300000000000001 110.46 -177.682 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 65.2 tttt -64.15 -18.26 64.27 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 113.145 0.794 . . . . 4.5899999999999999 113.145 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 19.6 mmtp -97.44 -45.57 6.39 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.178 1.391 . . . . 4.1699999999999999 112.294 167.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -61.76 -35.97 79.67 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.605 1.962 . . . . 4.0899999999999999 112.038 -170.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -110.96 -70.52 0.81 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.72 1.208 . . . . 2.1800000000000002 109.766 167.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 2.2 t 67.24 -64.91 0.24 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.18 1.792 . . . . 5.4400000000000004 113.118 -169.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.4 ' HB3' ' H ' ' B' ' 45' ' ' GLY . 4.2 mm? 30.36 -135.06 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 127.942 2.497 . . . . 3.6299999999999999 112.33 -171.391 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 45' ' ' GLY . . . . . 0.4 ' H ' ' HB3' ' B' ' 44' ' ' LEU . . . -89.0 -35.79 8.02 Favored Glycine 0 CA--C 1.528 0.874 0 O-C-N 120.303 -1.498 . . . . 3.21 111.057 165.368 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -89.72 -27.77 19.85 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.369 1.868 . . . . 6.79 114.632 -159.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.77 68.69 7.11 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 123.951 1.834 . . . . 2.73 111.92 -175.505 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp -134.3 161.22 35.56 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 129.12 2.968 . . . . 6.8499999999999996 108.487 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -40.57 -64.29 0.54 Allowed 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 116.619 2.081 . . . . 3.3999999999999999 116.619 -131.124 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 13.5 m -65.83 -25.62 67.29 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.272 1.212 . . . . 2.46 114.272 -173.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 5.3 m -62.41 -5.25 2.34 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.611 1.165 . . . . 2.27 112.898 170.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 52' ' ' ILE . . . . . 0.511 HG21 ' HA ' ' B' ' 35' ' ' LYS . 62.9 mt -110.33 -22.69 4.86 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 125.606 1.562 . . . . 1.3100000000000001 112.042 175.058 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -80.06 -48.76 12.77 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.262 0.937 . . . . 3.3100000000000001 112.313 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -68.67 -33.05 73.31 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 118.917 0.781 . . . . 2.7999999999999998 110.252 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 8.3 tt -62.12 -44.3 96.94 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 117.269 -1.348 . . . . 2.3300000000000001 111.073 172.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ttt -58.44 -48.91 79.17 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 121.943 2.156 . . . . 2.1499999999999999 112.133 169.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.23 -20.96 20.6 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 120.09 1.313 . . . . 5.4100000000000001 113.47 174.08 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 31.0 t -89.25 -38.1 14.47 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.967 1.707 . . . . 2.3799999999999999 112.738 176.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 7.3 mp -71.72 -59.7 2.62 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 126.504 1.921 . . . . 2.3500000000000001 111.809 174.061 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -78.66 95.15 5.2 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 127.869 2.468 . . . . 1.4199999999999999 110.748 -170.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.2 -39.89 84.02 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 114.418 1.266 . . . . 2.8399999999999999 114.418 -169.159 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 53.2 p-10 -99.91 -6.21 27.07 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.045 1.498 . . . . 1.9399999999999999 115.045 -173.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 17.9 t 64.02 26.41 14.06 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.776 1.23 . . . . 2.3700000000000001 113.742 -177.309 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 50.8 p30 -68.16 -15.98 63.81 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.406 1.482 . . . . 2.1000000000000001 111.493 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 64.58 22.32 12.62 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 129.273 3.029 . . . . 4.3799999999999999 113.563 -175.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -131.74 123.76 28.35 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 127.775 2.43 . . . . 2.98 107.562 175.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 18.8 mm -90.81 110.72 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 O-C-N 120.993 -1.067 . . . . 1.3700000000000001 111.662 -173.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -76.13 150.54 37.18 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.881 1.273 . . . . 2.6600000000000001 110.167 161.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.04 -33.11 72.77 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 119.96 -1.713 . . . . 2.8399999999999999 112.333 -174.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 19.1 pttm -74.32 -9.12 58.29 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.326 1.232 . . . . 3.5299999999999998 114.326 173.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -81.82 -53.19 6.39 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 108.011 -1.107 . . . . 1.78 108.011 157.485 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -61.37 -25.56 67.25 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 116.518 2.044 . . . . 3.6699999999999999 116.518 -172.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 94.4 p -65.53 -19.69 66.03 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.207 -1.558 . . . . 1.6399999999999999 111.886 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 1.2 p -69.36 -27.78 35.83 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 N-CA-C 113.0 0.741 . . . . 2.48 113.0 170.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 45.8 t80 -61.03 -51.25 69.99 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 120.822 -1.174 . . . . 2.4300000000000002 110.454 170.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 33.5 mt -59.71 -38.4 81.51 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.419 1.088 . . . . 1.3799999999999999 110.658 177.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.4 m -59.86 -54.21 48.82 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.725 1.21 . . . . 0.91000000000000003 111.417 174.382 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -55.31 -42.81 74.2 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.708 1.14 . . . . 2.1699999999999999 112.942 177.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 93.7 mt -63.83 -48.64 75.99 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.604 0.762 . . . . 1.73 111.52 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 75.1 m -67.58 -32.93 74.03 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 113.038 0.755 . . . . 1.6799999999999999 113.038 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 88.6 mtp -68.71 -36.04 77.95 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.643 0.656 . . . . 2.0499999999999998 112.082 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.91 -42.98 72.63 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 119.068 0.849 . . . . 1.1000000000000001 112.049 172.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -63.0 -25.76 68.54 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 119.686 1.13 . . . . 3.0099999999999998 113.77 176.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -62.54 -51.51 67.11 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 120.0 1.273 . . . . 2.0600000000000001 111.854 168.359 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -71.65 -29.34 64.52 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.578 1.151 . . . . 3.4100000000000001 112.456 -174.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -58.86 -56.5 21.41 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.584 1.554 . . . . 3.3199999999999998 110.678 164.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -60.17 -27.18 66.91 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.684 1.194 . . . . 2.2000000000000002 113.152 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 68.7 mt -66.37 -40.9 90.01 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 117.507 -1.235 . . . . 2.29 112.021 171.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -86.89 -1.73 58.04 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.782 1.401 . . . . 4.0899999999999999 114.782 176.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -76.43 -33.58 58.78 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 120.79 -1.194 . . . . 3.3199999999999998 111.605 159.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -102.86 7.96 39.31 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.506 1.523 . . . . 2.8799999999999999 113.918 -170.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 N-CA-C 118.844 2.905 . . . . 4.9000000000000004 118.844 -161.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 17.6 mp0 . . . . . 0 N--CA 1.445 -0.725 0 N-CA-C 106.887 -1.524 . . . . 3.4100000000000001 106.887 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.663 HG21 ' HA ' ' B' ' 41' ' ' GLU . 3.9 p -151.03 162.73 25.98 Favored Pre-proline 0 N--CA 1.472 0.628 0 N-CA-C 113.828 1.048 . . . . 1.6699999999999999 113.828 -138.091 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -63.65 -39.17 36.46 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.312 2.675 . . . . 2.9300000000000002 113.131 179.167 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.2 tp -71.29 -49.98 37.27 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.136 1.335 . . . . 4.0300000000000002 111.423 -177.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -63.55 -37.57 87.83 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.546 0.738 . . . . 5.3899999999999997 109.868 -177.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -67.53 -35.71 79.6 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 120.878 -1.139 . . . . 4.8700000000000001 112.55 171.744 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.16 -41.7 85.57 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.832 1.196 . . . . 1.4099999999999999 112.428 173.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.4 mt -62.74 -44.6 95.77 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.154 1.382 . . . . 1.76 110.211 172.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 68.4 m -53.45 -50.98 64.13 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.444 1.097 . . . . 1.6599999999999999 110.649 172.707 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 99.2 m -56.08 -48.96 75.11 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.727 0.811 . . . . 1.55 110.866 175.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 40.3 ttm -60.85 -45.85 92.9 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.99 1.316 . . . . 2.9500000000000002 112.432 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.3 t -62.65 -41.15 91.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 126.157 1.783 . . . . 2.1000000000000001 110.021 175.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 88.2 m -64.37 -50.7 66.67 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 124.24 1.016 . . . . 0.83999999999999997 111.138 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.3 p -63.66 -36.67 84.62 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.153 0.888 . . . . 2.1600000000000001 110.603 174.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -66.05 -53.18 41.6 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.328 -0.549 . . . . 2.3599999999999999 111.094 -177.232 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -69.81 -37.24 76.19 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.073 -1.017 . . . . 3.9300000000000002 112.887 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -70.74 -48.48 54.25 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 119.637 1.108 . . . . 4.0999999999999996 112.355 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -69.56 -23.54 63.57 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.17 0.896 . . . . 2.3799999999999999 111.601 172.552 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.0 t -64.5 -21.37 66.66 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 120.126 1.33 . . . . 2.0699999999999998 112.973 169.739 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.9 -3.76 79.62 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.128 1.347 . . . . 1.6399999999999999 114.946 174.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -67.11 -33.4 75.39 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.723 1.762 . . . . 5.1200000000000001 111.871 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -146.89 141.01 26.11 Favored 'General case' 0 C--O 1.249 1.03 0 C-N-CA 125.039 1.336 . . . . 3.9199999999999999 111.096 -178.834 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 45.53 -124.3 6.69 Favored Glycine 0 C--N 1.338 0.689 0 C-N-CA 126.232 1.873 . . . . 2.9900000000000002 112.131 165.221 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.4 m -41.77 114.33 0.52 Allowed 'General case' 0 C--O 1.245 0.857 0 C-N-CA 125.643 1.577 . . . . 2.6899999999999999 111.949 173.605 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 44.7 mtpt -86.75 109.94 19.58 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.518 1.527 . . . . 4.75 107.648 151.049 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.8 mt 152.03 -61.12 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 130.971 3.709 . . . . 3.8100000000000001 107.431 -164.173 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.3 p -111.64 160.07 17.58 Favored 'General case' 0 C--O 1.246 0.918 0 C-N-CA 127.022 2.129 . . . . 1.02 112.685 -171.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.2 mt -92.15 108.31 19.85 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 114.285 -1.325 . . . . 1.72 108.382 160.432 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.85 162.48 24.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.25 0.547 . . . . 2.1099999999999999 111.908 167.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.1 tpt85 -45.87 -27.69 0.93 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 127.682 2.393 . . . . 3.3500000000000001 114.829 -169.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.1 -28.89 12.07 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.552 1.141 . . . . 4.9699999999999998 113.244 177.412 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -58.0 -50.06 74.69 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.455 0.702 . . . . 2.6099999999999999 109.288 171.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.3 tp -62.42 -51.31 68.03 Favored 'General case' 0 C--N 1.344 0.369 0 C-N-CA 123.709 0.804 . . . . 2.1400000000000001 111.223 175.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.3 ttmm -55.77 -38.84 70.42 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 118.547 0.612 . . . . 3.4100000000000001 112.261 -176.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -70.79 -41.8 71.18 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 117.724 -1.132 . . . . 3.7599999999999998 113.228 176.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.02 -54.09 50.07 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.709 1.604 . . . . 2.3199999999999998 111.065 177.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.7 mt -53.25 -47.39 56.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 CA-C-O 122.167 0.984 . . . . 0.81000000000000005 109.221 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -67.59 -8.49 34.76 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 125.246 1.418 . . . . 5.6699999999999999 113.522 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -94.22 -50.33 5.32 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 119.848 -1.782 . . . . 3.6200000000000001 110.646 160.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 73.5 tt0 -52.25 -65.79 0.5 Allowed 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 128.999 2.92 . . . . 4.6200000000000001 111.862 -171.253 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -77.81 115.61 17.69 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 125.777 1.631 . . . . 2.2799999999999998 108.397 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 21.6 p -83.24 1.1 42.52 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.988 1.107 . . . . 5.9900000000000002 113.988 171.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -150.54 -172.56 4.22 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.07 0.948 . . . . 4.04 112.7 -155.828 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.71 9.1 50.8 Favored Glycine 0 N--CA 1.472 1.099 0 C-N-CA 124.207 0.908 . . . . 4.9800000000000004 114.996 170.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 54.32 32.61 16.65 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.431 1.492 . . . . 6.1100000000000003 112.703 -169.085 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.87 23.85 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.034 1.734 . . . . 2.8100000000000001 114.899 -177.675 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.0 mtpt -78.94 -168.09 1.34 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 127.895 2.478 . . . . 5.0899999999999999 112.133 -175.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -44.5 -62.32 1.23 Allowed 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 116.649 2.092 . . . . 4.8600000000000003 116.649 -161.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.6 t -71.77 -25.44 62.03 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.592 1.087 . . . . 2.4900000000000002 112.788 -175.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.3 m -68.41 -21.53 64.67 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.025 1.33 . . . . 2.7400000000000002 112.045 174.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 81.8 mt -80.9 -31.75 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 123.857 0.863 . . . . 1.51 111.939 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -73.56 -33.03 64.48 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.762 1.165 . . . . 3.5899999999999999 113.67 -174.784 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -70.77 -40.86 72.38 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 118.708 0.685 . . . . 2.3700000000000001 111.185 163.471 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.12 -47.82 82.12 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 118.474 -0.774 . . . . 1.8 110.296 178.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.5 mtp -53.42 -50.27 65.56 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 120.114 1.325 . . . . 2.2200000000000002 111.332 177.379 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.65 -35.11 67.99 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.245 1.418 . . . . 3.5099999999999998 113.064 174.56 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.7 m -84.58 -32.71 23.64 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.949 1.3 . . . . 3.27 112.656 -175.182 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 88.8 mt -76.34 -46.93 25.29 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 125.848 1.659 . . . . 2.5600000000000001 112.271 175.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -70.31 141.18 52.37 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.842 1.657 . . . . 1.6100000000000001 112.984 -172.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -112.44 -26.29 8.78 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 126.295 1.838 . . . . 3.7999999999999998 113.468 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.28 -23.02 57.35 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 120.349 1.431 . . . . 2.4300000000000002 111.652 175.298 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.8 t 70.53 41.64 0.94 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.701 2.4 . . . . 2.23 111.862 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -116.09 -117.24 0.32 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.94 1.296 . . . . 3.0600000000000001 109.249 -160.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -146.63 -10.35 0.47 Allowed 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 116.269 1.951 . . . . 4.4800000000000004 116.269 163.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -105.99 140.01 39.66 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 127.682 2.393 . . . . 2.75 110.937 177.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.2 mm -94.24 112.93 27.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 113.018 -1.901 . . . . 1.1699999999999999 109.938 177.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -61.21 157.08 16.98 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.674 1.19 . . . . 3.5099999999999998 111.01 163.464 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.76 -27.74 60.04 Favored 'General case' 0 CA--C 1.553 1.063 0 O-C-N 120.518 -1.364 . . . . 2.0899999999999999 111.697 164.356 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -69.93 -38.81 76.32 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.32 1.848 . . . . 3.7400000000000002 111.983 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 64.4 mt-10 -73.16 -51.86 16.31 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.761 1.624 . . . . 1.6699999999999999 109.246 173.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -49.98 -32.36 14.86 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.647 1.579 . . . . 2.1000000000000001 113.289 174.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.1 m -62.3 -30.81 71.41 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.466 -1.396 . . . . 1.6499999999999999 113.743 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.6 m -79.71 -25.05 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 CA-C-N 120.897 1.68 . . . . 2.5099999999999998 112.282 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -65.72 -64.07 0.95 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.329 0.651 . . . . 1.8700000000000001 111.279 172.541 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -53.82 -44.83 70.55 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 125.319 1.447 . . . . 2.4700000000000002 111.139 -178.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 48.6 m -59.2 -41.41 88.46 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 118.233 -0.889 . . . . 1.04 113.082 176.189 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 67.1 mtm -64.24 -36.04 82.8 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.12 1.327 . . . . 1.9399999999999999 112.204 175.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 78.3 mt -64.77 -43.65 92.58 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 118.866 0.757 . . . . 1.3799999999999999 111.752 173.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 79.8 m -58.57 -42.43 87.96 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 112.903 0.705 . . . . 1.9399999999999999 112.903 171.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 80.2 mtp -64.42 -32.97 74.81 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.687 0.676 . . . . 2.1499999999999999 112.559 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.09 -43.51 57.42 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.769 1.168 . . . . 0.81000000000000005 112.514 173.342 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -61.47 -31.82 71.8 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.298 0.954 . . . . 2.4399999999999999 113.152 175.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -57.41 -49.68 75.42 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.572 0.749 . . . . 1.97 112.866 169.473 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.93 -32.68 65.46 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.149 0.58 . . . . 3.3999999999999999 111.697 -174.015 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.81 -48.65 79.11 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.388 1.475 . . . . 2.48 111.152 166.43 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -63.65 -36.59 84.32 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.551 1.54 . . . . 2.7200000000000002 111.959 176.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 19.8 mt -72.33 -13.05 61.39 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.635 1.174 . . . . 1.99 114.029 -178.647 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -93.87 -1.75 54.37 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 114.782 1.401 . . . . 3.6699999999999999 114.782 168.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 16.6 t70 . . . . . 0 CA--C 1.543 0.682 0 C-N-CA 124.11 0.964 . . . . 4.4100000000000001 110.568 165.408 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 64.3 p . . . . . 0 N--CA 1.469 0.518 0 N-CA-C 111.797 0.295 . . . . 2.02 111.797 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -66.39 -9.16 22.94 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.507 2.138 . . . . 1.5600000000000001 112.576 165.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tt -75.45 -58.64 3.16 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.186 -1.388 . . . . 2.7200000000000002 109.586 169.036 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -48.1 -52.39 20.6 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.864 1.211 . . . . 4.3499999999999996 110.613 170.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 2.2 tptm -64.7 -31.69 73.02 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 113.645 0.98 . . . . 4.3700000000000001 113.645 -175.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.34 -31.29 72.4 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.775 0.83 . . . . 1.01 112.418 170.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 22.3 mt -75.15 -34.62 61.64 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.818 0.735 . . . . 1.8200000000000001 111.255 173.29 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.4 m -59.52 -46.67 88.18 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.326 0.65 . . . . 1.4099999999999999 110.959 166.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 30.1 m -60.56 -42.0 95.72 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.921 1.289 . . . . 1.6599999999999999 111.463 174.184 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 41.6 ttm -57.66 -49.98 74.67 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.372 0.669 . . . . 2.8999999999999999 111.331 172.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 10.5 t -59.52 -35.9 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 124.675 1.19 . . . . 1.7 112.389 174.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 89.0 m -65.68 -47.75 74.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.72 1.608 . . . . 0.80000000000000004 111.819 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.55 -50.21 73.85 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.769 0.713 . . . . 1.79 109.579 167.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -62.19 -46.01 90.83 Favored 'General case' 0 N--CA 1.463 0.218 0 O-C-N 124.192 0.933 . . . . 2.4100000000000001 111.489 -164.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -74.23 -34.77 63.76 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.131 0.789 . . . . 2.5600000000000001 113.131 176.612 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 16.6 ttmm -69.8 -23.96 63.41 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.021 -1.049 . . . . 4.5300000000000002 113.218 177.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 49.4 m-85 -77.73 -39.61 43.88 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.59 1.156 . . . . 2.0499999999999998 112.235 160.184 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 17.5 t -59.78 -19.23 49.23 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 116.032 1.864 . . . . 1.8300000000000001 116.032 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.85 -13.3 83.56 Favored Glycine 0 CA--C 1.54 1.649 0 CA-C-O 118.759 -1.023 . . . . 1.53 114.803 170.307 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -86.67 73.81 9.96 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.067 1.934 . . . . 5.4000000000000004 110.83 176.432 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 88.72 -178.16 0.02 OUTLIER 'General case' 0 C--O 1.247 0.946 0 C-N-CA 127.378 2.271 . . . . 3.0099999999999998 111.624 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.51 -150.54 21.08 Favored Glycine 0 C--N 1.339 0.718 0 C-N-CA 124.994 1.283 . . . . 2.1600000000000001 111.538 -177.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 2.3 m -80.3 170.15 16.79 Favored 'General case' 0 C--O 1.251 1.155 0 O-C-N 121.967 -0.725 . . . . 3.2999999999999998 111.412 166.541 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 61.5 mttt -63.9 162.48 13.68 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 125.082 1.353 . . . . 7.1699999999999999 109.5 144.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 9.3 tp 66.61 -24.77 0.11 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.702 2.001 . . . . 3.46 114.486 -174.098 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 57.7 p -110.01 152.85 25.4 Favored 'General case' 0 C--O 1.245 0.845 0 C-N-CA 124.445 1.098 . . . . 1.28 113.673 178.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 51.9 mt -107.48 99.22 8.75 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.868 -1.06 . . . . 1.71 110.717 163.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 35.0 t -55.67 160.16 2.66 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.578 1.151 . . . . 1.8200000000000001 113.381 161.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -45.59 -24.77 0.37 Allowed 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 117.302 2.334 . . . . 3.8100000000000001 117.302 -175.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.29 -50.53 5.77 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-N 120.392 1.451 . . . . 4.0199999999999996 114.096 174.724 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -54.64 -37.18 65.35 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.314 0.646 . . . . 2.04 110.68 179.062 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 49.9 tp -76.05 -47.19 25.65 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.322 0.86 . . . . 2.3399999999999999 113.322 172.249 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 17.4 ttmt -52.54 -47.55 66.66 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 120.693 1.588 . . . . 2.9900000000000002 110.986 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.6 tp10 -67.5 -36.0 80.24 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 116.871 -1.538 . . . . 3.7200000000000002 114.253 -178.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 tt -57.82 -54.81 42.69 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 125.672 1.589 . . . . 2.0899999999999999 111.86 173.236 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 mt -56.67 -39.92 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 N-CA-C 108.849 -0.797 . . . . 1.2 108.849 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 52.8 tttt -70.97 3.13 3.57 Favored 'General case' 0 CA--C 1.559 1.316 0 N-CA-C 114.7 1.37 . . . . 4.21 114.7 177.664 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 17.5 mmtm -112.24 -57.98 2.2 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 126.097 1.759 . . . . 3.9399999999999999 110.487 166.269 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 41' ' ' GLU . . . . . 0.663 ' HA ' HG21 ' A' ' 3' ' ' THR . 3.8 mp0 -53.5 -49.96 66.4 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.211 1.805 . . . . 4.5099999999999998 111.894 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -84.22 53.48 2.64 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 120.255 -1.528 . . . . 2.2400000000000002 111.182 176.313 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 13.1 t -58.81 -13.34 5.91 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.837 1.255 . . . . 3.2200000000000002 113.531 171.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.415 ' CD2' ' H ' ' B' ' 44' ' ' LEU . 2.8 mm? -48.12 -36.78 13.94 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 127.747 2.419 . . . . 2.9100000000000001 112.57 164.552 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.77 9.27 81.38 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.127 0.87 . . . . 2.9399999999999999 115.058 166.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -63.59 -49.12 74.63 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.218 1.009 . . . . 7.3899999999999997 110.696 170.684 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.92 110.64 1.61 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.74 0.816 . . . . 2.3399999999999999 112.097 172.224 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -128.57 146.7 50.77 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.444 1.498 . . . . 3.5099999999999998 109.616 172.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -6.0 -87.96 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 128.243 2.617 . . . . 3.8900000000000001 116.762 -158.334 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.9 m -57.59 -23.05 48.74 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.297 1.592 . . . . 3.0600000000000001 115.297 -173.364 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 29.2 t -66.94 -18.62 65.47 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.121 -0.987 . . . . 1.8500000000000001 113.133 173.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 13.8 mm -72.78 -37.3 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 123.923 0.889 . . . . 1.3700000000000001 110.534 171.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -80.13 -37.87 32.65 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.215 1.006 . . . . 3.9399999999999999 111.859 -170.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -67.16 -35.45 79.72 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.492 0.553 . . . . 2.2999999999999998 112.492 167.183 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 9.6 tt -63.64 -44.78 92.85 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 118.01 -0.995 . . . . 2.4700000000000002 111.035 171.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 26.9 mtp -56.94 -45.59 82.67 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 120.127 1.33 . . . . 2.8900000000000001 110.936 175.225 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.3 tttm -52.06 -38.02 55.69 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.425 1.09 . . . . 3.8500000000000001 113.001 168.292 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.8 t -67.36 -33.61 75.58 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 120.818 -1.176 . . . . 2.0299999999999998 112.731 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 20.6 mt -83.03 -45.52 13.94 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 120.943 -1.098 . . . . 1.8799999999999999 113.486 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -79.39 87.8 5.02 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.51 1.924 . . . . 1.8100000000000001 111.33 -156.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.88 -30.33 70.08 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 115.05 1.5 . . . . 3.1699999999999999 115.05 178.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . 0.286 0.0 OUTLIER -78.41 -22.86 47.13 Favored 'General case' 0 CA--C 1.558 1.274 0 CA-C-N 119.273 0.942 . . . . 2.6699999999999999 111.959 167.183 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 8.1 m 53.21 62.71 2.53 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 126.82 2.048 . . . . 3.4100000000000001 113.146 175.485 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -141.05 -60.53 0.49 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 118.512 -0.756 . . . . 2.6200000000000001 112.171 -140.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 161.73 -35.81 0.0 OUTLIER 'General case' 0 C--N 1.345 0.374 0 C-N-CA 131.511 3.924 . . . . 6.3300000000000001 115.004 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -106.87 135.85 47.7 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 126.358 1.863 . . . . 2.29 108.888 -178.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 67' ' ' ILE . . . . . 0.43 ' HA ' ' OE1' ' B' ' 71' ' ' GLU 0.257 14.6 mt -99.7 109.85 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.599 0.76 . . . . 1.27 111.47 169.98 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 68' ' ' ASP . . . . . 0.433 ' HB2' ' H ' ' B' ' 71' ' ' GLU . 41.1 m-20 -54.23 153.44 5.25 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.491 1.916 . . . . 3.6099999999999999 111.049 166.198 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.33 -35.13 62.37 Favored 'General case' 0 CA--C 1.552 1.03 0 O-C-N 120.533 -1.354 . . . . 2.1800000000000002 110.942 165.282 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.471 ' HE3' ' HA ' ' B' ' 70' ' ' LYS . 0.1 OUTLIER -70.19 -35.81 74.19 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 120.548 -1.345 . . . . 7.0199999999999996 113.122 176.965 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 71' ' ' GLU . . . . . 0.433 ' H ' ' HB2' ' B' ' 68' ' ' ASP . 57.1 mt-10 -65.03 -51.23 62.71 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 119.143 0.883 . . . . 1.71 108.734 168.515 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -56.8 -32.78 66.02 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 120.396 -1.44 . . . . 1.8999999999999999 113.898 -177.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 63.9 p -57.45 -21.95 40.31 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 119.748 -1.845 . . . . 1.99 114.466 171.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 59.6 t -64.94 -36.88 78.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 119.71 1.141 . . . . 1.6000000000000001 111.547 171.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -61.83 -47.26 85.87 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.809 0.843 . . . . 1.5800000000000001 109.86 173.077 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 47.1 mt -58.54 -50.53 73.46 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 117.406 -1.283 . . . . 1.74 110.698 178.347 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 98.6 m -58.66 -46.92 86.13 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.983 1.265 . . . . 1.0700000000000001 111.333 176.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 59.1 ttp -58.01 -47.74 82.14 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.547 0.739 . . . . 2.6400000000000001 112.321 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 94.4 mt -69.84 -46.75 64.92 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.869 0.692 . . . . 1.4299999999999999 112.869 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.76 -33.79 76.45 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.503 1.047 . . . . 1.53 111.646 -178.885 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 61.5 mtp -75.11 -30.39 60.84 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 118.054 -0.974 . . . . 2.21 113.1 172.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.0 -39.46 94.16 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 120.7 1.591 . . . . 1.1100000000000001 111.863 171.163 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -67.98 -13.08 61.9 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.491 1.293 . . . . 2.3100000000000001 114.491 173.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -69.43 -45.53 68.92 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.268 0.94 . . . . 2.98 111.912 170.561 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.0 -44.13 93.57 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.108 1.763 . . . . 3.71 111.643 174.349 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -54.26 -45.27 72.35 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.646 1.578 . . . . 2.1000000000000001 112.242 175.275 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -66.23 -27.33 67.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.756 1.223 . . . . 3.2999999999999998 112.804 176.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 49.0 mt -74.32 -21.62 59.63 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 120.893 -1.129 . . . . 2.1200000000000001 112.235 175.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -88.8 3.21 51.85 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.488 1.515 . . . . 3.4100000000000001 114.411 168.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -92.89 -46.2 7.62 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.74 1.216 . . . . 4.5099999999999998 111.027 162.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.35 20.73 0.52 Allowed 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 125.29 1.436 . . . . 4.3099999999999996 114.234 -178.822 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.256 1.444 0 C-N-CA 128.06 2.544 . . . . 4.7599999999999998 117.736 -166.579 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 . . . . . 0 CA--C 1.542 0.646 0 CA-C-O 123.463 1.601 . . . . 4.0499999999999998 109.26 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.498 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 6.2 p -99.12 175.54 2.4 Favored Pre-proline 0 C--N 1.316 -0.864 1 C-N-CA 132.644 4.378 . . . . 2.1200000000000001 111.011 -151.71 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.498 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 74.4 Cg_endo -77.07 -29.91 4.78 Favored 'Trans proline' 0 C--N 1.351 0.668 0 CA-C-N 121.076 1.42 . . . . 1.5800000000000001 112.886 -168.342 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 18.0 tp -85.71 -39.2 17.46 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 117.007 -1.473 . . . . 2.6000000000000001 112.519 -174.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -58.28 -37.93 75.98 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 120.487 1.494 . . . . 4.6799999999999997 109.915 172.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 ttmp? -65.41 -39.1 91.76 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.532 1.133 . . . . 3.5600000000000001 112.663 171.211 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.71 -40.66 69.32 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.043 0.937 . . . . 0.91000000000000003 113.106 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.3 mt -62.34 -42.78 99.67 Favored 'General case' 0 C--O 1.238 0.486 0 O-C-N 121.286 -0.884 . . . . 1.73 109.969 170.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 92.5 m -56.05 -44.35 78.77 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 117.042 -1.456 . . . . 1.5 110.748 170.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.0 m -56.54 -52.13 65.96 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 121.481 1.946 . . . . 1.48 112.329 178.16 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.08 -29.08 69.93 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 113.994 1.109 . . . . 3.0299999999999998 113.994 178.831 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 80.2 t -76.19 -32.22 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 123.954 0.901 . . . . 2.6299999999999999 112.741 171.292 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 56.8 m -61.34 -55.37 32.44 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.423 1.489 . . . . 0.85999999999999999 110.176 175.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.33 -25.26 64.12 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.862 1.265 . . . . 2.6200000000000001 111.504 -177.917 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -59.77 -37.65 79.64 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.256 -0.902 . . . . 1.7 111.675 167.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -76.99 -27.9 54.89 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 120.196 -1.565 . . . . 2.0499999999999998 112.954 175.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -56.44 -59.62 4.71 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.725 1.148 . . . . 5.4000000000000004 110.715 164.081 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -86.51 -45.71 10.85 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 114.298 1.222 . . . . 2.1400000000000001 114.298 -167.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.3 m -67.02 -31.03 71.3 Favored 'General case' 0 C--O 1.249 1.056 0 CA-C-N 120.605 1.548 . . . . 3.27 111.362 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.39 2.07 88.21 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 126.873 2.178 . . . . 1.6799999999999999 114.582 173.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.4 ttt85 -74.69 -46.08 40.18 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.749 1.775 . . . . 5.0199999999999996 111.264 175.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -133.0 147.98 52.27 Favored 'General case' 0 C--O 1.252 1.224 0 CA-C-O 122.663 1.22 . . . . 5.5199999999999996 112.845 -174.432 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.49 -122.96 14.07 Favored Glycine 0 C--N 1.343 0.936 0 C-N-CA 128.308 2.861 . . . . 2.3799999999999999 112.395 168.161 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.7 m -44.27 109.18 0.14 Allowed 'General case' 0 C--O 1.246 0.877 0 C-N-CA 125.065 1.346 . . . . 4.0700000000000003 110.995 161.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 40.4 tptt -72.71 -27.57 62.15 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.606 1.562 . . . . 5.9299999999999997 112.949 -172.458 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.445 ' H ' HD23 ' A' ' 27' ' ' LEU . 1.9 pt? -90.29 -17.3 27.65 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.503 1.521 . . . . 4.9299999999999997 114.253 178.734 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.8 p -106.26 152.6 23.31 Favored 'General case' 0 C--O 1.254 1.326 0 C-N-CA 123.921 0.888 . . . . 2.0800000000000001 111.293 178.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 12.2 mt -82.98 107.28 15.47 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 113.306 -1.77 . . . . 1.8600000000000001 106.912 148.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.2 t -66.56 162.69 20.34 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.552 -0.717 . . . . 2.0800000000000001 109.969 162.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -46.74 -36.62 7.42 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.89 1.223 . . . . 3.3900000000000001 113.226 -177.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -79.74 -30.79 40.95 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 120.728 -1.233 . . . . 5.79 113.858 177.153 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -69.36 -33.95 73.84 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.867 1.212 . . . . 1.5700000000000001 110.887 170.194 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -64.75 -53.47 46.64 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.606 1.162 . . . . 3.1699999999999999 109.597 174.592 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.1 mttm -50.87 -47.15 60.52 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.406 -0.809 . . . . 4.1699999999999999 112.49 170.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -53.91 -66.72 0.34 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.575 1.55 . . . . 3.2599999999999998 112.257 173.244 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.4 tp -49.09 -51.38 31.97 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.571 1.948 . . . . 2.0699999999999998 111.466 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 84.2 mt -61.21 -57.83 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 N-CA-C 109.321 -0.622 . . . . 1.21 109.321 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -60.53 -30.99 70.1 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 121.491 -0.755 . . . . 4.0499999999999998 112.399 -174.33 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.2 mmtm -76.11 -57.95 3.57 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.25 1.82 . . . . 3.6299999999999999 112.761 176.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -108.66 6.6 25.95 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 113.519 0.933 . . . . 6.25 113.519 -163.628 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.8 mt -142.91 50.21 1.44 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 127.557 2.343 . . . . 3.6099999999999999 108.171 168.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 24.7 t -73.19 51.34 0.31 Allowed 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 127.394 2.278 . . . . 3.75 115.9 -166.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -86.74 151.62 23.23 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.579 -1.325 . . . . 4.1100000000000003 111.67 178.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.11 -23.51 73.03 Favored Glycine 0 N--CA 1.48 1.625 0 N-CA-C 116.219 1.248 . . . . 3.21 116.219 -167.307 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -98.26 0.69 46.16 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.558 1.143 . . . . 6.3300000000000001 112.37 174.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.9 tpt -82.65 78.38 9.28 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.679 1.591 . . . . 2.0699999999999998 107.808 171.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.8 ttpt -143.87 167.9 21.21 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.849 1.66 . . . . 4.0700000000000003 110.577 -151.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -60.67 -42.37 96.92 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 119.44 -2.037 . . . . 3.6699999999999999 114.504 -161.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.9 m -72.37 -3.78 26.07 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.268 1.581 . . . . 3.1600000000000001 115.268 176.014 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.8 p -109.3 -34.81 6.45 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.688 1.131 . . . . 2.0600000000000001 112.106 166.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.1 mt -76.29 -38.98 34.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.409 1.484 . . . . 1.55 113.498 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -71.02 -34.46 71.34 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 120.114 1.324 . . . . 2.5899999999999999 112.898 -173.018 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -87.42 -26.34 23.34 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.815 1.646 . . . . 4.7800000000000002 113.068 175.413 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 62.3 tp -59.24 -44.57 92.35 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 118.312 -0.852 . . . . 2.2000000000000002 109.846 158.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -48.18 81.35 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 119.795 1.18 . . . . 1.8 110.06 179.229 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.2 mttp -58.11 -33.26 68.92 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.123 0.969 . . . . 5.6799999999999997 113.172 172.392 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.8 t -79.17 -27.02 42.65 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 114.368 1.247 . . . . 1.8300000000000001 114.368 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.5 mt -81.56 -25.87 35.49 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.734 2.014 . . . . 2.1299999999999999 111.373 174.636 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.517 ' C ' ' HE2' ' A' ' 61' ' ' LYS . 36.8 t0 -69.12 120.65 15.3 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.478 1.111 . . . . 1.8600000000000001 109.748 166.043 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.534 ' HE3' HG11 ' A' ' 74' ' ' VAL . 0.8 OUTLIER -84.38 6.3 23.74 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 119.909 -1.745 . . . . 3.23 114.29 -172.635 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -153.03 -86.06 0.07 Allowed 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 124.83 1.252 . . . . 3.3399999999999999 110.516 -170.588 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.0 m 156.82 92.73 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 130.191 3.396 . . . . 2.3700000000000001 108.004 -174.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.3 p30 -152.23 -6.45 0.22 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.976 1.31 . . . . 2.21 113.399 -177.527 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 63.91 1.71 1.2 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 128.238 2.615 . . . . 4.3799999999999999 114.288 -170.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -106.19 138.3 42.62 Favored 'General case' 0 C--O 1.246 0.872 0 C-N-CA 127.319 2.248 . . . . 3.3599999999999999 110.435 178.413 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 41.2 mm -103.85 98.37 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 113.709 -1.587 . . . . 1.1899999999999999 107.894 159.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.99 157.33 25.36 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.612 1.165 . . . . 2.73 111.64 163.583 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -55.95 -25.26 42.73 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 115.159 1.54 . . . . 2.6000000000000001 115.159 -178.249 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 mtmp? -87.35 -35.17 18.53 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 117.267 -1.349 . . . . 3.4300000000000002 111.893 170.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.421 ' O ' HG12 ' A' ' 74' ' ' VAL . 40.1 mt-10 -54.2 -49.84 68.44 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 120.382 1.446 . . . . 1.98 108.979 166.593 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -49.93 -32.3 14.48 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 128.09 2.556 . . . . 2.7000000000000002 114.953 -178.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 72.5 p -57.93 -27.4 63.34 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.041 -1.037 . . . . 2.5 112.809 174.387 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.534 HG11 ' HE3' ' A' ' 61' ' ' LYS . 2.0 p -73.99 -30.0 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.217 -0.927 . . . . 2.3500000000000001 112.015 179.334 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -64.98 -49.96 68.24 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.944 -0.762 . . . . 1.9199999999999999 108.944 169.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.0 mt -61.04 -36.6 79.99 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.177 0.591 . . . . 2.0600000000000001 111.695 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.2 m -59.99 -53.16 61.12 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.714 1.206 . . . . 1.05 111.402 174.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.9 mtm -66.94 -37.64 84.69 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 119.121 -0.466 . . . . 1.8899999999999999 112.192 -177.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 92.9 mt -60.53 -47.52 85.82 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 119.095 -0.479 . . . . 1.8899999999999999 111.331 171.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 19.6 m -55.47 -39.79 70.84 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.691 0.796 . . . . 2.0 112.795 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 36.1 mtp -70.12 -33.54 71.95 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 119.003 -0.523 . . . . 1.8899999999999999 112.235 176.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.53 -46.76 68.69 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 119.211 0.914 . . . . 0.95999999999999996 113.176 -178.595 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -68.34 -24.25 64.79 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.333 -0.854 . . . . 2.9300000000000002 112.613 175.379 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -71.8 -33.37 68.5 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 114.036 1.124 . . . . 1.78 114.036 174.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.0 -32.27 51.08 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.131 0.572 . . . . 3.1000000000000001 111.324 179.503 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -54.73 29.33 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.804 0.842 . . . . 2.3399999999999999 110.782 161.742 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -59.22 -14.96 12.58 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.277 1.431 . . . . 2.3199999999999998 113.89 177.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 41.0 mt -90.42 -12.54 37.15 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 117.273 -1.346 . . . . 2.04 114.624 172.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -102.41 -38.28 7.66 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.738 1.215 . . . . 2.8399999999999999 113.931 167.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 . . . . . 0 N--CA 1.474 0.76 0 C-N-CA 126.274 1.829 . . . . 4.1200000000000001 113.287 -177.222 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 119.211 -0.423 . . . . 2.6200000000000001 111.792 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -63.54 -26.62 69.73 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 121.643 1.562 . . . . 2.27 112.94 178.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.91 -37.71 39.23 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.174 0.897 . . . . 2.8799999999999999 111.08 174.618 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -58.76 -42.04 87.98 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.314 0.961 . . . . 3.9300000000000002 111.369 170.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -62.56 -36.69 83.44 Favored 'General case' 0 N--CA 1.463 0.188 0 O-C-N 121.433 -0.792 . . . . 3.9900000000000002 111.714 176.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.29 -47.12 71.56 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 118.937 0.789 . . . . 1.2 112.554 172.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -55.84 -50.0 71.75 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.769 1.628 . . . . 2.7400000000000002 113.346 173.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 22.0 p -66.95 -35.91 81.04 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 117.461 -1.257 . . . . 2.1600000000000001 110.821 178.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 95.9 m -59.59 -43.41 93.68 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 119.688 1.131 . . . . 1.5600000000000001 110.641 170.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -60.58 -55.08 37.63 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.073 0.549 . . . . 3.8199999999999998 111.248 175.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 51.7 t -58.33 -31.79 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 CA-C-N 118.698 0.681 . . . . 1.95 111.879 178.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 92.5 m -65.73 -57.6 7.64 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 117.614 -1.184 . . . . 1.05 110.876 175.474 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.7 p -57.04 -37.55 71.93 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 119.744 1.157 . . . . 1.9099999999999999 111.611 175.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -66.8 -57.9 6.13 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 123.661 0.601 . . . . 1.98 109.969 -176.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.23 -33.62 67.69 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.65 -0.656 . . . . 2.1800000000000002 112.67 -175.213 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -64.55 -34.38 78.11 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.585 1.084 . . . . 5.3600000000000003 112.198 174.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -85.85 -30.11 23.2 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.077 0.853 . . . . 2.1299999999999999 111.833 176.138 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 35.3 t -69.45 -25.6 64.18 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 114.206 1.187 . . . . 1.6599999999999999 114.206 174.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.66 12.19 67.87 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.853 1.692 . . . . 2.0600000000000001 114.702 172.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -75.66 -36.73 60.05 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 118.757 1.278 . . . . 4.9699999999999998 111.935 172.159 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -157.34 156.87 33.07 Favored 'General case' 0 C--O 1.248 0.985 0 CA-C-O 121.637 0.732 . . . . 2.9900000000000002 111.519 -163.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.94 -128.13 46.46 Favored Glycine 0 C--N 1.338 0.689 0 N-CA-C 109.185 -1.566 . . . . 2.4300000000000002 109.185 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 38.7 m -79.02 153.51 30.21 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-O 122.345 1.069 . . . . 3.3500000000000001 111.975 164.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -57.3 174.18 0.21 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 115.174 -0.921 . . . . 7.46 110.669 142.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 23.6 mt 73.34 -56.99 0.64 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.603 1.561 . . . . 3.2400000000000002 109.405 -169.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 40.6 p -103.38 146.65 28.16 Favored 'General case' 0 C--O 1.255 1.367 0 N-CA-C 115.863 1.801 . . . . 1.1899999999999999 115.863 -170.774 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 64.9 mt -102.44 103.46 13.85 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 128.484 2.714 . . . . 1.8500000000000001 111.601 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.5 p -65.77 170.76 4.92 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 115.111 1.522 . . . . 2.7799999999999998 115.111 178.301 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 31' ' ' ARG . . . . . 0.417 ' HD2' ' SD ' ' B' ' 56' ' ' MET . 10.7 tpt180 -47.6 -11.41 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 128.147 2.579 . . . . 5.0800000000000001 115.659 167.46 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.43 -47.91 3.14 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.812 1.245 . . . . 4.3099999999999996 112.275 168.758 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -52.91 -38.45 61.83 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.743 0.817 . . . . 2.29 111.428 179.33 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.498 HD23 ' HG2' ' B' ' 56' ' ' MET . 7.6 tp -71.9 -45.66 60.44 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.605 0.762 . . . . 2.21 112.539 178.626 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -71.58 -37.19 71.04 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 120.609 -1.307 . . . . 5.21 111.145 -176.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -54.24 -52.15 62.27 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.157 1.383 . . . . 2.8799999999999999 111.982 164.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 42.9 tp -58.24 -53.17 61.32 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.988 1.267 . . . . 1.99 112.376 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 27.4 mt -54.64 -55.07 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 N-CA-C 109.131 -0.692 . . . . 1.22 109.131 176.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -68.2 -11.84 59.94 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.08 1.141 . . . . 4.2000000000000002 114.08 -173.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 12.8 mmtp -92.59 -29.64 16.05 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 125.057 1.343 . . . . 3.8900000000000001 114.034 178.067 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -100.28 -49.93 4.1 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.635 0.774 . . . . 5.7400000000000002 111.733 177.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -81.1 56.19 2.74 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.857 1.263 . . . . 2.3900000000000001 110.383 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 72.3 m -79.24 -7.31 58.17 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.382 1.473 . . . . 3.79 113.432 176.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.4 HD23 ' H ' ' B' ' 44' ' ' LEU . 1.8 pt? -83.94 137.56 33.58 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.847 1.259 . . . . 2.7200000000000002 112.015 -176.69 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.1 -108.14 2.44 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.414 -0.674 . . . . 3.8799999999999999 111.414 178.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -169.08 118.46 0.68 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.08 1.752 . . . . 5.7699999999999996 106.947 -174.04 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.66 -13.61 60.04 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 122.231 1.015 . . . . 3.8199999999999998 112.871 -173.026 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.4 mtpp 71.93 45.8 0.39 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 128.123 2.569 . . . . 5.1900000000000004 110.215 170.595 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . 0.268 7.3 pt-20 -63.4 2.96 0.34 Allowed 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 119.893 3.294 . . . . 4.1900000000000004 119.893 -138.537 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 29.4 t -53.47 -29.92 38.25 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 119.129 -2.232 . . . . 2.7999999999999998 111.488 149.132 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 8.6 t -68.63 -15.38 63.51 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.041 1.336 . . . . 2.6200000000000001 114.003 171.503 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 5.9 mm -68.96 -21.68 25.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 CA-C-N 120.512 1.506 . . . . 2.1600000000000001 111.461 173.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -77.36 -44.79 28.15 Favored 'General case' 0 C--O 1.224 -0.247 0 N-CA-C 113.754 1.02 . . . . 3.4399999999999999 113.754 164.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.35 -30.86 66.68 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.422 1.465 . . . . 2.54 114.086 -178.085 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -51.81 -39.45 58.75 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 117.997 -1.001 . . . . 2.5299999999999998 110.399 162.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 56' ' ' MET . . . . . 0.498 ' HG2' HD23 ' B' ' 34' ' ' LEU . 23.1 mtp -63.32 -55.74 22.17 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-O 116.912 -1.518 . . . . 2.6099999999999999 112.383 173.259 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -61.13 -32.78 72.47 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 122.238 2.29 . . . . 4.4500000000000002 112.995 -175.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 21.2 m -72.49 -42.68 64.61 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.142 1.377 . . . . 2.1099999999999999 112.183 177.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 8.8 mp -74.41 -31.89 62.48 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 117.992 -1.004 . . . . 2.7200000000000002 112.858 173.117 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -108.4 56.06 0.63 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 128.568 2.747 . . . . 1.99 110.863 178.527 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 61' ' ' LYS . . . . . 0.583 ' H ' ' HE2' ' B' ' 61' ' ' LYS . 0.0 OUTLIER -58.17 -19.7 35.19 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 115.453 1.649 . . . . 3.2799999999999998 115.453 -173.536 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -89.34 -6.61 56.54 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.121 1.526 . . . . 1.77 115.121 173.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 57.8 m 63.06 22.96 13.72 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.903 1.681 . . . . 2.0800000000000001 114.635 174.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 37.0 p30 -89.8 -2.33 58.2 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.505 1.122 . . . . 2.8999999999999999 111.913 177.058 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 74.71 -31.41 0.21 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 129.935 3.294 . . . . 4.1900000000000004 114.559 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -73.41 135.55 44.21 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 122.629 1.204 . . . . 2.5600000000000001 110.188 176.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 77.9 mt -124.42 106.23 16.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 124.8 1.24 . . . . 1.5 108.551 -176.402 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -90.23 160.96 15.92 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 127.043 2.137 . . . . 3.71 109.919 165.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -39.18 -42.56 0.98 Allowed 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.985 1.714 . . . . 2.4399999999999999 113.892 170.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -80.16 -10.56 59.77 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.182 0.993 . . . . 4.0099999999999998 113.471 -171.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -91.08 -47.3 7.63 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.3 1.04 . . . . 1.8999999999999999 109.509 161.013 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -63.57 -28.06 69.67 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 129.083 2.953 . . . . 2.71 115.546 -171.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 13.4 p -54.48 -24.04 18.73 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.674 -1.266 . . . . 2.2000000000000002 113.033 175.124 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 p -58.1 -34.82 50.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 N-CA-C 113.009 0.744 . . . . 2.7000000000000002 113.009 171.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -66.3 -51.27 58.98 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.015 1.326 . . . . 1.6499999999999999 109.972 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 28.9 mt -61.16 -43.2 99.25 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.764 0.825 . . . . 1.48 110.123 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 24.1 m -57.49 -51.45 69.4 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.41 1.084 . . . . 1.1499999999999999 111.469 176.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 3.8 mmm -56.97 -44.7 82.88 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.568 0.747 . . . . 2.54 112.638 178.169 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 96.8 mt -68.23 -43.31 78.22 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.604 0.762 . . . . 1.45 111.668 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 80.0 m -61.64 -33.0 73.18 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.274 -0.891 . . . . 1.6000000000000001 112.554 175.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 41.1 mtp -69.14 -37.91 78.53 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.163 0.892 . . . . 2.8500000000000001 112.925 171.048 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.54 -46.34 88.84 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.207 0.912 . . . . 1.24 112.121 174.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -64.62 -27.72 69.13 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.094 1.146 . . . . 2.4500000000000002 114.094 174.527 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -70.67 -39.6 73.47 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.281 0.946 . . . . 2.4100000000000001 111.338 174.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -68.29 -40.41 81.77 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.906 0.882 . . . . 4.1799999999999997 111.475 177.113 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -52.68 -50.87 62.43 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.566 1.546 . . . . 2.9100000000000001 111.481 172.624 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -59.23 -25.72 64.26 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.256 1.422 . . . . 2.4500000000000002 113.144 -178.766 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 60.1 mt -77.37 -22.25 52.02 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 117.842 -1.075 . . . . 2.29 112.787 177.178 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -99.53 0.8 43.1 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.043 1.337 . . . . 4.1500000000000004 113.567 169.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -84.2 -36.28 22.9 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.815 1.246 . . . . 3.71 111.78 164.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -100.49 28.3 5.15 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.46 1.504 . . . . 3.2200000000000002 113.409 -170.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 3.7 ptmm? . . . . . 0 C--O 1.246 0.901 0 N-CA-C 118.011 2.597 . . . . 5.3700000000000001 118.011 -156.338 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.445 -0.724 0 N-CA-C 106.594 -1.632 . . . . 5.0800000000000001 106.594 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 75.6 p -53.17 162.78 1.02 Allowed Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 124.289 1.036 . . . . 1.6000000000000001 111.225 164.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.75 -19.49 36.1 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 121.952 1.768 . . . . 1.5 111.965 168.02 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -79.06 -41.41 28.84 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.977 0.911 . . . . 4.1699999999999999 112.24 178.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -58.06 -46.21 85.8 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.347 1.059 . . . . 4.0300000000000002 110.094 176.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -60.53 -31.86 70.92 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 114.078 1.14 . . . . 3.6800000000000002 114.078 172.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.14 -34.04 75.6 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.274 0.943 . . . . 1.0 111.655 -175.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 71.4 mt -57.86 -51.81 68.06 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.055 0.942 . . . . 1.9199999999999999 110.476 170.636 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 m -58.77 -43.84 90.5 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.026 1.331 . . . . 1.74 112.004 175.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 51.2 m -60.83 -38.78 86.63 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.668 1.587 . . . . 1.5900000000000001 110.853 178.156 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.86 -52.8 47.29 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.171 0.988 . . . . 3.8900000000000001 111.453 172.353 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t -54.73 -28.8 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 O-C-N 120.555 -1.341 . . . . 1.9199999999999999 112.503 174.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 94.4 m -68.56 -46.55 69.15 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.033 1.333 . . . . 1.3500000000000001 113.372 -177.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.0 p -69.41 -42.96 74.36 Favored 'General case' 0 CA--C 1.504 -0.817 0 CA-C-N 119.724 1.147 . . . . 2.27 108.85 172.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -60.92 -57.22 13.57 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 124.622 1.201 . . . . 2.1000000000000001 110.729 -171.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -64.76 -40.84 95.95 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 122.244 -0.285 . . . . 2.5600000000000001 110.554 -175.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -67.24 -41.74 85.16 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.359 -0.838 . . . . 3.8199999999999998 112.776 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -68.8 -37.04 78.99 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.421 1.01 . . . . 2.1000000000000001 112.297 173.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.5 m -62.71 -27.31 69.17 Favored 'General case' 0 C--O 1.25 1.114 0 N-CA-C 114.934 1.457 . . . . 2.73 114.934 172.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.29 -4.63 80.73 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 126.703 2.097 . . . . 1.3500000000000001 114.071 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -54.67 -37.37 65.66 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.395 1.598 . . . . 4.0 112.608 178.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 173.12 -155.57 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 128.858 2.863 . . . . 7.04 109.539 176.373 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 72.92 -142.09 31.39 Favored Glycine 0 C--N 1.336 0.582 0 C-N-CA 127.131 2.3 . . . . 2.1200000000000001 110.181 176.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.9 t -64.43 142.3 58.47 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 122.882 1.325 . . . . 2.5 110.153 149.475 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -97.49 137.64 36.13 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.885 1.674 . . . . 9.2100000000000009 107.609 174.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.6 mt 92.47 -31.16 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 129.219 3.008 . . . . 4.2000000000000002 111.416 -161.464 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.418 HG22 ' HA ' ' A' ' 68' ' ' ASP . 81.5 p -116.7 161.97 18.4 Favored 'General case' 0 C--O 1.251 1.142 0 N-CA-C 114.638 1.347 . . . . 1.55 114.638 179.071 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -120.45 102.81 8.7 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.647 1.179 . . . . 2.4199999999999999 112.162 -179.336 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.4 p -77.75 173.64 11.86 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 120.776 -1.202 . . . . 2.02 112.381 165.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -39.51 -42.86 1.19 Allowed 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 116.857 2.169 . . . . 3.4399999999999999 116.857 -163.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.57 -26.99 45.67 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 119.632 -1.917 . . . . 5.2999999999999998 114.057 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -72.95 -51.19 19.4 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 107.339 -1.356 . . . . 2.1699999999999999 107.339 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.21 -32.45 74.13 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.737 0.643 . . . . 1.96 112.737 175.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -67.13 -38.81 86.22 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 120.11 -1.619 . . . . 4.6200000000000001 112.784 173.497 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -64.66 -29.29 70.29 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-O 117.794 -1.098 . . . . 4.4800000000000004 113.634 171.558 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.1 tt -73.27 -66.79 0.64 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.203 1.401 . . . . 2.0800000000000001 112.358 177.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.9 mt -56.26 -43.94 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 124.647 1.179 . . . . 0.82999999999999996 110.525 -168.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.3 tttp -70.97 -3.85 21.64 Favored 'General case' 0 N--CA 1.439 -1.012 0 N-CA-C 113.994 1.109 . . . . 4.0899999999999999 113.994 -176.045 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -108.76 -21.63 12.59 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.196 1.798 . . . . 3.73 113.387 168.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -76.84 -62.08 1.76 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.855 2.062 . . . . 4.6200000000000001 110.047 178.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 60.3 mt -92.57 101.05 13.47 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.514 -1.366 . . . . 2.4300000000000002 113.241 -163.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 77.8 m -88.03 48.81 1.69 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.626 2.371 . . . . 4.2699999999999996 112.315 -169.399 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 38.8 mt -129.27 -1.21 5.09 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.55 1.94 . . . . 3.7799999999999998 113.791 -163.089 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 140.81 33.69 0.13 Allowed Glycine 0 N--CA 1.472 1.07 0 C-N-CA 125.763 1.649 . . . . 2.79 112.752 -170.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 26.78 65.08 0.08 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 130.209 3.404 . . . . 8.3300000000000001 113.355 172.037 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 52.1 mmm -20.82 117.27 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.797 2.439 . . . . 2.71 117.122 -158.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.3 tmtt? -48.41 122.84 5.79 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.604 1.962 . . . . 7.4000000000000004 110.297 178.551 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.31 -39.66 87.8 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.019 1.489 . . . . 5.0099999999999998 115.019 -157.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.2 t -76.35 -21.41 56.15 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.525 1.057 . . . . 3.4900000000000002 113.507 174.044 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.0 m -73.66 -9.64 58.88 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.774 -1.204 . . . . 2.71 112.527 173.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 20.1 mm -67.59 -25.96 34.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 123.608 0.763 . . . . 1.79 112.076 165.543 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -78.04 -46.45 20.88 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 114.223 1.194 . . . . 2.7000000000000002 114.223 -163.806 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.28 -33.22 73.96 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.005 0.821 . . . . 3.25 110.762 166.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 67.9 tp -61.48 -39.36 90.65 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 117.982 -1.009 . . . . 1.8700000000000001 113.33 177.701 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 18.0 ptm -74.94 -34.5 62.09 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 120.2 1.364 . . . . 1.8100000000000001 112.973 169.612 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -73.83 -23.35 59.63 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 120.781 -1.199 . . . . 6.5999999999999996 112.735 -178.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.1 t -58.43 -36.89 74.31 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.958 1.703 . . . . 2.5099999999999998 111.348 163.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.6 mt -74.17 -33.69 63.55 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.128 0.971 . . . . 2.3199999999999998 111.306 178.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -80.8 94.02 6.35 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.107 1.763 . . . . 2.52 114.131 -175.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.46 ' HZ1' HG21 ' A' ' 74' ' ' VAL . 12.0 mptt -63.02 -34.1 76.84 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.6 1.16 . . . . 3.5800000000000001 111.594 174.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.87 -34.86 51.45 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.706 1.202 . . . . 2.02 111.491 175.285 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.0 m 55.66 61.68 2.73 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.024 2.13 . . . . 3.79 111.509 -164.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -105.77 -55.35 2.34 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 117.399 -1.286 . . . . 2.7599999999999998 112.036 -167.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 152.29 -32.35 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.73 1 C-N-CA 133.368 4.667 . . . . 5.1600000000000001 116.091 175.549 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -90.87 143.5 26.66 Favored 'General case' 0 C--O 1.244 0.803 0 CA-C-O 123.079 1.419 . . . . 2.5299999999999998 108.314 169.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 35.6 mm -110.45 111.43 36.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 126.302 1.841 . . . . 1.6699999999999999 107.051 173.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.418 ' HA ' HG22 ' A' ' 28' ' ' THR . 0.0 OUTLIER -74.71 175.32 8.04 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.315 1.046 . . . . 2.9100000000000001 112.991 169.983 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -46.92 -48.56 21.3 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.122 1.369 . . . . 2.4100000000000001 113.682 170.233 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -80.67 -31.81 36.2 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.862 1.265 . . . . 5.6799999999999997 112.226 -171.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -55.58 -65.88 0.51 Allowed 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 123.98 0.912 . . . . 1.8 110.217 159.371 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -59.42 -32.6 70.33 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.26 2.224 . . . . 2.5499999999999998 114.619 -172.748 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 69.5 m -62.85 -14.87 51.13 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 119.909 -1.744 . . . . 2.1000000000000001 113.06 -176.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.46 HG21 ' HZ1' ' A' ' 61' ' ' LYS . 46.0 t -70.53 -24.22 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 O-C-N 120.893 -1.129 . . . . 2.04 112.418 171.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -67.16 -50.0 62.76 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.473 1.109 . . . . 1.97 110.356 171.716 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -56.15 -44.54 79.37 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.226 1.01 . . . . 2.27 111.411 172.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.4 m -53.43 -57.41 10.76 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 118.544 -0.741 . . . . 0.68000000000000005 111.578 174.207 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 14.3 ptp -66.58 -29.09 69.08 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 118.924 0.784 . . . . 1.8500000000000001 112.864 -177.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.1 mt -67.21 -50.86 59.25 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-N 119.011 0.823 . . . . 1.4399999999999999 111.44 171.541 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.2 m -62.18 -34.71 76.94 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 119.056 0.843 . . . . 1.8 112.151 177.339 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 35.5 mtp -65.56 -37.79 87.73 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.03 0.832 . . . . 1.75 112.732 172.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.38 -34.71 54.9 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 119.632 1.106 . . . . 1.01 113.152 175.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.468 ' CD2' HD11 ' B' ' 9' ' ' LEU . 0.2 OUTLIER -64.21 -28.42 69.73 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.018 0.826 . . . . 2.8300000000000001 112.993 175.618 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -56.41 -52.08 65.97 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.275 0.63 . . . . 2.1000000000000001 111.004 167.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.47 -32.96 66.65 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.094 1.357 . . . . 3.4700000000000002 112.509 -176.085 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -57.22 -48.94 77.53 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.476 1.51 . . . . 2.9199999999999999 110.889 170.186 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -61.41 -38.67 87.94 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.919 1.288 . . . . 2.8900000000000001 112.716 174.417 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.1 -20.97 64.08 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.484 0.92 . . . . 2.77 113.484 176.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -95.02 -4.49 46.41 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.513 1.301 . . . . 4.3700000000000001 114.513 172.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.9 t70 . . . . . 0 N--CA 1.473 0.724 0 C-N-CA 125.114 1.366 . . . . 3.9300000000000002 111.685 172.73 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 3' ' ' THR . . . . . 0.444 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 0.2 OUTLIER . . . . . 0 CA--C 1.542 0.661 0 N-CA-C 111.99 0.367 . . . . 3.04 111.99 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 4' ' ' PRO . . . . . 0.444 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 42.4 Cg_endo -71.04 -16.6 32.17 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 121.966 1.778 . . . . 2.0800000000000001 115.097 -173.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -73.01 -49.68 27.47 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 120.671 1.578 . . . . 2.3599999999999999 110.038 177.615 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 6' ' ' GLU . . . . . 0.504 ' H ' ' CD ' ' B' ' 6' ' ' GLU . 18.7 mp0 -67.45 -45.47 75.91 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.244 1.818 . . . . 5.8799999999999999 108.748 -178.334 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.55 -36.4 69.24 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.098 1.359 . . . . 6.2199999999999998 112.699 171.612 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.19 -48.78 64.33 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 117.515 -1.231 . . . . 2.2599999999999998 111.197 170.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.468 HD11 ' CD2' ' A' ' 83' ' ' TYR 0.274 0.3 OUTLIER -63.15 -24.11 67.74 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.68 1.582 . . . . 3.1600000000000001 112.962 179.674 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.1 m -52.16 -34.5 45.16 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.942 0.897 . . . . 1.3600000000000001 111.992 165.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.88 -22.04 58.88 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 117.222 -1.371 . . . . 2.6299999999999999 113.169 -179.015 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 19.9 mtp -72.02 -44.67 63.03 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 119.685 1.13 . . . . 3.6099999999999999 111.475 175.123 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 2.9 m -66.05 -23.84 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 O-C-N 121.055 -1.028 . . . . 2.3999999999999999 111.273 175.701 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 58.7 m -75.74 -49.49 18.06 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.501 1.52 . . . . 0.93000000000000005 111.707 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.2 p -66.57 -40.24 88.87 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 119.129 0.877 . . . . 1.5600000000000001 109.605 170.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -63.02 -58.88 5.81 Favored 'General case' 0 C--O 1.224 -0.284 0 O-C-N 123.872 0.732 . . . . 2.0899999999999999 110.488 -174.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -57.81 -46.43 84.7 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 118.004 0.365 . . . . 2.5600000000000001 110.588 -175.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.74 -30.53 65.7 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.333 0.864 . . . . 5.2599999999999998 113.333 -174.218 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -82.19 -19.69 39.32 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.104 0.866 . . . . 2.6099999999999999 112.811 169.569 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 21.3 p -81.22 -27.96 35.05 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.008 1.484 . . . . 1.4099999999999999 115.008 178.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.06 -9.58 86.01 Favored Glycine 0 CA--C 1.538 1.504 0 O-C-N 120.506 -1.371 . . . . 2.3300000000000001 112.736 168.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.7 -23.16 63.39 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.136 1.774 . . . . 3.8700000000000001 113.923 -168.075 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -150.41 157.95 43.61 Favored 'General case' 0 C--O 1.245 0.852 0 C-N-CA 126.863 2.065 . . . . 4.1600000000000001 108.454 172.043 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.69 -3.91 0.21 Allowed Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.383 1.468 . . . . 2.8700000000000001 114.011 -170.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 8.5 t 41.66 -137.74 0.19 Allowed 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 124.877 1.271 . . . . 4.9800000000000004 112.9 -144.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . 0.316 0.0 OUTLIER 53.2 -176.15 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.658 1 C-N-CA 132.703 4.401 . . . . 11.25 114.893 -173.301 . . . . . . . . 4 3 . 1 . 013 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 14.4 tp -85.86 39.35 0.8 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.822 1.649 . . . . 4.6100000000000003 111.001 170.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 22.5 p -134.31 141.32 46.89 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.827 2.051 . . . . 1.1899999999999999 112.446 -167.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 53.8 mt -97.75 98.16 9.62 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.917 1.687 . . . . 1.77 111.2 172.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 29.1 t -54.09 151.9 6.51 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.167 1.387 . . . . 2.2200000000000002 110.893 158.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 25.4 ttm-85 -42.81 -37.56 1.84 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.52 1.928 . . . . 4.71 115.229 -172.253 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 17.1 tptt -87.39 -21.81 25.41 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 118.099 2.629 . . . . 8.9399999999999995 118.099 175.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -60.29 -49.62 76.9 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 108.178 -1.045 . . . . 2.3999999999999999 108.178 164.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -56.48 -50.4 71.87 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.967 1.707 . . . . 2.6000000000000001 111.386 -177.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 35' ' ' LYS . . . . . 0.413 ' HA ' HD12 ' B' ' 38' ' ' ILE . 0.0 OUTLIER -54.38 -42.52 70.44 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.056 1.132 . . . . 3.8900000000000001 114.056 -177.051 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -82.66 -35.53 26.79 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 118.251 -0.88 . . . . 4.9900000000000002 111.709 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.36 -42.29 81.77 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 118.096 -0.955 . . . . 2.1899999999999999 111.211 175.324 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 0.413 HD12 ' HA ' ' B' ' 35' ' ' LYS . 47.3 mt -44.9 -53.84 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 CA-C-N 120.178 1.354 . . . . 1.5800000000000001 110.27 171.251 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 4.5 ttpm? -78.19 -0.9 30.23 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 125.346 1.458 . . . . 3.6099999999999999 114.401 -174.078 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.85 -33.64 6.67 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 127.1 2.16 . . . . 4.1299999999999999 111.831 175.54 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.14 -68.51 0.38 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.889 1.675 . . . . 4.6299999999999999 107.185 170.098 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.13 141.25 52.7 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 121.33 -0.856 . . . . 3.2599999999999998 109.079 170.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 5.1 t -84.3 9.29 13.44 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.422 0.897 . . . . 4.3399999999999999 113.422 171.806 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 9.3 mp -89.71 153.38 20.75 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.372 1.469 . . . . 4.7199999999999998 111.688 -169.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.71 146.71 48.62 Favored Glycine 0 CA--C 1.532 1.146 0 N-CA-C 110.803 -0.919 . . . . 3.73 110.803 169.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 46' ' ' GLU . . . . . 0.513 ' HG2' ' H ' ' B' ' 48' ' ' LYS . 23.4 tt0 -57.26 145.38 32.06 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.845 1.054 . . . . 10.41 113.845 -164.256 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 76.3 mmm -40.49 -40.95 1.33 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.322 1.849 . . . . 4.4900000000000002 113.271 161.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.513 ' H ' ' HG2' ' B' ' 46' ' ' GLU . 0.8 OUTLIER 99.53 140.05 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.968 1 C-N-CA 134.613 5.165 . . . . 3.4399999999999999 108.117 -172.267 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -43.13 -47.76 6.21 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.973 1.709 . . . . 3.8700000000000001 113.579 -176.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -65.02 -15.29 62.16 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 115.39 1.626 . . . . 2.8900000000000001 115.39 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 40.5 t -92.71 -15.27 26.9 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 120.074 1.306 . . . . 2.4500000000000002 112.663 171.016 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 37.3 mm -65.02 -26.96 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 124.752 1.221 . . . . 2.25 111.636 -177.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -63.72 -60.42 3.32 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 119.35 0.977 . . . . 5.96 112.417 178.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.35 -25.98 61.74 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.138 0.792 . . . . 3.4199999999999999 113.138 177.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -63.62 -58.21 7.64 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-O 118.766 -0.635 . . . . 2.2200000000000002 109.785 169.146 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ppp? -66.15 -36.28 82.69 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 118.935 0.789 . . . . 2.6600000000000001 110.873 -172.21 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -60.1 -23.8 64.12 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 127.774 2.43 . . . . 3.7200000000000002 113.994 173.635 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 9.3 t -80.34 -21.82 42.07 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.939 -1.101 . . . . 2.79 112.187 174.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.3 mt -90.67 -46.39 8.3 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.762 1.625 . . . . 2.25 109.809 178.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -67.6 137.05 55.36 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.89 1.276 . . . . 2.4300000000000002 110.82 172.011 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.21 -43.08 7.52 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.545 -1.347 . . . . 2.9199999999999999 111.43 175.901 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -86.39 -15.1 41.44 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.294 0.85 . . . . 2.0699999999999998 113.294 -168.445 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 9.3 t 67.85 16.33 9.66 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.588 1.555 . . . . 2.0099999999999998 112.218 -169.101 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -73.47 -24.67 60.24 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 130.384 3.473 . . . . 2.1600000000000001 110.318 174.087 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 64.69 0.52 1.16 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 128.524 2.729 . . . . 5.9699999999999998 115.573 169.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -77.14 130.67 37.64 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 108.088 -1.078 . . . . 2.1200000000000001 108.088 138.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 48.0 mt -100.54 112.97 34.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 124.999 1.32 . . . . 1.28 108.516 173.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.94 164.31 25.9 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 122.444 0.298 . . . . 2.5800000000000001 111.466 172.604 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -43.83 -42.68 5.79 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.366 1.466 . . . . 2.52 113.537 179.192 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 ttpm? -76.04 -25.47 55.67 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.406 2.282 . . . . 3.5099999999999998 113.842 -177.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -74.85 -50.4 17.18 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 107.77 -1.196 . . . . 1.6000000000000001 107.77 167.301 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -56.81 -36.04 69.46 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.618 1.967 . . . . 2.1200000000000001 115.14 -178.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 89.7 p -67.74 -15.28 63.56 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 118.684 -2.51 . . . . 1.77 113.599 175.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 27.9 t -70.37 -30.42 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 O-C-N 120.668 -1.27 . . . . 2.04 111.711 170.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -60.84 -53.44 57.37 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.528 -0.732 . . . . 2.27 110.427 166.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 41.5 mt -57.23 -39.14 74.9 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.648 0.779 . . . . 1.3700000000000001 112.189 176.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 91.5 m -55.34 -56.19 22.94 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.793 1.637 . . . . 0.93999999999999995 111.627 174.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 22.0 ptp -68.15 -35.83 78.7 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 112.917 0.71 . . . . 1.8100000000000001 112.917 -177.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 97.4 mt -61.84 -45.31 94.37 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 122.921 0.488 . . . . 1.76 110.904 172.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 3.0 t -61.18 -32.19 71.93 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.173 0.897 . . . . 1.8799999999999999 112.817 177.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 68.3 mtp -71.57 -34.86 70.32 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.918 1.081 . . . . 1.99 113.918 172.089 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.46 -44.2 83.4 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.763 1.165 . . . . 1.05 110.475 171.16 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -64.71 -22.02 66.88 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.009 0.744 . . . . 2.3399999999999999 113.009 -179.113 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -61.18 -62.12 2.07 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 119.245 0.929 . . . . 2.1400000000000001 112.59 162.506 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.97 -30.47 65.31 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 119.343 0.974 . . . . 3.6800000000000002 112.51 -172.05 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -58.44 -46.96 85.49 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.481 1.912 . . . . 3.6000000000000001 112.143 169.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -60.7 -29.7 69.49 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.443 -1.411 . . . . 3.1600000000000001 112.193 169.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 86.5 mt -83.99 -5.03 59.15 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 117.893 -1.051 . . . . 2.6600000000000001 113.443 171.773 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -89.83 -23.9 21.57 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.874 1.67 . . . . 6.4699999999999998 112.618 170.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.44 -44.63 64.45 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.803 1.241 . . . . 3.52 110.682 163.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -90.34 4.02 52.02 Favored 'General case' 0 CA--C 1.558 1.265 0 N-CA-C 114.944 1.461 . . . . 3.0600000000000001 114.944 -176.105 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 1.1 tttp . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 117.969 2.581 . . . . 5.5800000000000001 117.969 -166.375 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 . . . . . 0 C--O 1.24 0.558 0 N-CA-C 108.702 -0.851 . . . . 4.8300000000000001 108.702 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.05 153.95 42.22 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 126.485 1.914 . . . . 2.8700000000000001 112.278 -175.086 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -65.93 -26.83 51.26 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.699 2.266 . . . . 2.1099999999999999 113.482 -167.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -65.31 -36.03 82.81 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.597 0.759 . . . . 3.2599999999999998 111.238 171.405 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -73.11 -36.9 66.85 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.129 -0.982 . . . . 4.1200000000000001 111.321 174.276 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -61.93 -33.37 74.13 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.063 -1.023 . . . . 4.4900000000000002 112.491 169.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.31 -46.58 60.34 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.997 1.319 . . . . 1.23 112.232 174.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 66.6 mt -72.41 -29.48 63.77 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 120.605 -1.309 . . . . 2.04 113.026 177.527 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.8 p -71.1 -32.34 68.91 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 120.695 -1.253 . . . . 2.6699999999999999 112.669 169.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.1 m -53.96 -39.96 66.42 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.852 1.206 . . . . 1.3999999999999999 110.782 171.028 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -61.05 -44.24 97.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.072 0.949 . . . . 4.1500000000000004 113.48 176.202 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.8 m -71.5 -19.6 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 CA-C-N 119.969 1.259 . . . . 2.25 113.097 176.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 87.4 m -80.48 -33.36 36.65 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.715 2.006 . . . . 1.3100000000000001 113.211 -179.128 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 p -70.82 -39.78 72.85 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.216 0.916 . . . . 1.96 108.87 158.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -62.98 -57.37 10.96 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.407 0.549 . . . . 1.6499999999999999 112.326 -167.506 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 -54.79 -44.99 74.23 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.728 -0.608 . . . . 3.3599999999999999 111.812 174.346 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -67.62 -42.72 81.89 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.872 0.869 . . . . 4.1500000000000004 112.492 -171.19 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -78.35 -29.21 47.38 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.605 -0.685 . . . . 2.1099999999999999 112.457 174.156 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.4 t -56.98 -19.04 15.99 Favored 'General case' 0 C--O 1.247 0.939 0 N-CA-C 114.738 1.385 . . . . 1.97 114.738 174.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.68 -5.04 88.61 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 116.823 -2.098 . . . . 1.8799999999999999 116.869 175.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 -76.94 -23.9 52.41 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 119.87 1.835 . . . . 4.8399999999999999 115.633 -174.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -162.65 162.29 26.95 Favored 'General case' 0 C--O 1.248 0.993 0 C-N-CA 126.861 2.065 . . . . 5.0899999999999999 109.805 -173.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 47.09 -137.58 9.7 Favored Glycine 0 N--CA 1.474 1.214 0 C-N-CA 125.836 1.684 . . . . 1.9299999999999999 113.877 174.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.2 t -73.6 167.97 20.25 Favored 'General case' 0 C--O 1.251 1.164 0 CA-C-O 123.121 1.439 . . . . 2.5800000000000001 112.982 173.417 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 38.9 mttp -117.07 67.47 0.73 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 130.604 3.562 . . . . 7.4400000000000004 109.501 -175.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 164.18 -10.77 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.969 1 C-N-CA 133.71 4.804 . . . . 3.8100000000000001 110.502 -174.458 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.6 p -107.76 160.46 15.7 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.466 2.307 . . . . 1.3899999999999999 112.282 167.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.8 mt -108.76 101.53 10.65 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.75 1.62 . . . . 1.51 111.307 162.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.4 m -71.1 160.8 32.23 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 125.102 1.361 . . . . 2.8999999999999999 113.138 -177.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -41.07 -47.03 3.08 Favored 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 115.472 1.656 . . . . 5.0099999999999998 115.472 -172.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.52 -30.29 13.41 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 121.122 1.783 . . . . 4.46 113.271 -178.086 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -49.87 -41.73 46.09 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.665 1.186 . . . . 1.51 110.32 163.217 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -68.55 -50.31 52.88 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.496 1.118 . . . . 2.7200000000000002 112.032 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -56.77 -38.52 72.59 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.223 -0.923 . . . . 4.1100000000000003 113.232 -178.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.0 tp10 -66.03 -44.17 85.44 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.36 0.664 . . . . 3.71 112.786 173.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.2 -51.65 69.06 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.664 1.185 . . . . 2.0499999999999998 111.94 -176.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 35.3 mt -54.21 -48.65 66.26 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 CA-C-O 121.925 0.869 . . . . 0.82999999999999996 110.478 179.06 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? -69.35 -8.88 50.33 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.371 1.068 . . . . 5.2000000000000002 112.405 -176.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.61 -71.14 0.66 Allowed 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.738 1.615 . . . . 4.5 112.805 157.474 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -40.61 -51.39 2.98 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.256 1.422 . . . . 4.3499999999999996 111.864 -172.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.32 9.76 17.0 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 115.608 1.707 . . . . 2.8599999999999999 115.608 -162.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 53.1 t -73.13 74.72 1.26 Allowed 'General case' 0 CA--C 1.551 1.012 0 CA-C-O 123.945 1.831 . . . . 3.5600000000000001 113.043 -177.264 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -80.5 -47.75 13.82 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 126.366 1.866 . . . . 5.0099999999999998 109.243 166.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -125.04 162.52 19.32 Favored Glycine 0 CA--C 1.534 1.281 0 N-CA-C 108.054 -2.018 . . . . 4.7999999999999998 108.054 139.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.07 120.42 31.24 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.686 1.743 . . . . 7.8899999999999997 110.591 -178.335 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.9 ptm -70.55 141.0 51.9 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.071 -1.018 . . . . 2.3300000000000001 110.825 168.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.41 166.91 22.08 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.93 1.085 . . . . 4.5 113.93 -166.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.35 -45.33 69.11 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 127.06 2.144 . . . . 5.9900000000000002 114.087 -168.366 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.4 p -76.06 -40.41 53.3 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 126.099 1.76 . . . . 2.4100000000000001 112.342 177.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.8 m -61.02 -28.6 69.17 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.43 -0.794 . . . . 2.4300000000000002 112.597 174.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.3 mt -70.91 -35.09 58.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-O 117.612 -1.185 . . . . 1.24 112.243 171.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.32 -29.0 57.13 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 120.432 1.469 . . . . 3.04 113.5 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -72.67 -38.01 67.75 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.103 0.865 . . . . 2.3700000000000001 112.025 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -58.67 -47.32 84.9 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.445 0.698 . . . . 2.46 109.666 169.323 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.26 -44.76 80.0 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.796 1.239 . . . . 1.8999999999999999 111.93 173.86 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.12 -22.92 61.63 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 119.881 1.219 . . . . 4.0599999999999996 113.047 173.33 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.1 t -80.84 -36.93 30.85 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 119.81 -1.806 . . . . 2.46 112.714 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.5 mp -64.57 -49.08 72.58 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 121.073 -1.017 . . . . 2.9300000000000002 110.608 168.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -103.05 71.44 1.13 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.255 1.822 . . . . 2.4399999999999999 111.718 -164.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -50.97 -27.94 8.77 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.916 1.686 . . . . 3.1699999999999999 114.074 -168.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 41.4 p30 -100.69 -11.52 19.89 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.318 1.847 . . . . 2.9300000000000002 114.744 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.4 t 50.49 52.65 14.41 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.825 1.25 . . . . 4.1600000000000001 112.047 -168.383 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.5 p30 -83.9 -11.13 57.37 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.575 1.55 . . . . 2.48 111.1 174.119 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 70.28 13.72 7.6 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 130.256 3.423 . . . . 4.4500000000000002 113.997 -177.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -131.65 120.97 23.55 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 127.209 2.204 . . . . 2.48 108.924 179.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 47.4 mt -101.72 108.14 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.004 -1.06 . . . . 1.6000000000000001 111.709 -178.385 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -64.34 155.74 31.34 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 127.71 2.404 . . . . 2.5499999999999998 111.571 164.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -34.68 68.33 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.477 -1.389 . . . . 2.04 114.324 -179.17 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? -83.72 -24.66 31.12 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 120.497 -1.377 . . . . 2.9900000000000002 112.502 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -60.46 -54.25 47.85 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 108.777 -0.823 . . . . 1.9299999999999999 108.777 157.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -62.07 -33.05 73.69 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 126.706 2.003 . . . . 3.1200000000000001 115.77 -174.414 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.41 -21.65 65.56 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 120.872 -1.143 . . . . 1.8100000000000001 112.452 -171.222 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.1 p -57.45 -35.29 49.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 123.632 0.773 . . . . 2.3199999999999998 112.573 170.398 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.469 ' CE1' HD11 ' A' ' 79' ' ' LEU . 18.2 t80 -61.79 -61.01 2.81 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 126.144 1.778 . . . . 2.1299999999999999 111.299 -173.274 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.5 mt -68.15 -24.54 65.0 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.451 -0.785 . . . . 2.3999999999999999 111.332 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 30.0 m -61.59 -54.88 37.07 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.199 0.909 . . . . 0.68999999999999995 110.983 168.296 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 78.1 mtm -58.36 -37.66 75.66 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.258 0.935 . . . . 1.46 112.888 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.469 HD11 ' CE1' ' A' ' 75' ' ' PHE . 43.6 mt -73.36 -46.24 50.25 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.853 0.686 . . . . 1.5700000000000001 112.853 178.41 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 1.7 t -71.11 -25.86 62.78 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.418 -0.801 . . . . 1.8100000000000001 112.721 178.575 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 44.6 mmm -58.82 -48.51 81.06 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.807 1.243 . . . . 1.74 111.657 165.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.67 -37.85 85.58 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.17 -0.957 . . . . 0.84999999999999998 112.067 174.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -64.88 -33.11 75.24 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.161 1.171 . . . . 2.27 114.161 173.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -58.25 -46.7 85.49 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.608 1.095 . . . . 2.1899999999999999 111.499 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -75.47 -35.36 60.87 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.086 1.354 . . . . 3.8500000000000001 111.984 -172.442 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.21 -46.02 79.63 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.991 1.716 . . . . 2.25 110.981 167.02 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -69.02 -27.49 65.72 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.672 1.189 . . . . 2.5899999999999999 112.466 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 78.6 mt -70.33 -41.36 73.33 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.967 -1.083 . . . . 1.8500000000000001 111.546 171.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -71.47 -13.73 61.91 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.954 1.464 . . . . 3.21 114.954 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.5 t70 . . . . . 0 CA--C 1.537 0.452 0 O-C-N 121.377 -0.827 . . . . 4.6299999999999999 111.182 163.965 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 72.4 p . . . . . 0 C--O 1.237 0.42 0 N-CA-C 113.189 0.811 . . . . 2.8799999999999999 113.189 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -65.01 -14.51 45.7 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 121.571 1.514 . . . . 1.96 112.489 168.069 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.2 -40.92 74.31 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-N 119.987 1.267 . . . . 3.0299999999999998 112.298 174.609 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -60.26 -27.6 67.38 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 120.676 1.58 . . . . 4.1500000000000004 112.58 171.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -74.7 -25.64 59.28 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.646 -1.284 . . . . 5.4400000000000004 111.869 171.498 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.45 -47.89 30.79 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.726 1.211 . . . . 1.02 112.116 172.322 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mp -60.5 -41.63 94.71 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 120.552 1.523 . . . . 2.4100000000000001 112.086 176.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 17.6 p -65.68 -39.41 91.29 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 118.147 -0.93 . . . . 2.0600000000000001 112.231 174.153 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 87.8 m -57.3 -45.48 84.13 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.775 1.17 . . . . 1.28 110.893 169.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 4.4 tmm? -60.18 -53.08 61.91 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.089 1.355 . . . . 3.79 111.584 -176.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 9.9 p -64.79 -25.06 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 O-C-N 121.241 -0.912 . . . . 2.1600000000000001 112.801 175.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 56.3 m -74.9 -45.42 42.82 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 117.978 -1.01 . . . . 0.75 111.276 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 8.6 p -58.48 -38.44 77.62 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.825 0.738 . . . . 1.5900000000000001 110.105 164.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -63.77 -51.98 62.41 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.927 -0.309 . . . . 2.4100000000000001 111.723 -173.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -78.16 -21.81 49.67 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 114.157 1.169 . . . . 2.23 114.157 -177.276 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -68.6 -54.88 13.75 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.068 0.849 . . . . 4.3499999999999996 111.374 167.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -73.25 -27.49 61.61 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 121.577 -0.702 . . . . 2.3500000000000001 112.412 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 10.5 p -68.74 -25.66 64.85 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.92 1.691 . . . . 2.3700000000000001 113.21 172.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.24 5.4 84.4 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 126.684 2.088 . . . . 1.6499999999999999 114.678 170.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -70.42 -29.11 65.63 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.166 1.483 . . . . 3.6800000000000002 112.171 172.446 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -156.75 153.84 29.03 Favored 'General case' 0 C--O 1.249 1.034 0 CA-C-O 121.899 0.857 . . . . 3.9500000000000002 112.255 176.542 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 58.08 -127.82 46.03 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 126.689 2.09 . . . . 2.5600000000000001 110.972 166.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.91 121.69 11.14 Favored 'General case' 0 C--O 1.249 1.027 0 O-C-N 122.267 -0.549 . . . . 3.0499999999999998 110.127 167.086 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -76.72 54.74 1.0 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 128.367 2.667 . . . . 7.4800000000000004 110.393 166.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 53.7 tp -161.28 -51.09 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 126.213 1.805 . . . . 2.7400000000000002 107.906 -178.312 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.6 p -92.28 157.42 16.67 Favored 'General case' 0 C--O 1.254 1.338 0 CA-C-O 123.513 1.625 . . . . 1.49 112.626 175.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -103.4 107.21 17.95 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 111.636 -2.529 . . . . 3.0800000000000001 107.814 167.112 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 41.4 t -70.91 143.03 51.1 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 108.594 -0.891 . . . . 2.1200000000000001 108.594 161.169 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -24.36 -51.51 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 128.727 2.811 . . . . 5.5700000000000003 116.352 -175.217 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -44.18 91.63 Favored 'General case' 0 CA--C 1.554 1.112 0 N-CA-C 116.107 1.891 . . . . 5.04 116.107 174.134 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -59.95 -43.74 94.81 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.862 2.065 . . . . 1.8 109.514 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.38 -44.93 70.5 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.245 1.418 . . . . 3.3399999999999999 110.834 -179.544 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -54.96 -42.11 71.94 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.069 -1.02 . . . . 2.8700000000000001 112.283 174.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -59.9 -49.06 79.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.532 0.733 . . . . 3.0299999999999998 111.805 174.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.5 tp -57.78 -44.52 86.29 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.144 0.978 . . . . 2.23 112.715 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 73.8 mt -56.74 -55.4 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 N-CA-C 109.558 -0.534 . . . . 1.29 109.558 171.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -63.5 -17.52 62.84 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 112.95 0.722 . . . . 4.5800000000000001 112.95 -175.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -87.25 -48.56 7.92 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 125.902 1.681 . . . . 4.7000000000000002 113.917 -178.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -116.09 -8.84 11.77 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 125.399 1.687 . . . . 6.5499999999999998 114.384 -159.254 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 24.0 tp -121.34 88.72 2.99 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.753 1.221 . . . . 2.5499999999999998 109.073 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 17.9 p -82.4 13.89 3.34 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 115.088 1.514 . . . . 4.4400000000000004 115.088 -157.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 8.0 mp -75.98 134.16 40.24 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.121 0.968 . . . . 3.5299999999999998 111.173 -169.044 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.59 -20.97 59.86 Favored Glycine 0 CA--C 1.532 1.15 0 CA-C-O 119.625 -0.541 . . . . 2.9399999999999999 113.83 177.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -87.39 -3.81 59.02 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.886 1.275 . . . . 5.6900000000000004 113.629 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 7.3 tpt -77.06 39.16 0.23 Allowed 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 124.309 2.004 . . . . 2.27 112.144 171.43 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -57.84 125.89 25.01 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 127.138 2.175 . . . . 3.98 109.848 -174.329 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 65.1 tt0 -58.38 -29.37 65.97 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 115.267 1.58 . . . . 3.5499999999999998 115.267 -166.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -66.66 -14.39 62.41 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 120.556 1.525 . . . . 2.4100000000000001 113.789 173.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 9.4 t -97.19 -7.84 31.44 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.669 1.588 . . . . 2.2999999999999998 112.422 172.047 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 12.5 mt -65.28 -40.39 88.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 119.843 1.202 . . . . 1.29 110.813 176.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -72.0 -23.89 61.48 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.206 0.817 . . . . 3.0800000000000001 113.206 -174.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -76.1 -37.22 58.38 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.467 0.707 . . . . 2.3900000000000001 111.809 172.281 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 10.3 tt -62.62 -49.39 75.38 Favored 'General case' 0 C--N 1.343 0.316 0 O-C-N 121.506 -0.746 . . . . 2.4399999999999999 110.184 168.205 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.09 -48.78 67.49 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 124.341 1.056 . . . . 3.1800000000000002 111.72 177.443 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -58.4 -36.47 73.61 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.313 1.845 . . . . 4.0300000000000002 113.056 173.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 67.9 m -77.57 -19.43 55.67 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.317 1.847 . . . . 2.1699999999999999 114.315 177.475 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 20.4 mt -78.08 -54.37 6.34 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.338 -0.851 . . . . 1.8 109.568 159.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -82.88 53.43 2.41 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 129.699 3.2 . . . . 2.0600000000000001 112.197 -172.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -58.53 -19.17 35.42 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.049 1.74 . . . . 3.2200000000000002 113.642 -172.43 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 50.9 p30 -96.23 -8.33 33.23 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.39 1.876 . . . . 2.1800000000000002 115.145 174.72 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 68.1 m 60.68 28.64 18.35 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.916 1.686 . . . . 2.1499999999999999 114.743 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 47.1 p30 -79.11 -8.54 59.06 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.173 -0.954 . . . . 2.29 111.562 177.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 71.12 -15.22 0.42 Allowed 'General case' 0 C--O 1.236 0.369 0 C-N-CA 131.038 3.735 . . . . 3.9700000000000002 115.282 171.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -78.3 150.14 33.37 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-O 122.752 1.263 . . . . 3.71 110.16 159.39 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 37.1 mm -113.72 112.14 39.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 125.824 1.649 . . . . 1.3100000000000001 108.561 164.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 68' ' ' ASP . . . . . 0.444 ' CG ' ' HZ2' ' B' ' 70' ' ' LYS . 0.0 OUTLIER -82.73 168.68 16.97 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.607 1.163 . . . . 2.8799999999999999 111.315 163.54 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -56.63 -33.27 66.14 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.508 0.929 . . . . 2.5499999999999998 113.508 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.444 ' HZ2' ' CG ' ' B' ' 68' ' ' ASP . 8.6 mtmp? -70.14 -44.28 69.19 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.555 -1.34 . . . . 4.1699999999999999 111.975 176.378 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -59.59 -47.91 83.74 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 118.838 0.744 . . . . 1.77 109.812 171.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -59.42 -31.91 69.71 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.849 1.66 . . . . 2.0499999999999998 114.851 179.527 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 38.3 t -56.43 -30.63 63.06 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.753 -1.217 . . . . 1.99 112.518 171.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 45.5 t -60.13 -44.47 95.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 O-C-N 121.394 -0.817 . . . . 1.54 110.471 175.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -58.24 -53.3 59.88 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.659 0.784 . . . . 1.6000000000000001 111.384 176.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 59.8 mt -60.28 -40.2 89.6 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.131 0.973 . . . . 1.55 111.604 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.9 m -62.02 -53.26 58.12 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.322 1.449 . . . . 0.80000000000000004 110.981 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.9 mtm -57.43 -38.79 74.95 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.383 0.512 . . . . 1.52 112.383 179.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 95.1 mt -70.39 -47.28 61.59 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 118.572 -0.728 . . . . 1.5800000000000001 111.699 178.347 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 65.0 m -64.4 -30.18 71.23 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 120.034 1.288 . . . . 1.8 113.872 175.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 81.3 mtp -64.39 -48.69 74.49 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.074 0.852 . . . . 2.2400000000000002 111.242 165.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.76 -39.01 92.84 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.298 0.953 . . . . 0.89000000000000001 112.513 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -66.66 -33.31 75.36 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.427 1.012 . . . . 3.3199999999999998 112.803 174.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.96 -49.99 58.5 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.271 1.028 . . . . 1.78 111.001 172.419 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -64.2 -46.69 82.8 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.802 1.241 . . . . 4.2000000000000002 110.725 -175.488 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -62.39 -41.26 98.53 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.234 1.813 . . . . 2.0600000000000001 112.509 174.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -64.26 -32.43 74.02 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 120.802 -1.186 . . . . 2.7200000000000002 111.104 174.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 66.0 mt -73.22 -17.25 61.37 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 117.934 -1.031 . . . . 1.8300000000000001 113.573 173.085 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -83.34 -15.01 51.66 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.905 1.23 . . . . 4.8700000000000001 113.679 168.621 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -85.57 -59.65 2.25 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.075 1.35 . . . . 3.1200000000000001 111.645 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.62 -4.67 32.3 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 115.064 1.505 . . . . 2.8599999999999999 115.064 -170.603 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.046 0 C-N-CA 126.649 1.98 . . . . 4.7800000000000002 114.969 175.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.4 mp0 . . . . . 0 CA--C 1.534 0.347 0 N-CA-C 107.169 -1.419 . . . . 4.9199999999999999 107.169 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 24.9 p -151.73 157.73 34.4 Favored Pre-proline 0 C--O 1.238 0.485 0 C-N-CA 128.569 2.747 . . . . 3.2400000000000002 108.617 177.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.77 -25.98 16.43 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 122.926 2.418 . . . . 2.6899999999999999 111.199 162.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.66 -47.01 85.55 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.676 1.59 . . . . 2.8599999999999999 112.351 -178.578 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -60.8 -34.73 74.95 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.258 0.481 . . . . 4.0599999999999996 111.746 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.33 -28.82 65.42 Favored 'General case' 0 CA--C 1.552 1.033 0 O-C-N 119.851 -1.781 . . . . 4.3899999999999997 112.17 175.424 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.16 -39.89 62.95 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.63 -0.669 . . . . 1.7 111.657 173.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 97.6 mt -59.9 -47.0 87.55 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.859 0.754 . . . . 1.3799999999999999 110.887 172.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 m -52.96 -54.52 33.76 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.424 1.49 . . . . 2.5499999999999998 112.031 171.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.7 t -66.86 -28.48 68.37 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-N 120.5 1.5 . . . . 2.6600000000000001 112.879 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.98 -48.45 63.1 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 117.782 -1.104 . . . . 3.77 112.365 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.0 p -63.74 -24.5 35.97 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-N 120.689 1.586 . . . . 2.27 111.848 175.289 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.9 m -73.9 -53.07 10.96 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.347 1.459 . . . . 0.72999999999999998 111.923 179.459 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.4 p -63.77 -35.01 79.18 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.701 1.137 . . . . 2.0499999999999998 110.533 171.757 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -59.05 -62.87 1.56 Allowed 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 108.925 -0.768 . . . . 1.8799999999999999 108.925 177.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.99 -31.13 69.74 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.647 1.112 . . . . 2.4700000000000002 112.725 -172.165 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -57.77 -49.25 77.22 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.704 -0.623 . . . . 4.2300000000000004 112.358 169.46 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -83.94 -29.57 26.99 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.951 -1.093 . . . . 2.9199999999999999 113.397 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.9 p -69.46 -30.69 68.65 Favored 'General case' 0 C--O 1.242 0.689 0 O-C-N 120.82 -1.175 . . . . 2.2999999999999998 111.047 172.332 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.57 -1.15 70.04 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 127.518 2.485 . . . . 1.72 115.467 171.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -72.23 -42.56 65.55 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.879 1.839 . . . . 5.8799999999999999 111.37 -177.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -149.56 166.44 29.22 Favored 'General case' 0 C--O 1.244 0.775 0 C-N-CA 125.781 1.633 . . . . 3.8500000000000001 113.011 -177.113 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.62 -132.77 51.62 Favored Glycine 0 C--N 1.339 0.735 0 C-N-CA 125.292 1.425 . . . . 2.5800000000000001 110.779 171.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.5 m -64.34 138.21 58.31 Favored 'General case' 0 C--O 1.249 1.051 0 O-C-N 121.934 -0.745 . . . . 2.6400000000000001 110.555 163.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 36.1 pttt -67.81 -24.81 65.33 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.31 0.644 . . . . 5.3799999999999999 111.929 171.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.0 mt -81.57 -23.74 36.95 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.931 1.292 . . . . 3.71 113.683 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 61.1 p -109.26 146.15 34.74 Favored 'General case' 0 C--O 1.244 0.799 0 CA-C-N 119.934 1.243 . . . . 1.24 111.276 175.032 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.84 83.37 2.54 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.245 -1.02 . . . . 2.1499999999999999 108.245 163.251 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.0 m -58.16 143.62 43.4 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 123.914 0.885 . . . . 3.7000000000000002 108.803 176.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 35.7 ptt-85 -47.47 -34.89 7.89 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 117.241 2.312 . . . . 6.3300000000000001 117.241 -158.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.5 ptmm? -51.76 -39.53 58.71 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 116.337 1.977 . . . . 4.6600000000000001 116.337 168.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -68.1 -52.57 33.49 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 128.334 2.654 . . . . 1.6499999999999999 108.747 169.355 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.6 tp -64.37 -33.95 77.03 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.799 0.666 . . . . 2.6099999999999999 112.799 -172.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -8.84 54.07 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 115.184 1.55 . . . . 4.8099999999999996 115.184 -179.239 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -74.96 -66.79 0.71 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 118.592 -0.718 . . . . 3.9500000000000002 109.758 156.12 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 31.8 tp -44.33 -54.49 5.76 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.319 1.448 . . . . 2.5299999999999998 113.26 -167.15 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 28.6 mt -48.14 -44.47 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 123.43 0.692 . . . . 0.96999999999999997 112.102 -176.018 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.275 0.0 OUTLIER -84.45 -9.07 58.71 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-O 118.626 -0.702 . . . . 4.1600000000000001 110.896 -167.769 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -67.28 -57.58 6.39 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.733 1.151 . . . . 2.6699999999999999 109.627 168.1 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -54.95 -69.16 0.14 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.885 2.074 . . . . 4.5099999999999998 110.421 171.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -79.23 65.23 4.34 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.66 1.219 . . . . 2.6699999999999999 108.402 176.165 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.8 p -59.96 -55.09 38.31 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.411 1.884 . . . . 3.5 111.647 176.375 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.464 HD12 ' H ' ' A' ' 44' ' ' LEU . 4.4 mp -14.28 -110.82 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.737 1 C-N-CA 132.378 4.271 . . . . 4.7000000000000002 115.876 -174.789 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -147.13 -28.63 0.07 OUTLIER Glycine 0 N--CA 1.473 1.119 0 O-C-N 121.473 -0.767 . . . . 3.6000000000000001 114.595 175.564 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 27.1 mp0 -63.24 -43.04 99.15 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 128.339 2.656 . . . . 5.5199999999999996 111.581 -177.337 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.17 67.59 6.04 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 123.961 1.838 . . . . 2.1200000000000001 110.333 165.702 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.3 tptp -72.5 160.23 32.64 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 111.49 -2.595 . . . . 6.8799999999999999 109.652 160.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.565 ' CD ' ' H ' ' A' ' 49' ' ' GLU . 4.4 mp0 -52.25 -45.85 65.53 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.624 1.57 . . . . 4.75 113.188 -170.503 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.8 t -80.02 -15.17 57.77 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.507 1.299 . . . . 3.04 114.507 178.366 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.9 m -68.04 -19.27 64.87 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.129 1.332 . . . . 2.6800000000000002 111.712 173.11 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 70.6 mt -85.93 -24.12 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 125.548 1.539 . . . . 1.49 112.808 -175.087 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -57.0 -58.08 9.74 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.698 -0.852 . . . . 3.6200000000000001 108.698 162.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -66.45 -38.61 87.74 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.339 0.866 . . . . 2.5299999999999998 113.339 -175.168 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.68 -51.35 70.32 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 118.582 -0.723 . . . . 2.3999999999999999 110.395 171.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.08 -33.26 70.03 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.236 0.925 . . . . 1.8200000000000001 112.5 -176.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.3 mtpt -58.72 -39.38 80.67 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.446 1.021 . . . . 4.7599999999999998 112.489 170.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.7 t -77.41 -30.37 53.48 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.617 0.969 . . . . 1.77 113.617 173.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.52 -36.36 76.36 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 124.398 1.079 . . . . 2.6200000000000001 112.143 178.812 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -72.45 77.48 1.04 Allowed 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.682 1.193 . . . . 1.6200000000000001 111.276 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 3.5 0.21 Allowed 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.863 1.665 . . . . 5.3600000000000003 114.974 -170.209 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 38.7 p30 -137.67 -0.79 2.11 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 127.298 2.239 . . . . 3.0899999999999999 114.525 173.581 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.9 m 60.73 37.48 18.92 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 115.182 1.549 . . . . 4.1299999999999999 115.182 168.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -88.11 -32.0 18.92 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 126.905 2.082 . . . . 2.7599999999999998 112.975 177.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 105.89 -1.17 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.043 1 C-N-CA 136.455 5.902 . . . . 4.0999999999999996 114.087 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -107.92 136.38 47.73 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 128.21 2.604 . . . . 2.4900000000000002 110.429 178.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 24.7 mm -112.05 114.34 46.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 124.173 0.989 . . . . 1.5800000000000001 108.468 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -103.48 156.92 17.4 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.558 2.343 . . . . 3.3199999999999998 108.589 173.233 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -37.82 -45.19 0.81 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.976 1.71 . . . . 2.4399999999999999 114.241 176.037 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.3 pttt -63.9 -18.31 64.07 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.965 1.306 . . . . 3.6800000000000002 114.025 -177.006 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -105.14 -53.17 2.71 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 127.797 2.439 . . . . 2.9100000000000001 108.147 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -45.25 -35.1 3.17 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 128.384 2.674 . . . . 2.0699999999999998 114.81 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.1 m -68.79 -15.3 63.47 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 120.657 -1.277 . . . . 1.9399999999999999 113.182 178.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 84.3 t -67.06 -31.37 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-N 119.348 0.977 . . . . 2.2599999999999998 110.637 169.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -59.33 -53.19 61.08 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 118.983 0.811 . . . . 1.77 110.323 168.316 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 22.1 mt -62.73 -35.91 81.28 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.255 0.622 . . . . 1.5700000000000001 111.186 -176.341 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.4 m -63.2 -42.39 99.31 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 125.12 1.368 . . . . 1.1599999999999999 111.507 172.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 44.3 ttm -61.6 -42.6 99.1 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.499 1.12 . . . . 3.3799999999999999 111.431 178.104 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.34 -56.66 10.05 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.056 0.543 . . . . 2.7999999999999998 111.253 173.193 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.3 m -60.99 -34.34 74.65 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.8 1.037 . . . . 1.5800000000000001 113.8 -175.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 56.0 mtp -76.7 -24.99 53.11 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.927 1.24 . . . . 2.25 113.918 173.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.3 -43.63 40.61 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 120.525 1.511 . . . . 0.93999999999999995 111.454 169.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -63.61 -28.73 70.12 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.494 1.043 . . . . 2.23 112.914 173.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -54.38 -56.72 15.72 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.577 0.751 . . . . 2.0699999999999998 111.75 165.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.75 -42.35 81.93 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.855 0.862 . . . . 3.2400000000000002 111.661 -176.171 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.52 -44.44 69.14 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.589 1.956 . . . . 2.2400000000000002 112.347 172.15 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -70.62 -32.2 69.44 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.577 -1.327 . . . . 3.0800000000000001 111.723 176.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.3 mt -84.41 -1.52 55.69 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 125.466 1.507 . . . . 1.9399999999999999 113.546 174.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -74.11 -22.42 59.48 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 121.088 -1.007 . . . . 5.2300000000000004 112.348 162.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.2 t70 . . . . . 0 CA--C 1.545 0.777 0 C-N-CA 126.379 1.872 . . . . 5.0099999999999998 111.39 176.931 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 48.4 p . . . . . 0 N--CA 1.469 0.486 0 N-CA-C 112.629 0.603 . . . . 1.75 112.629 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -63.41 -20.66 70.51 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 121.818 1.679 . . . . 2.1600000000000001 112.898 168.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -80.19 -43.39 21.62 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-O 117.136 -1.412 . . . . 2.4300000000000002 111.905 175.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.93 -46.98 81.67 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.436 1.471 . . . . 4.6200000000000001 110.922 168.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -57.97 -27.8 63.78 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.103 -0.998 . . . . 5.1699999999999999 112.959 172.44 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.09 -39.85 54.39 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 120.597 -1.314 . . . . 1.6599999999999999 111.659 176.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 96.0 mt -66.22 -32.5 73.96 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.016 0.926 . . . . 1.73 112.011 171.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.4 m -60.44 -55.98 26.96 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.087 0.858 . . . . 1.8500000000000001 110.777 161.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 83.4 m -53.07 -39.48 63.33 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.15 1.38 . . . . 2.48 111.375 -174.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -48.25 -42.6 30.91 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.027 1.731 . . . . 3.9700000000000002 112.864 174.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 66.4 t -62.41 -28.64 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 124.967 1.307 . . . . 2.2000000000000002 112.674 178.32 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 14.5 m -66.07 -39.96 90.5 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.991 1.716 . . . . 1.1200000000000001 112.423 -179.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -44.94 68.34 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 126.548 1.939 . . . . 1.8400000000000001 108.713 169.613 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -67.73 -43.97 78.72 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 123.719 0.637 . . . . 2.04 111.721 -169.209 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.46 -47.84 83.93 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.895 0.878 . . . . 2.9300000000000002 111.479 170.44 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 3.7 ttmp? -73.19 -40.61 64.63 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.667 0.988 . . . . 3.8100000000000001 113.667 -171.222 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -70.67 -26.07 63.27 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.047 -0.978 . . . . 2.3199999999999998 112.187 166.055 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 32.3 m -68.19 -40.54 82.19 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 120.702 1.592 . . . . 1.49 113.118 167.534 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.59 -12.88 83.78 Favored Glycine 0 CA--C 1.532 1.153 0 C-N-CA 125.769 1.652 . . . . 1.78 112.9 -178.079 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.06 97.83 0.53 Allowed 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 105.832 -1.914 . . . . 4.5700000000000003 105.832 153.122 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 65.17 175.45 0.21 Allowed 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 126.175 1.79 . . . . 5.4400000000000004 114.655 167.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.66 -140.03 30.56 Favored Glycine 0 N--CA 1.474 1.231 0 C-N-CA 125.919 1.723 . . . . 2.1899999999999999 113.036 174.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 67.6 m -78.36 162.42 26.47 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.517 -0.99 . . . . 3.3199999999999998 112.553 171.339 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 19.2 ttmt -85.65 128.24 34.72 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 127.187 2.195 . . . . 7.1299999999999999 107.363 156.599 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.0 tt 91.59 -24.66 0.06 Allowed 'General case' 0 N--CA 1.492 1.625 0 C-N-CA 128.819 2.848 . . . . 3.54 112.321 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.55 137.1 47.06 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 125.287 1.435 . . . . 1.8100000000000001 109.623 170.559 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 75.7 mt -98.29 98.39 9.65 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.928 1.291 . . . . 1.5900000000000001 110.627 175.56 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 3.6 m -52.43 153.56 2.93 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 122.102 0.953 . . . . 2.3199999999999998 112.493 163.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 19.1 ttp85 -48.52 -39.55 23.7 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.893 1.277 . . . . 3.6299999999999999 114.162 -172.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -68.59 -40.72 80.37 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 119.58 -1.95 . . . . 6.3600000000000003 111.7 178.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -53.77 -51.13 64.39 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.638 1.575 . . . . 1.76 109.245 177.511 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 15.0 tp -64.77 -45.61 85.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.477 1.111 . . . . 2.04 112.657 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 2.1 tmpt? -58.17 -34.31 70.18 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 118.883 0.765 . . . . 4.8399999999999999 111.711 175.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -68.64 -54.54 15.75 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.624 0.769 . . . . 4.4000000000000004 111.676 172.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.43 -52.74 64.17 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 126.16 1.784 . . . . 2.1099999999999999 112.294 -176.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 29.0 mt -59.72 -44.44 93.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 119.338 0.972 . . . . 1.45 110.092 178.439 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.425 ' HZ1' ' CD ' ' B' ' 49' ' ' GLU . 13.8 tppt? -66.65 -11.79 55.36 Favored 'General case' 0 CA--C 1.557 1.23 0 O-C-N 121.512 -0.743 . . . . 5.0499999999999998 112.488 178.884 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmtm -105.46 -35.59 7.43 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.796 2.038 . . . . 5.2300000000000004 114.591 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -69.71 -63.26 1.11 Allowed 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 124.8 1.24 . . . . 5.04 109.668 170.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -86.32 56.83 4.16 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.022 0.929 . . . . 2.4199999999999999 108.976 179.17 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 4.8 t -70.09 24.78 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 125.588 1.555 . . . . 3.6099999999999999 114.868 -173.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 38.6 mt -77.41 -3.86 42.41 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 128.746 2.818 . . . . 3.54 113.516 -177.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.14 -49.24 4.19 Favored Glycine 0 N--CA 1.47 0.945 0 C-N-CA 125.042 1.306 . . . . 3.9100000000000001 112.692 179.016 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -60.48 -10.16 4.61 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.583 1.553 . . . . 5.46 114.381 176.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 8.0 tpt -71.31 69.05 0.54 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.106 1.762 . . . . 2.0600000000000001 111.203 170.054 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -88.94 153.41 21.05 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.656 1.982 . . . . 3.7799999999999998 112.845 -166.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.425 ' CD ' ' HZ1' ' B' ' 39' ' ' LYS . 5.3 mp0 -49.64 -57.32 7.42 Favored 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 127.12 2.168 . . . . 4.25 112.096 -165.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 12.0 m -73.12 -0.21 13.45 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.317 1.599 . . . . 2.5699999999999998 115.317 -179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 15.7 t -97.27 -33.39 11.47 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.437 1.095 . . . . 2.7400000000000002 111.451 164.312 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 38.8 mt -58.81 -35.33 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 124.677 1.191 . . . . 1.6100000000000001 110.015 166.28 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -61.66 -25.04 67.14 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.515 1.126 . . . . 3.8399999999999999 113.829 170.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.491 ' HA ' ' HE2' ' B' ' 57' ' ' LYS . 7.8 t70 -89.93 -32.95 16.6 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 121.021 1.737 . . . . 4.1799999999999997 113.051 173.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -52.0 -41.72 62.41 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 118.646 -0.693 . . . . 2.5600000000000001 109.42 158.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -53.49 52.56 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 120.139 1.336 . . . . 2.1400000000000001 111.55 175.389 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 57' ' ' LYS . . . . . 0.491 ' HE2' ' HA ' ' B' ' 54' ' ' ASP . 30.0 mtmm -51.1 -44.1 61.21 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 118.988 0.813 . . . . 3.7000000000000002 112.9 176.119 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 38.9 m -76.06 -40.39 53.37 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.895 1.278 . . . . 2.02 113.279 -176.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 9.6 mp -71.36 -35.8 71.26 Favored 'General case' 0 C--O 1.225 -0.194 0 O-C-N 120.959 -1.088 . . . . 2.3399999999999999 111.808 178.616 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -100.11 98.49 9.2 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 119.612 1.096 . . . . 1.4299999999999999 113.897 -163.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -98.14 -14.8 20.22 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.933 1.693 . . . . 3.27 115.278 -176.145 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.88 -21.27 60.15 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 119.448 1.022 . . . . 2.5800000000000001 110.303 152.523 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 50.6 m 60.78 66.69 0.89 Allowed 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.04 1.736 . . . . 4.3399999999999999 111.165 168.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -147.3 -116.49 0.07 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.665 1.586 . . . . 3.5600000000000001 109.5 -148.124 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -149.74 -5.18 0.36 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 116.57 2.063 . . . . 4.54 116.57 169.168 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -115.37 139.13 50.27 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.89 1.276 . . . . 2.46 111.527 167.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 8.0 mm -94.27 110.78 24.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 126.24 1.816 . . . . 1.1699999999999999 109.858 172.255 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -58.22 156.26 10.1 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.593 1.157 . . . . 3.3999999999999999 110.705 166.38 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.99 -39.52 66.1 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.164 -1.585 . . . . 2.3500000000000001 111.525 169.263 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -76.59 -18.07 58.84 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.751 1.389 . . . . 3.8799999999999999 114.751 178.095 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -73.97 -50.33 20.46 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 108.322 -0.992 . . . . 1.8799999999999999 108.322 163.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -61.1 -26.28 67.56 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 128.814 2.845 . . . . 1.96 115.338 -177.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 68.6 m -47.91 -34.55 9.17 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 120.851 -1.156 . . . . 2.21 113.441 172.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 6.6 m -69.22 -22.45 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 O-C-N 121.208 -0.933 . . . . 2.6400000000000001 113.155 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -64.97 -59.54 4.05 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.101 0.96 . . . . 1.8100000000000001 110.031 175.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 58.6 mt -55.19 -37.65 67.34 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.792 0.837 . . . . 1.52 110.839 176.075 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 30.8 m -57.95 -61.84 2.25 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.619 1.168 . . . . 0.91000000000000003 111.677 173.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 24.3 ptp -68.08 -32.21 72.37 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 118.949 0.795 . . . . 1.8300000000000001 112.848 -174.714 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -46.02 81.22 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.923 0.889 . . . . 3.25 110.529 175.027 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.6 t -69.9 -27.67 64.98 Favored 'General case' 0 CA--C 1.545 0.786 0 O-C-N 121.736 -0.602 . . . . 2.1200000000000001 112.5 175.389 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 61.6 mtp -67.19 -40.38 86.53 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.837 -1.164 . . . . 1.96 112.768 168.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.81 -37.3 78.76 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.566 1.076 . . . . 0.77000000000000002 111.397 172.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 5.0 m-30 -65.7 -24.16 66.93 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.955 1.094 . . . . 2.1899999999999999 113.955 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -70.28 -41.3 73.59 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 119.82 1.191 . . . . 2.2400000000000002 111.866 174.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -65.61 -44.56 86.19 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.375 1.07 . . . . 3.3199999999999998 110.519 176.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.82 -47.05 77.88 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.14 1.776 . . . . 2.0600000000000001 111.884 174.037 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -63.66 -21.37 66.34 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.192 1.397 . . . . 2.6099999999999999 112.382 175.415 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 85.5 mt -88.27 -7.19 57.16 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 114.305 1.224 . . . . 1.79 114.305 176.156 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -70.18 -35.2 73.79 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.171 0.896 . . . . 5.1399999999999997 111.779 161.743 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -100.75 -65.34 0.97 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.538 1.935 . . . . 3.54 112.681 -168.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -79.91 34.36 0.29 Allowed 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 125.594 1.558 . . . . 3.9100000000000001 112.501 175.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.875 0 C-N-CA 131.521 3.928 . . . . 7.1699999999999999 117.518 -172.53 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 . . . . . 0 CA--C 1.537 0.445 0 N-CA-C 108.633 -0.877 . . . . 3.75 108.633 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.433 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 1.2 p -153.26 179.61 1.25 Allowed Pre-proline 0 N--CA 1.478 0.965 0 C-N-CA 127.03 2.132 . . . . 1.46 109.123 169.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.433 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 95.0 Cg_endo -76.9 -9.31 18.12 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 121.471 1.447 . . . . 1.47 113.7 171.772 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -76.92 -49.63 15.15 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.022 1.329 . . . . 2.71 112.67 -178.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -56.66 -34.96 67.86 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.574 1.079 . . . . 4.5 110.876 169.131 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.7 mtpm? -73.24 -26.65 61.21 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.575 -1.328 . . . . 4.71 113.415 173.553 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.0 -49.99 39.11 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.756 1.222 . . . . 1.21 109.921 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.3 mt -56.16 -45.49 79.65 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.319 1.048 . . . . 1.8500000000000001 111.258 171.77 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.4 m -54.42 -53.34 55.48 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.091 0.956 . . . . 1.77 111.736 171.583 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 t -67.39 -32.76 73.9 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 120.094 1.315 . . . . 2.2200000000000002 112.172 -178.118 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 95.4 mtp -59.0 -51.65 69.16 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.412 1.085 . . . . 2.8900000000000001 112.452 169.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.2 m -68.82 -28.55 40.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 CA-C-N 119.153 0.888 . . . . 2.1800000000000002 112.745 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 90.9 m -60.84 -57.02 14.41 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.88 1.272 . . . . 0.85999999999999999 110.089 173.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -57.94 -40.06 79.59 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 122.789 0.436 . . . . 2.21 110.736 172.475 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -64.14 -47.86 78.29 Favored 'General case' 0 C--N 1.334 -0.077 0 C-N-CA 119.901 -0.719 . . . . 1.97 112.078 -171.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -40.67 74.57 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.881 1.218 . . . . 2.8100000000000001 111.759 178.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -58.37 -47.33 84.17 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.684 1.993 . . . . 3.73 113.427 178.03 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -70.78 -37.38 73.33 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.827 0.851 . . . . 2.3900000000000001 112.481 168.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.3 m -64.22 -20.59 66.13 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.816 -1.178 . . . . 2.27 113.771 178.187 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -98.33 40.35 2.51 Favored Glycine 0 CA--C 1.533 1.186 0 C-N-CA 127.501 2.477 . . . . 1.99 113.11 171.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.1 mmp_? -105.08 -17.89 14.34 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.275 1.03 . . . . 4.96 113.169 167.261 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -175.03 172.41 2.84 Favored 'General case' 0 C--O 1.248 0.984 0 C-N-CA 127.172 2.189 . . . . 4.7000000000000002 110.737 -173.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.57 -135.48 50.57 Favored Glycine 0 C--N 1.337 0.629 0 C-N-CA 124.915 1.245 . . . . 1.97 111.726 171.598 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.1 m -84.89 164.46 18.38 Favored 'General case' 0 C--O 1.246 0.872 0 CA-C-O 121.494 0.664 . . . . 2.54 112.079 163.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -84.64 156.31 21.6 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.18 0.992 . . . . 4.9299999999999997 110.224 157.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.2 tp 73.15 -2.74 2.64 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.745 2.018 . . . . 3.9300000000000002 112.392 -159.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 61.3 p -138.89 150.41 45.93 Favored 'General case' 0 C--O 1.253 1.272 0 C-N-CA 125.342 1.457 . . . . 0.95999999999999996 113.798 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.1 mt -114.87 109.79 18.68 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.711 2.004 . . . . 1.5600000000000001 111.631 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.9 t -84.42 173.76 10.63 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.042 1.337 . . . . 2.3199999999999998 112.042 167.535 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -51.36 -41.72 60.83 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 114.724 1.379 . . . . 3.8900000000000001 114.724 -163.093 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.42 ' HZ2' ' HB2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -82.68 -28.94 30.27 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 120.332 1.424 . . . . 3.7400000000000002 113.414 178.545 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -56.45 -46.09 80.5 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.281 0.946 . . . . 1.7 109.81 166.267 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -73.09 -41.86 63.61 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.124 0.97 . . . . 2.3300000000000001 111.016 -173.575 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.74 -41.16 77.04 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.253 -0.905 . . . . 6.4400000000000004 113.28 167.488 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -70.61 -31.43 68.41 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.943 0.72 . . . . 3.2599999999999998 112.943 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 tt -64.75 -63.48 1.11 Allowed 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.47 -0.937 . . . . 2.23 108.47 174.637 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.7 mt -56.28 -56.72 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-N 119.044 0.838 . . . . 1.05 112.305 -172.003 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 mmmm -79.26 4.22 15.67 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.496 1.295 . . . . 5.0599999999999996 114.496 -171.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -112.37 -36.5 5.26 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 117.718 -1.134 . . . . 3.21 113.656 166.075 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -66.27 -34.15 77.35 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.104 1.361 . . . . 3.9399999999999999 112.81 172.375 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -105.82 108.72 20.38 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 107.974 -1.121 . . . . 2.3999999999999999 107.974 168.008 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 28.2 p -80.13 51.99 1.47 Allowed 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.101 0.96 . . . . 4.7699999999999996 113.227 -178.32 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.5 mp -111.11 153.51 25.59 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.773 2.029 . . . . 4.54 112.722 -170.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -82.91 -17.95 66.44 Favored Glycine 0 CA--C 1.536 1.355 0 O-C-N 121.219 -0.926 . . . . 3.8199999999999998 112.59 166.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -79.34 -157.18 0.12 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 129.561 3.144 . . . . 5.9000000000000004 111.024 178.672 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.8 tpt 55.86 22.01 5.29 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 123.494 1.616 . . . . 3.1400000000000001 113.589 -178.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.6 tttm -72.03 154.44 41.13 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 113.732 -1.576 . . . . 5.6699999999999999 114.136 -141.051 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.7 mp0 -66.02 -22.17 66.43 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 116.058 1.873 . . . . 5.5999999999999996 116.058 -134.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.7 t -67.09 -15.23 63.59 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.3 -1.5 . . . . 2.4700000000000002 113.783 171.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.7 t -82.98 -12.23 57.46 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.667 1.187 . . . . 2.9199999999999999 113.4 170.451 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 18.0 mm -74.87 -35.05 34.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 124.568 1.147 . . . . 1.6899999999999999 110.924 -176.302 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.92 -33.23 75.23 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.661 1.584 . . . . 3.0600000000000001 110.899 176.747 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -75.23 -47.39 28.35 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-O 118.397 -0.811 . . . . 2.4199999999999999 111.79 165.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.23 -45.12 68.58 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.581 1.082 . . . . 2.3900000000000001 110.87 -172.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.6 ppp? -62.88 -48.67 77.97 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 122.149 -0.344 . . . . 2.29 111.701 175.729 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -18.95 47.81 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.406 2.282 . . . . 4.0499999999999998 114.342 173.29 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.9 m -94.98 -27.63 15.55 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 127.411 2.284 . . . . 3.1699999999999999 112.934 177.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 96.9 mt -76.91 -33.46 57.75 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.366 1.066 . . . . 1.9199999999999999 112.002 165.27 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -73.35 68.65 1.09 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.985 2.114 . . . . 1.78 112.582 -173.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.1 tttt -54.29 -23.84 16.68 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 127.97 2.508 . . . . 4.5899999999999999 114.009 -175.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -85.06 -23.13 28.69 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.472 1.286 . . . . 2.4100000000000001 114.472 173.057 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.3 t 57.73 63.75 1.73 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.043 1.337 . . . . 2.54 112.432 -167.594 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -120.12 -108.75 0.35 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.427 2.291 . . . . 2.7400000000000002 109.338 -172.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -142.45 -19.9 0.69 Allowed 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 115.231 1.567 . . . . 6.04 115.231 167.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -132.7 145.5 51.1 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 122.599 1.19 . . . . 2.4700000000000002 110.815 -169.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 8.8 mm -86.88 113.48 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 125.713 1.605 . . . . 1.27 107.666 174.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.34 174.12 11.92 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.767 0.827 . . . . 3.0899999999999999 111.702 167.694 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -54.5 -38.24 66.25 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-O 122.564 1.173 . . . . 2.2599999999999998 112.163 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -78.45 -22.06 48.17 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.107 2.163 . . . . 3.1200000000000001 113.577 -173.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -79.01 -54.11 6.35 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.213 1.805 . . . . 1.72 109.005 161.585 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -53.7 -37.72 63.55 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 128.122 2.569 . . . . 2.4399999999999999 115.005 -173.455 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -20.23 56.7 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 120.988 -1.07 . . . . 2.02 113.755 174.555 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 53.3 t -70.13 -28.24 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 120.875 -1.141 . . . . 1.79 110.973 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -64.58 -53.56 45.93 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.369 -0.832 . . . . 1.98 110.928 171.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -54.64 -45.79 73.84 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.427 1.091 . . . . 2.1200000000000001 110.548 177.425 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 88.1 m -53.6 -49.28 68.12 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.373 1.069 . . . . 0.81000000000000005 112.263 176.397 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 50.4 mtm -62.18 -47.48 84.29 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 118.684 0.675 . . . . 1.3700000000000001 112.596 178.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.8 mt -65.56 -36.75 84.7 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.737 -0.602 . . . . 1.5800000000000001 112.125 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 4.3 t -68.44 -32.34 72.3 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 118.467 -0.777 . . . . 1.3200000000000001 112.477 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -47.72 85.12 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 118.855 0.752 . . . . 3.6899999999999999 110.921 171.185 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.26 -38.02 89.04 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.196 0.907 . . . . 1.6899999999999999 113.086 -175.316 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -68.68 -29.93 68.5 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.134 0.79 . . . . 2.6699999999999999 113.134 174.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -73.79 -44.27 56.45 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.943 0.792 . . . . 2.3799999999999999 111.669 171.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -72.44 -16.7 61.82 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.435 1.094 . . . . 4.4900000000000002 111.664 -173.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -50.91 -57.83 7.52 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.624 1.97 . . . . 3.1200000000000001 111.682 166.037 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -55.18 -28.9 56.22 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.973 0.909 . . . . 3.79 112.584 176.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 71.6 mt -83.39 -18.47 38.69 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.782 0.833 . . . . 1.96 111.324 -172.435 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -90.4 -15.32 31.22 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.905 1.446 . . . . 3.7999999999999998 114.905 164.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 . . . . . 0 CA--C 1.55 0.963 0 C-N-CA 124.607 1.163 . . . . 3.4700000000000002 111.818 163.573 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 71.6 p . . . . . 0 N--CA 1.476 0.854 0 CA-C-O 119.692 -0.194 . . . . 1.8999999999999999 111.52 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -62.46 -20.06 69.36 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.005 1.803 . . . . 1.3 112.738 174.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -83.13 -41.72 18.19 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.736 1.215 . . . . 3.2999999999999998 111.949 174.511 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -58.29 -31.88 67.9 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.606 1.094 . . . . 3.6099999999999999 110.923 164.692 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.81 -30.46 62.73 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.106 -1.621 . . . . 4.0800000000000001 112.921 172.43 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.16 -43.35 92.08 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.206 -0.934 . . . . 1.0 111.027 168.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 81.6 mt -61.36 -44.77 96.6 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.429 1.091 . . . . 1.54 111.84 169.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 85.7 m -53.43 -47.2 69.84 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.73 1.212 . . . . 2.1600000000000001 110.543 174.004 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 27.3 m -59.42 -52.5 65.36 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.041 0.937 . . . . 1.5800000000000001 109.326 174.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 4.3 tpp -50.13 -53.56 26.71 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.943 1.697 . . . . 3.2799999999999998 112.299 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 21.2 m -70.99 -21.27 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 112.706 0.632 . . . . 2.4500000000000002 112.706 -175.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 61.5 m -83.42 -45.29 13.84 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.034 1.333 . . . . 0.84999999999999998 111.283 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -54.61 -41.08 69.52 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.497 -0.557 . . . . 1.6499999999999999 109.497 164.204 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -71.75 -35.22 70.05 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 120.326 -0.55 . . . . 2.1800000000000002 111.662 -176.71 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -64.42 -51.12 64.74 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 120.444 -1.41 . . . . 2.6699999999999999 112.095 170.82 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -55.93 -51.84 66.23 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.924 0.889 . . . . 6.3600000000000003 111.788 177.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.476 ' CD2' HD13 ' B' ' 37' ' ' LEU . 56.1 m-85 -83.43 -34.99 25.35 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 117.372 -1.299 . . . . 1.9399999999999999 112.504 -172.257 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 60.2 p -68.39 -28.68 67.31 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 121.351 1.887 . . . . 1.6699999999999999 111.733 174.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.27 17.37 5.08 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 125.81 1.671 . . . . 1.7 114.516 170.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 5.6 mmp_? -92.45 62.88 4.03 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 120.372 2.086 . . . . 6.6100000000000003 109.608 166.553 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 71.2 -177.91 0.21 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.195 1.398 . . . . 4.3300000000000001 112.123 -175.321 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.72 -146.0 50.14 Favored Glycine 0 CA--C 1.53 0.988 0 N-CA-C 109.829 -1.309 . . . . 2.1699999999999999 109.829 -156.272 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 73.3 m -78.67 153.97 30.54 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.277 -1.131 . . . . 3.5099999999999998 111.405 161.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 15.4 ttpt -68.24 55.81 0.07 Allowed 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 125.344 1.458 . . . . 7.7699999999999996 111.153 160.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -170.88 -31.99 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 126.42 1.888 . . . . 3.2999999999999998 111.658 -165.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 20.7 p -119.34 151.58 38.22 Favored 'General case' 0 C--O 1.242 0.694 0 C-N-CA 125.764 1.626 . . . . 1.0800000000000001 113.422 -175.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 87.4 mt -114.53 119.44 36.82 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.274 2.23 . . . . 1.77 112.243 178.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 4.8 t -104.18 179.22 4.34 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 113.506 0.928 . . . . 2.98 113.506 162.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 31.0 ttp180 -56.16 -36.02 67.84 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.71 1.744 . . . . 4.0800000000000001 115.71 -161.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -29.04 64.0 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 120.457 -1.402 . . . . 5.4800000000000004 113.452 173.546 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -72.22 -51.68 19.93 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 108.006 -1.109 . . . . 2.1000000000000001 108.006 177.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 mt -67.71 -33.15 74.33 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-O 117.475 -1.25 . . . . 2.5 113.884 176.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.7 ttmt -53.13 -48.63 67.75 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 120.816 1.644 . . . . 3.46 111.788 170.05 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -66.38 -45.54 79.7 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.378 0.881 . . . . 3.8599999999999999 113.378 176.138 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 37' ' ' LEU . . . . . 0.476 HD13 ' CD2' ' B' ' 19' ' ' TYR . 55.1 tp -74.05 -45.24 50.72 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 117.682 -1.152 . . . . 2.04 112.572 -175.837 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 28.6 mt -57.25 -52.43 56.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 CA-C-N 121.041 1.746 . . . . 1.3700000000000001 107.999 176.235 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . 0.344 0.0 OUTLIER -70.49 8.46 0.82 Allowed 'General case' 0 CA--C 1.558 1.268 0 CA-C-O 122.022 0.915 . . . . 5.4900000000000002 113.106 -178.91 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 10.1 mmtm -118.99 -29.6 5.23 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 127.158 2.183 . . . . 5.8200000000000003 115.696 170.546 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -67.86 -29.73 68.94 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.964 1.256 . . . . 5.6100000000000003 109.706 160.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.451 HD21 HD11 ' B' ' 79' ' ' LEU . 3.7 mm? -111.49 63.86 0.62 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 126.391 1.877 . . . . 2.6400000000000001 109.015 170.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.9 t -62.72 -33.69 75.64 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 120.443 -1.411 . . . . 3.3999999999999999 111.945 -178.058 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.421 HD23 ' H ' ' B' ' 44' ' ' LEU . 1.8 pt? -90.49 -5.0 56.57 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.022 1.729 . . . . 4.0 114.996 172.227 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -103.79 10.98 52.97 Favored Glycine 0 N--CA 1.475 1.296 0 CA-C-O 118.401 -1.222 . . . . 3.4300000000000002 115.915 -162.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 70.87 -83.52 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.339 1.855 . . . . 5.6299999999999999 112.663 169.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 1.1 mmt 70.71 87.91 0.11 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 128.455 2.702 . . . . 3.3599999999999999 113.309 -168.19 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 mttp -61.59 133.61 55.85 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.655 -1.278 . . . . 3.5899999999999999 110.951 166.452 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -36.06 -56.89 0.72 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 127.12 2.168 . . . . 3.7999999999999998 114.998 -177.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 29.3 t -67.28 -15.01 63.44 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.389 1.255 . . . . 3.4100000000000001 114.389 -176.566 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 10.5 t -85.43 -12.51 51.82 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.405 1.002 . . . . 2.3100000000000001 112.796 171.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 71.3 mt -77.74 -37.53 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 CA-C-N 119.316 0.962 . . . . 2.7599999999999998 109.871 179.818 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -70.79 -39.93 72.85 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.718 1.207 . . . . 2.9100000000000001 113.108 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -68.77 -40.25 79.8 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 118.489 0.586 . . . . 2.9900000000000002 111.4 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 25.4 tp -59.23 -48.42 81.68 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 117.429 -1.272 . . . . 1.8999999999999999 110.437 172.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 58.0 mmm -50.18 -48.83 53.86 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 120.158 1.344 . . . . 2.29 111.823 173.053 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -16.82 48.83 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.107 1.763 . . . . 4.2800000000000002 113.994 175.87 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.13 -31.9 12.23 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.399 1.48 . . . . 2.2599999999999998 113.659 171.513 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 59' ' ' LEU . . . . . 0.453 HD22 ' HB2' ' B' ' 75' ' ' PHE . 13.1 mt -76.21 -24.13 54.65 Favored 'General case' 0 N--CA 1.463 0.186 0 O-C-N 120.933 -1.104 . . . . 1.99 111.56 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -94.04 149.05 21.58 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.504 1.122 . . . . 1.98 113.664 168.457 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -99.78 -11.76 20.53 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.734 1.614 . . . . 3.6800000000000002 113.169 172.439 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.63 -62.79 1.53 Allowed 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.342 0.868 . . . . 1.8200000000000001 113.342 -157.67 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 58.6 m 109.98 12.57 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.116 1 C-N-CA 132.332 4.253 . . . . 2.77 111.667 -157.146 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 48.0 p-10 -83.82 8.18 15.62 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 119.377 -2.077 . . . . 2.71 112.289 -165.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 55.18 2.05 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 130.564 3.546 . . . . 4.1699999999999999 115.923 -166.588 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -131.88 121.14 23.57 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 125.499 1.52 . . . . 2.8100000000000001 111.342 -168.581 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 2.8 mp -93.06 103.84 15.1 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.398 1.479 . . . . 1.8500000000000001 107.736 177.074 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.24 160.18 32.65 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.268 1.427 . . . . 3.3599999999999999 111.517 169.51 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -47.69 -46.93 29.89 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.579 1.551 . . . . 2.2599999999999998 112.512 -179.443 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -69.2 -17.45 63.8 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.817 0.847 . . . . 4.8099999999999996 112.776 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -84.44 -51.96 6.53 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.592 1.157 . . . . 1.9199999999999999 109.966 170.661 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -53.13 -25.81 14.54 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.89 2.476 . . . . 1.75 114.14 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.27 -20.17 65.22 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.776 -1.202 . . . . 2.5099999999999998 111.426 177.53 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.3 p -70.45 -31.32 46.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 O-C-N 120.79 -1.194 . . . . 2.0699999999999998 112.252 172.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 75' ' ' PHE . . . . . 0.453 ' HB2' HD22 ' B' ' 59' ' ' LEU . 10.7 t80 -63.36 -56.16 18.61 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 108.682 -0.858 . . . . 1.8100000000000001 108.682 174.828 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 96.2 mt -53.88 -39.56 65.81 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.832 1.253 . . . . 1.4099999999999999 112.385 175.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 97.8 m -62.16 -53.58 53.28 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.294 1.038 . . . . 0.94999999999999996 111.862 176.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 19.7 ptp -68.82 -32.87 72.88 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 118.604 0.638 . . . . 1.8500000000000001 112.64 -177.369 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.451 HD11 HD21 ' B' ' 42' ' ' LEU . 2.0 mm? -65.64 -49.69 67.77 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.043 0.937 . . . . 2.4300000000000002 112.277 170.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 12.8 t -65.45 -32.0 73.38 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.035 0.383 . . . . 1.6599999999999999 112.035 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -45.9 92.84 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.837 0.744 . . . . 2.6000000000000001 112.255 167.034 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.02 -40.73 94.68 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.176 0.898 . . . . 0.80000000000000004 111.89 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -60.95 -24.8 66.35 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.431 1.271 . . . . 2.04 114.431 176.357 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -70.03 -42.55 72.8 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.636 1.107 . . . . 1.98 111.909 174.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -69.8 -41.3 75.23 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.959 0.904 . . . . 3.02 110.315 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -51.45 -53.09 40.62 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.581 1.552 . . . . 2.3100000000000001 110.9 169.489 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -61.96 -24.25 66.89 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.54 1.536 . . . . 2.9399999999999999 113.705 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 47.0 mt -79.7 -23.44 42.4 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.529 -1.357 . . . . 1.8600000000000001 112.456 174.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -94.55 -6.69 43.09 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.74 1.385 . . . . 4.04 114.74 170.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -86.38 -37.57 18.28 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 127.35 2.26 . . . . 3.7400000000000002 113.488 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 28.8 m-20 -82.33 49.55 1.45 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.193 1.797 . . . . 3.8399999999999999 113.244 -167.537 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? . . . . . 0 C--O 1.252 1.219 0 C-N-CA 128.095 2.558 . . . . 7.71 114.334 178.06 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 . . . . . 0 CA--C 1.54 0.594 0 N-CA-C 112.821 0.674 . . . . 3.75 112.821 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 66.2 p -153.17 162.43 26.47 Favored Pre-proline 0 N--CA 1.472 0.665 0 C-N-CA 124.893 1.277 . . . . 1.8500000000000001 111.61 -161.551 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -64.5 -11.75 30.06 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 122.426 2.084 . . . . 1.6000000000000001 113.128 166.015 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.91 -38.05 15.94 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.104 1.362 . . . . 2.5800000000000001 111.471 178.29 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -55.44 -50.5 69.67 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 108.961 -0.755 . . . . 4.8499999999999996 108.961 159.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.428 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -59.18 -31.08 68.68 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.665 -0.647 . . . . 3.7599999999999998 112.6 177.063 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.34 -53.69 39.95 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.429 0.692 . . . . 1.21 110.861 172.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 44.8 mt -54.77 -44.75 73.95 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.058 0.943 . . . . 1.95 112.234 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.8 p -69.37 -36.87 77.25 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 117.844 -1.074 . . . . 2.2599999999999998 112.447 176.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.4 m -62.32 -39.92 94.62 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 120.292 1.405 . . . . 1.3500000000000001 111.564 171.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 72.8 mtp -60.59 -51.92 67.37 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.067 0.947 . . . . 3.21 112.173 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.3 p -63.46 -34.37 67.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 CA-C-N 118.692 0.678 . . . . 2.52 111.506 173.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 85.3 m -61.74 -53.71 52.31 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 117.923 -1.037 . . . . 0.81999999999999995 111.067 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.5 p -55.97 -43.29 77.43 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.036 0.835 . . . . 2.23 109.559 172.657 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -64.64 -54.63 28.84 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.302 0.376 . . . . 1.98 111.51 -169.549 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.7 -32.65 73.45 Favored 'General case' 0 CA--C 1.548 0.869 0 O-C-N 121.544 -0.723 . . . . 2.5099999999999998 111.831 179.221 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -76.81 -12.87 60.04 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.453 1.279 . . . . 4.1699999999999999 114.453 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -92.43 -33.24 14.61 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 119.527 1.058 . . . . 2.46 112.56 155.424 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.8 p -42.76 -48.3 5.6 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 117.389 2.366 . . . . 3.7799999999999998 117.389 -163.077 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -88.01 4.82 85.49 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 125.393 1.473 . . . . 1.95 114.319 -173.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 35.3 mtp180 -92.6 50.26 1.57 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.663 1.232 . . . . 5.5 108.957 175.26 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 115.34 151.76 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.877 1 C-N-CA 131.832 4.053 . . . . 4.4000000000000004 111.455 -177.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.86 -159.99 48.51 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 120.752 -1.218 . . . . 2.27 113.391 -179.603 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.4 t -75.22 161.91 28.93 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.885 -0.773 . . . . 3.77 111.981 172.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.0 mmtp -49.96 -24.92 2.84 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.279 1.432 . . . . 4.7199999999999998 112.404 155.356 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 18.9 tp -93.47 -13.64 27.65 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 117.35 -1.309 . . . . 3.8500000000000001 114.095 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 53.7 p -128.04 145.04 51.11 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-N 120.714 1.597 . . . . 0.96999999999999997 114.983 -168.012 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.8 mt -101.19 120.44 40.23 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.772 1.629 . . . . 1.5800000000000001 111.876 170.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.4 p -78.37 171.81 14.53 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.961 1.467 . . . . 2.9700000000000002 114.961 -177.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -45.43 -27.6 0.73 Allowed 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 115.021 1.489 . . . . 3.3700000000000001 115.021 167.367 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.93 -38.97 6.43 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.863 1.265 . . . . 3.8599999999999999 113.148 -178.593 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -67.63 -30.06 69.53 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.062 1.345 . . . . 2.1899999999999999 111.584 175.5 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.2 tp -75.33 -47.97 25.3 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.097 0.959 . . . . 1.8700000000000001 112.417 173.484 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -15.2 57.59 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.95 1.463 . . . . 4.79 114.95 -172.639 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -94.87 -39.23 10.34 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.951 1.093 . . . . 4.6299999999999999 113.951 175.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 39.6 tp -58.33 -50.78 72.43 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.469 1.031 . . . . 2.3599999999999999 111.558 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.1 mt -52.51 -57.09 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-O 121.628 0.728 . . . . 0.98999999999999999 109.081 175.555 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.404 ' HE2' ' OE1' ' A' ' 49' ' ' GLU . 25.9 ttpp -67.11 -8.3 29.71 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.254 1.205 . . . . 3.8399999999999999 114.254 -176.298 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.9 mmtm -95.27 -33.43 12.57 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 125.358 1.463 . . . . 3.7999999999999998 112.212 172.745 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -68.61 -66.96 0.51 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.086 1.754 . . . . 4.9500000000000002 110.045 169.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -70.52 22.54 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 126.667 1.987 . . . . 2.8300000000000001 113.667 176.417 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 12.9 t -67.36 2.27 1.78 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.708 2.003 . . . . 3.29 113.951 177.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -68.96 -10.99 60.23 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.638 0.775 . . . . 4.79 112.639 167.311 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 145.38 13.08 0.22 Allowed Glycine 0 CA--C 1.528 0.889 0 CA-C-O 117.909 -1.495 . . . . 3.5699999999999998 116.709 169.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -124.49 -175.13 3.18 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.674 1.737 . . . . 4.71 113.282 -176.116 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 63.35 33.84 13.59 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-O 123.552 1.644 . . . . 2.3300000000000001 113.686 169.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.409 ' H ' ' HD2' ' A' ' 48' ' ' LYS . 2.7 mptt -59.77 151.75 24.61 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 113.359 -1.746 . . . . 5.0999999999999996 110.429 166.414 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.404 ' OE1' ' HE2' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -44.31 -44.12 7.9 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.941 1.46 . . . . 4.3799999999999999 114.941 -165.93 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.0 t -63.73 -15.57 58.89 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 115.061 1.504 . . . . 2.96 115.061 -178.294 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 43.4 m -90.02 -7.8 53.08 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.371 0.987 . . . . 2.1299999999999999 113.091 172.36 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 45.2 mt -88.25 -35.75 8.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 117.745 -1.122 . . . . 1.5700000000000001 113.326 -166.403 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.87 -25.75 64.78 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.427 1.467 . . . . 2.6699999999999999 113.197 -176.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.55 -44.09 71.61 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.899 0.772 . . . . 3.3999999999999999 111.169 164.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 tp -62.54 -43.49 98.68 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 118.611 -0.709 . . . . 2.1099999999999999 109.922 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.5 tpt -53.93 -53.96 45.49 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 125.914 1.686 . . . . 1.49 110.791 170.764 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.83 -35.67 64.19 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.008 1.323 . . . . 4.2699999999999996 113.147 176.094 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 61.3 m -86.69 -33.3 20.09 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 126.15 1.78 . . . . 1.99 111.964 -173.674 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.555 HD11 ' HB2' ' A' ' 75' ' ' PHE . 1.8 mm? -69.57 -42.78 74.07 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 126.776 2.03 . . . . 2.5 112.015 169.45 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -74.72 63.09 1.11 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 123.384 1.564 . . . . 1.51 110.77 -176.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -69.84 -4.95 22.5 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.83 1.252 . . . . 5.5099999999999998 113.427 -164.692 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -110.5 -5.69 15.08 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.85 2.46 . . . . 2.4900000000000002 113.785 171.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 37.7 t 58.69 64.55 1.41 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.074 1.35 . . . . 2.73 112.797 172.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -115.07 -88.97 0.56 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.384 1.473 . . . . 2.8100000000000001 108.67 176.762 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -173.19 -26.32 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.746 2.419 . . . . 6.1799999999999997 114.724 -176.076 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -124.78 163.22 22.6 Favored 'General case' 0 C--O 1.243 0.729 0 CA-C-O 123.249 1.5 . . . . 3.1000000000000001 111.944 175.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.6 mm -104.95 100.08 9.8 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.882 2.473 . . . . 1.03 110.401 -178.499 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -66.16 163.13 18.31 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.538 0.735 . . . . 3.7999999999999998 111.636 167.516 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -47.13 -42.32 19.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.603 0.761 . . . . 2.1000000000000001 112.882 -178.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 -30.39 67.03 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 120.895 -1.128 . . . . 7.7400000000000002 112.649 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -68.3 -54.36 18.02 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 107.855 -1.165 . . . . 1.96 107.855 171.32 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -51.2 -37.34 46.13 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.864 2.066 . . . . 2.5499999999999998 114.401 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.0 p -66.17 -14.89 62.6 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 120.307 -1.496 . . . . 1.6399999999999999 114.647 173.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 44.7 t -71.82 -33.02 46.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 CA-C-N 120.441 1.473 . . . . 2.1400000000000001 111.212 171.61 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.555 ' HB2' HD11 ' A' ' 59' ' ' LEU . 19.4 t80 -56.32 -54.72 42.09 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.466 1.03 . . . . 1.74 110.637 172.276 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 67.0 mt -64.07 -30.49 71.56 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.165 0.986 . . . . 1.8700000000000001 111.864 -178.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 15.3 m -68.13 -50.98 51.22 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.284 0.947 . . . . 0.87 111.942 170.602 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 65.3 mtp -51.87 -48.01 64.23 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.182 0.901 . . . . 1.8600000000000001 111.088 177.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 99.6 mt -65.45 -48.68 71.88 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.086 0.955 . . . . 1.22 112.599 176.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 34.6 t -64.84 -33.04 75.06 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.352 0.978 . . . . 1.8400000000000001 113.213 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 88.7 mtp -63.39 -46.59 85.73 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 118.687 0.676 . . . . 1.76 110.813 168.495 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.94 -42.94 97.18 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.626 0.602 . . . . 1.1100000000000001 112.626 -178.324 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -65.39 -25.71 67.68 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.574 -0.704 . . . . 2.7200000000000002 112.346 178.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -69.56 -37.21 76.94 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.103 0.865 . . . . 3.2200000000000002 112.351 173.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -70.65 -47.46 59.88 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.979 1.312 . . . . 2.8100000000000001 110.703 172.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -52.41 -47.42 66.32 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 126.09 1.756 . . . . 2.8999999999999999 110.98 177.408 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -53.53 -33.1 53.32 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.504 1.522 . . . . 2.5600000000000001 113.045 177.284 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 24.7 mt -81.86 -20.73 38.31 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.99 0.916 . . . . 1.5800000000000001 112.506 -177.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -96.5 -7.85 33.61 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.641 1.348 . . . . 2.9399999999999999 114.641 172.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 23.7 t70 . . . . . 0 CA--C 1.538 0.496 0 C-N-CA 126.89 2.076 . . . . 3.71 112.686 -174.081 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 3' ' ' THR . . . . . 0.4 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 1.2 p . . . . . 0 N--CA 1.483 1.213 0 CA-C-O 118.77 -0.633 . . . . 1.97 109.769 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 4' ' ' PRO . . . . . 0.4 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 92.1 Cg_endo -81.8 -15.04 9.73 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 121.759 1.639 . . . . 1.8200000000000001 113.139 166.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.26 -39.31 68.49 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.604 1.093 . . . . 2.48 111.967 -174.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -50.69 -55.46 16.42 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.604 0.762 . . . . 5.1200000000000001 110.522 167.496 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 43.4 mttm -67.54 -19.23 65.26 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.221 -0.924 . . . . 3.7799999999999998 112.365 -176.004 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.59 -43.17 39.83 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.018 1.327 . . . . 0.87 111.891 171.495 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 56.7 mt -61.47 -44.62 96.78 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.177 1.391 . . . . 1.51 111.69 169.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 88.2 m -58.26 -48.99 78.7 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.542 1.537 . . . . 1.27 110.445 171.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 23.2 m -54.92 -49.96 70.0 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 119.539 1.063 . . . . 1.3 110.897 175.36 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 14.9 mmm -50.68 -51.46 49.18 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.684 1.194 . . . . 2.8300000000000001 112.623 174.007 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 4.0 t -59.31 -40.7 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.848 0.859 . . . . 1.78 112.34 175.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 87.9 m -72.28 -44.12 63.25 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.766 1.627 . . . . 0.90000000000000002 111.753 -173.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 19.2 p -67.74 -44.88 76.53 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 108.913 -0.773 . . . . 1.76 108.913 172.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -63.57 -53.65 48.41 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 123.597 0.561 . . . . 2.3599999999999999 110.518 -173.022 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -66.19 -30.01 70.4 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 112.506 0.558 . . . . 2.5899999999999999 112.506 -178.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 19.4 ttmm -70.91 -47.06 61.22 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 120.868 -1.145 . . . . 4.0999999999999996 112.117 176.004 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -73.18 -32.95 65.14 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.351 -0.843 . . . . 2.21 112.486 176.271 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 53.1 p -68.44 -29.02 67.58 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-N 119.666 1.121 . . . . 1.6299999999999999 113.012 176.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.35 -5.91 84.59 Favored Glycine 0 C--N 1.342 0.88 0 C-N-CA 127.625 2.536 . . . . 1.5 114.756 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -64.48 -41.68 96.33 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.896 1.848 . . . . 3.2799999999999998 111.392 175.198 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -147.93 156.02 42.22 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 123.252 1.501 . . . . 3.48 114.799 -173.484 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.43 -126.79 43.21 Favored Glycine 0 C--N 1.34 0.765 0 C-N-CA 127.156 2.313 . . . . 1.8500000000000001 111.123 171.059 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 2.3 m -54.53 116.31 2.6 Favored 'General case' 0 C--O 1.249 1.035 0 CA-C-O 121.207 0.527 . . . . 4.0899999999999999 109.736 162.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -18.81 60.65 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.445 0.906 . . . . 6.4500000000000002 113.445 -176.061 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.476 ' H ' HD23 ' B' ' 27' ' ' LEU . 2.0 pt? -91.27 -13.71 32.2 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.622 1.569 . . . . 4.2599999999999998 113.58 177.662 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -127.86 162.27 27.09 Favored 'General case' 0 C--O 1.249 1.042 0 N-CA-C 114.226 1.195 . . . . 1.54 114.226 -178.275 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 91.8 mt -107.16 108.51 20.0 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.89 2.476 . . . . 1.72 111.592 -178.055 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 95.9 p -70.72 163.37 27.31 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 121.26 -0.9 . . . . 2.1899999999999999 113.211 164.174 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -42.28 -38.16 1.72 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 125.642 1.577 . . . . 6.3499999999999996 114.545 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.63 -28.0 25.06 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 116.438 2.014 . . . . 4.0999999999999996 116.438 176.263 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -67.53 -48.64 66.41 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 120.103 1.32 . . . . 1.6699999999999999 109.221 166.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 24.6 tp -58.07 -42.95 86.63 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.679 1.191 . . . . 1.8300000000000001 111.827 177.179 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -51.37 -40.79 59.91 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.915 0.886 . . . . 3.5699999999999998 111.885 177.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -64.33 -51.98 60.7 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.948 0.499 . . . . 2.9700000000000002 110.364 177.27 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 29.6 tp -57.65 -55.24 37.35 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 117.067 -1.444 . . . . 2.25 111.0 -178.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 30.7 mt -54.46 -51.44 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-N 120.201 1.364 . . . . 0.98999999999999999 110.469 178.307 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 44.1 tttm -65.89 -18.53 65.4 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.755 1.02 . . . . 4.4299999999999997 113.755 -176.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm -85.78 -59.75 2.22 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.752 1.621 . . . . 3.1600000000000001 110.609 168.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 72.3 tt0 -43.54 -62.52 1.06 Allowed 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 130.97 3.708 . . . . 5.1600000000000001 112.846 -177.129 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -82.22 -37.65 25.69 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.296 1.038 . . . . 3.4300000000000002 111.939 178.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 8.2 t 70.33 -44.44 0.57 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 127.691 2.396 . . . . 3.2400000000000002 114.998 175.106 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -63.31 -4.24 2.46 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 117.351 2.352 . . . . 3.2799999999999998 117.351 -167.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.48 16.55 77.71 Favored Glycine 0 N--CA 1.474 1.215 0 O-C-N 120.812 -1.18 . . . . 3.9300000000000002 115.105 173.389 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -46.05 -71.36 0.08 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 127.45 2.3 . . . . 7.9800000000000004 112.204 176.062 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.84 125.46 26.89 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.944 0.878 . . . . 2.7799999999999998 111.431 173.421 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -87.18 173.88 8.96 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.836 -0.54 . . . . 3.5 109.809 166.388 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.01 -37.5 74.41 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 115.062 1.504 . . . . 3.4700000000000002 115.062 -169.37 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 13.1 t -72.59 -11.15 60.53 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 114.148 1.166 . . . . 2.7400000000000002 114.148 172.258 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 1.7 m -94.17 -31.68 14.04 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.992 1.717 . . . . 2.8700000000000001 111.544 172.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 86.6 mt -65.99 -32.96 60.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.293 0.637 . . . . 1.76 110.718 170.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.0 -66.12 0.56 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.232 1.013 . . . . 3.0800000000000001 111.207 176.575 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.61 -24.64 62.78 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 113.885 1.068 . . . . 3.9199999999999999 113.885 -173.25 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.77 -52.96 63.46 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.52 0.728 . . . . 2.21 109.992 164.409 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -60.89 -49.47 77.34 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.377 1.071 . . . . 1.6499999999999999 111.922 -179.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 24.8 mtpt -57.16 -36.22 70.5 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.44 1.096 . . . . 5.1200000000000001 113.011 173.478 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 52.1 m -75.07 -30.64 61.02 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 120.956 -1.09 . . . . 2.6400000000000001 113.479 177.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 mp -65.34 -52.8 51.41 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 118.031 -0.985 . . . . 2.8799999999999999 110.504 167.108 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -73.93 74.91 1.66 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.322 2.249 . . . . 1.45 114.343 -169.192 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 61' ' ' LYS . . . . . 0.496 ' HZ3' HG11 ' B' ' 74' ' ' VAL . 14.8 mptt -53.96 -27.57 32.12 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 115.113 1.523 . . . . 3.4700000000000002 115.113 -176.542 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -88.25 -15.28 36.29 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.723 1.209 . . . . 1.8799999999999999 113.379 177.529 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 29.4 t 58.17 32.05 21.54 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.473 1.109 . . . . 2.1600000000000001 112.552 -176.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -84.47 -0.24 52.19 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.378 1.471 . . . . 2.3500000000000001 112.02 -175.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 82.3 -0.96 1.42 Allowed 'General case' 0 C--O 1.238 0.477 0 C-N-CA 130.36 3.464 . . . . 4.4800000000000004 113.204 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -126.38 135.21 51.16 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 123.045 1.403 . . . . 2.27 113.106 178.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 21.3 mm -74.58 100.0 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-N 115.016 -0.993 . . . . 1.49 109.232 170.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.35 158.31 31.91 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.293 1.037 . . . . 4.9900000000000002 109.846 169.595 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.57 -35.17 53.36 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 120.517 -1.364 . . . . 2.8599999999999999 113.496 175.92 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.451 ' HD3' ' H ' ' B' ' 70' ' ' LYS . 1.0 OUTLIER -67.18 -25.96 66.4 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.862 0.865 . . . . 5.2599999999999998 112.48 177.45 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -88.03 -40.74 13.6 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.246 1.418 . . . . 2.2799999999999998 110.35 174.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -54.78 -23.67 19.05 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 120.39 -1.444 . . . . 2.1000000000000001 113.059 173.606 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 36.1 t -65.8 -30.61 71.28 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.518 1.527 . . . . 2.3300000000000001 112.989 174.05 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.496 HG11 ' HZ3' ' B' ' 61' ' ' LYS . 0.9 OUTLIER -86.85 -28.57 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.714 0.805 . . . . 2.48 111.544 -176.974 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -58.93 -67.03 0.41 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.945 1.298 . . . . 1.6100000000000001 111.396 179.451 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -59.92 -36.77 77.71 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.452 1.101 . . . . 3.71 112.0 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 31.5 m -51.19 -54.35 26.33 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.664 0.786 . . . . 0.97999999999999998 110.492 173.461 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.4 mtm -58.68 -46.11 87.94 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 118.544 0.611 . . . . 1.5900000000000001 111.593 179.093 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.08 -45.54 94.32 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.147 0.579 . . . . 1.48 112.436 178.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.4 t -72.68 -29.41 63.38 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.328 -0.857 . . . . 2.0800000000000001 113.1 -178.106 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 91.5 mtp -69.9 -39.45 76.2 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 118.79 -0.624 . . . . 2.0499999999999998 110.948 170.533 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.65 -36.16 81.93 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.493 1.042 . . . . 0.85999999999999999 112.524 173.182 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -68.26 -35.43 77.89 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.083 1.142 . . . . 2.5699999999999998 114.083 170.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 17.1 t30 -64.72 -42.38 95.28 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.521 1.055 . . . . 1.74 112.607 171.318 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -73.43 -24.7 60.28 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.11 0.964 . . . . 4.0199999999999996 111.186 -177.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -55.98 26.53 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.492 1.517 . . . . 2.7400000000000002 112.104 160.471 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -57.46 -26.62 61.51 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.862 1.665 . . . . 2.3100000000000001 112.3 -179.139 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 55.0 mt -77.05 -7.89 56.48 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.728 1.381 . . . . 2.4399999999999999 114.728 174.199 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -94.78 -29.78 14.58 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 113.86 1.059 . . . . 4.4699999999999998 113.86 162.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -74.6 -46.91 35.49 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.956 1.302 . . . . 3.6099999999999999 112.464 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -136.77 41.36 2.52 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 127.723 2.409 . . . . 4.4500000000000002 110.874 -165.085 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 36.8 mttm . . . . . 0 C--O 1.253 1.239 0 C-N-CA 130.386 3.475 . . . . 8.5500000000000007 117.047 -175.607 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 CA--C 1.533 0.322 0 CA-C-O 121.148 0.499 . . . . 3.4199999999999999 111.421 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 67.3 p -110.49 165.2 13.14 Favored Pre-proline 0 N--CA 1.472 0.645 0 C-N-CA 126.474 1.909 . . . . 1.4299999999999999 110.652 -168.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -69.62 -23.09 31.81 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 121.118 1.212 . . . . 1.4199999999999999 112.26 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.34 -40.39 44.28 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.7 1.137 . . . . 2.7000000000000002 113.63 173.696 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -64.75 -34.44 78.33 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.114 1.325 . . . . 4.0599999999999996 110.625 172.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 59.1 mttt -68.21 -29.02 67.76 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 120.051 -1.656 . . . . 4.5199999999999996 112.255 170.511 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.13 -50.79 29.76 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.273 1.029 . . . . 1.1000000000000001 111.204 174.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.2 mt -55.9 -43.56 77.41 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.745 1.218 . . . . 1.6899999999999999 111.87 174.084 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 85.4 m -53.49 -54.71 33.16 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.342 1.057 . . . . 1.77 111.366 168.537 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.3 m -58.55 -37.24 75.28 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.489 1.115 . . . . 1.3100000000000001 111.924 -179.216 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 60.0 mtp -61.91 -52.54 63.67 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.032 0.933 . . . . 3.25 111.113 174.427 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 19.2 m -67.77 -28.25 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 CA-C-N 119.803 1.183 . . . . 2.27 113.299 177.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 57.2 m -58.64 -55.85 29.73 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.891 1.276 . . . . 0.91000000000000003 110.851 174.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -74.53 -34.45 63.01 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 119.304 -0.379 . . . . 2.54 110.275 -176.543 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.426 ' CZ ' HD23 ' A' ' 29' ' ' LEU . 21.2 t80 -61.66 -51.59 67.8 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 118.397 -0.811 . . . . 1.8200000000000001 110.999 176.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -66.29 -39.25 89.25 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 120.307 1.412 . . . . 2.5899999999999999 112.23 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -53.71 52.65 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.756 1.222 . . . . 4.9299999999999997 113.097 176.119 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -74.13 -32.2 63.07 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.358 -0.839 . . . . 2.46 112.091 176.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.5 t -58.79 -38.6 78.91 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 120.429 1.468 . . . . 2.1699999999999999 114.145 178.294 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.55 -6.17 83.74 Favored Glycine 0 CA--C 1.528 0.85 0 CA-C-O 117.958 -1.468 . . . . 1.96 115.184 -171.107 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -69.0 -41.56 77.63 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.239 1.519 . . . . 6.79 112.616 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -149.98 143.49 25.24 Favored 'General case' 0 C--O 1.247 0.93 0 C-N-CA 124.217 1.007 . . . . 4.6100000000000003 110.551 -154.14 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.39 -131.8 34.4 Favored Glycine 0 C--N 1.337 0.592 0 CA-C-N 114.522 -1.217 . . . . 1.99 110.973 -178.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.9 m -65.4 155.02 36.72 Favored 'General case' 0 C--O 1.247 0.973 0 C-N-CA 123.896 0.878 . . . . 2.79 112.995 170.053 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -112.86 10.73 19.1 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 115.037 1.495 . . . . 4.6100000000000003 115.037 170.734 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.8 mp -93.11 -1.66 56.22 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.339 1.056 . . . . 4.3799999999999999 111.485 167.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -159.7 148.29 17.56 Favored 'General case' 0 C--O 1.247 0.972 0 C-N-CA 126.841 2.056 . . . . 1.8 110.915 -157.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.426 HD23 ' CZ ' ' A' ' 16' ' ' PHE . 3.1 mm? -96.21 103.14 15.02 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 113.859 -1.518 . . . . 2.79 108.354 175.109 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.3 p -70.95 155.93 40.23 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.854 -1.066 . . . . 2.7599999999999998 110.348 171.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.1 ttm-85 -40.56 -50.9 2.98 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.665 1.186 . . . . 3.8399999999999999 113.897 -169.024 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -74.16 -30.33 62.21 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 115.39 1.626 . . . . 5.96 115.39 -175.49 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -58.12 -44.93 88.02 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.165 0.586 . . . . 1.96 111.227 166.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.73 -46.48 65.81 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.246 1.018 . . . . 2.9900000000000002 110.854 -175.667 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.1 ttmt -60.31 -44.29 95.56 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.43 -1.419 . . . . 4.1100000000000003 112.702 177.097 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.12 -43.2 87.09 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 114.026 1.121 . . . . 5.1799999999999997 114.026 168.83 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.9 tp -62.01 -54.01 47.57 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.4 1.08 . . . . 2.1899999999999999 111.149 179.563 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.7 mt -56.51 -44.52 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 CA-C-N 118.893 0.77 . . . . 0.90000000000000002 109.962 175.443 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -67.96 -18.98 64.91 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 114.149 1.166 . . . . 3.9300000000000002 114.149 -176.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -91.81 -40.48 11.19 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.57 1.548 . . . . 3.0699999999999998 112.498 -179.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -81.29 -26.38 35.77 Favored 'General case' 0 CA--C 1.552 1.041 0 O-C-N 124.413 1.071 . . . . 4.6600000000000001 111.815 176.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.0 mt -133.62 131.74 39.96 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 123.277 1.513 . . . . 2.71 113.442 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 4.3 t -149.15 7.51 0.71 Allowed 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.508 1.67 . . . . 4.4800000000000004 115.508 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -87.43 170.35 11.45 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.327 1.051 . . . . 3.3799999999999999 111.556 170.009 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.55 -131.08 26.44 Favored Glycine 0 N--CA 1.472 1.079 0 N-CA-C 109.977 -1.249 . . . . 3.73 109.977 -172.102 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -119.89 86.28 2.53 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.666 0.746 . . . . 7.29 109.137 148.493 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.0 tpt -74.65 78.47 2.02 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 120.51 -1.369 . . . . 2.1400000000000001 109.287 169.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.9 tttm -89.44 151.37 22.05 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.799 1.407 . . . . 6.0899999999999999 114.799 -157.612 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.3 -40.31 81.64 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.589 0.959 . . . . 4.5199999999999996 113.589 174.728 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.7 t -83.84 -41.76 17.15 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.134 0.974 . . . . 2.77 113.458 174.781 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.9 m -61.92 -24.82 67.21 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.492 1.117 . . . . 2.8799999999999999 112.442 177.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 65.8 mt -69.51 -28.13 36.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 124.265 1.026 . . . . 1.29 113.111 167.654 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.92 -30.19 68.61 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.958 1.708 . . . . 2.7799999999999998 112.123 -176.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -79.68 -35.77 38.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.747 0.819 . . . . 3.1699999999999999 112.401 168.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.9 tp -59.63 -32.42 70.42 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.559 -0.713 . . . . 2.02 111.236 170.615 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 6.0 tpt -55.16 -46.78 75.75 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.292 1.437 . . . . 1.8700000000000001 111.517 173.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -65.87 -29.28 69.71 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.799 1.24 . . . . 3.1899999999999999 112.524 171.712 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.9 t -75.35 -31.29 60.49 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.041 0.936 . . . . 2.1400000000000001 112.794 177.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.0 mp -71.38 -55.55 7.75 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.39 1.076 . . . . 2.7999999999999998 111.348 167.103 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -70.78 148.5 47.84 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 113.07 0.767 . . . . 2.1200000000000001 113.07 -168.558 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm -125.44 7.54 7.69 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.758 1.223 . . . . 3.3700000000000001 113.0 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 18.8 m-20 -122.17 -21.19 5.98 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.587 1.155 . . . . 2.5699999999999998 112.995 176.368 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 7.8 t 74.35 20.89 2.49 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.408 2.283 . . . . 2.2200000000000002 112.584 -171.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 p30 -83.4 -23.75 32.24 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.928 2.091 . . . . 1.97 112.287 -163.202 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 73.59 19.23 3.35 Favored 'General case' 0 CA--C 1.548 0.874 1 C-N-CA 132.1 4.16 . . . . 3.8399999999999999 113.736 -172.804 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -121.85 122.57 39.74 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 128.719 2.808 . . . . 3.71 109.211 169.515 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 18.2 mm -91.47 107.75 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 O-C-N 120.652 -1.28 . . . . 1.1100000000000001 110.441 175.026 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 59.1 t0 -74.85 151.81 38.98 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 127.07 2.148 . . . . 2.7599999999999998 109.66 164.187 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -46.33 -43.61 16.11 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 115.299 1.592 . . . . 2.25 115.299 -177.254 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.458 ' H ' ' HD2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -69.98 -21.59 63.22 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 113.831 1.048 . . . . 3.0299999999999998 113.831 178.673 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -74.03 -53.36 10.19 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.718 1.207 . . . . 1.6699999999999999 108.634 165.454 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -52.9 -30.04 31.89 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 120.304 -1.497 . . . . 2.23 114.401 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 33.1 t -40.76 -45.1 2.36 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.125 1.77 . . . . 3.21 113.284 165.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.3 m -75.05 -27.99 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 CA-C-N 118.925 0.784 . . . . 2.3399999999999999 112.419 -172.381 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -59.25 -58.23 9.53 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 118.724 0.693 . . . . 1.79 110.499 168.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 38.3 mt -65.42 -29.61 70.33 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.517 0.727 . . . . 1.5600000000000001 111.902 -177.592 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.0 m -65.91 -46.64 77.53 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.331 1.052 . . . . 0.94999999999999996 111.196 174.079 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 59.0 mtm -61.45 -47.79 84.09 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.668 1.122 . . . . 1.5600000000000001 112.116 177.291 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 96.7 mt -62.21 -44.85 95.65 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.737 0.815 . . . . 1.29 112.002 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 16.3 t -66.49 -35.2 79.68 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 113.012 0.745 . . . . 1.78 113.012 175.018 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.1 -41.3 96.41 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.009 0.744 . . . . 3.1400000000000001 113.009 174.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.54 -38.1 86.41 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 118.53 -0.748 . . . . 1.26 111.468 174.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -63.05 -28.17 69.91 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 120.011 1.278 . . . . 2.73 114.059 176.125 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -60.55 -52.04 66.85 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.869 1.213 . . . . 2.1699999999999999 110.919 170.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -73.11 -30.42 63.62 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.063 1.345 . . . . 3.3900000000000001 112.107 -175.136 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.77 -54.03 51.1 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.7 1.6 . . . . 3.3599999999999999 110.132 168.192 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -55.76 -38.12 69.43 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.29 1.436 . . . . 2.54 112.489 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 85.5 mt -70.66 -16.07 62.78 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.879 1.066 . . . . 1.8600000000000001 113.879 177.776 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -109.89 2.52 19.88 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.156 1.782 . . . . 3.25 113.621 175.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 15.6 t70 . . . . . 0 N--CA 1.474 0.775 0 C-N-CA 126.539 1.936 . . . . 2.9900000000000002 112.311 -174.825 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 3' ' ' THR . . . . . 0.5 HG23 ' H ' ' B' ' 6' ' ' GLU . 3.9 t . . . . . 0 N--CA 1.472 0.631 0 CA-C-O 118.506 -0.759 . . . . 2.73 110.727 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -65.77 -24.52 54.38 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 122.079 1.853 . . . . 1.49 113.065 164.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 14.0 tp -65.69 -63.48 1.08 Allowed 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 121.135 1.788 . . . . 2.7200000000000002 111.451 -176.746 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 6' ' ' GLU . . . . . 0.5 ' H ' HG23 ' B' ' 3' ' ' THR . 14.2 tp10 -57.99 -37.85 75.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.234 1.016 . . . . 5.3200000000000003 110.646 178.674 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 7' ' ' LYS . . . . . 0.445 ' HA ' ' HE2' ' B' ' 7' ' ' LYS . 0.2 OUTLIER -63.92 -31.53 72.75 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 120.361 -1.462 . . . . 5.21 112.997 174.994 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -79.38 -27.74 41.9 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.58 1.152 . . . . 1.22 112.862 178.315 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 56.8 mt -60.31 -32.55 71.33 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 120.864 -1.148 . . . . 1.8600000000000001 111.799 168.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.7 m -60.35 -40.57 91.2 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.074 -1.016 . . . . 1.78 111.722 167.701 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 5.9 m -57.74 -38.82 76.01 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.175 0.898 . . . . 1.45 111.261 177.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 13.7 ttm -59.53 -37.42 78.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.447 0.906 . . . . 3.1099999999999999 113.447 173.07 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -75.06 -27.26 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 CA-C-N 119.911 1.232 . . . . 2.3399999999999999 112.092 172.736 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 85.5 m -71.94 -46.75 56.41 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.708 1.603 . . . . 0.84999999999999998 110.24 -171.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 38.1 p -69.9 -39.12 76.42 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 123.538 0.735 . . . . 1.76 109.68 170.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -62.37 -53.63 52.14 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-O 118.455 -0.783 . . . . 2.29 111.966 -175.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -19.44 62.62 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 120.269 1.395 . . . . 2.98 112.328 -178.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -72.63 -49.36 32.43 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.698 -1.251 . . . . 4.5 112.519 168.12 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -74.54 -39.6 62.24 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.688 -1.258 . . . . 2.2799999999999998 112.886 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 18.2 m -55.96 -42.0 75.58 Favored 'General case' 0 C--O 1.245 0.831 0 C-N-CA 124.299 1.04 . . . . 1.76 112.337 166.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.94 -9.03 86.86 Favored Glycine 0 C--N 1.343 0.928 0 C-N-CA 127.237 2.351 . . . . 1.3400000000000001 113.999 -176.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -56.75 -67.52 0.3 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.184 1.794 . . . . 3.7799999999999998 109.373 174.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -138.01 168.61 19.36 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 124.167 0.987 . . . . 3.5699999999999998 113.025 -168.073 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.2 -132.18 48.84 Favored Glycine 0 C--N 1.341 0.839 0 C-N-CA 125.785 1.66 . . . . 2.0899999999999999 111.816 176.405 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -50.51 121.78 6.21 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.176 0.991 . . . . 3.96 110.227 158.391 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -85.17 -16.22 41.12 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 120.657 -1.277 . . . . 7.9000000000000004 114.411 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 60.8 tp -72.72 -36.62 67.83 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.504 1.121 . . . . 2.7400000000000002 112.226 168.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 3.2 p -119.23 166.5 12.91 Favored 'General case' 0 C--O 1.252 1.236 0 C-N-CA 126.283 1.833 . . . . 1.29 114.553 -172.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.81 129.46 47.04 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 113.663 -1.608 . . . . 2.25 113.83 176.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.64 175.51 5.47 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.712 1.605 . . . . 2.2599999999999998 110.698 175.723 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 31' ' ' ARG . . . . . 0.486 HH11 ' HG2' ' B' ' 31' ' ' ARG . 14.9 ttt-85 -44.77 -33.04 1.74 Allowed 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 116.738 2.125 . . . . 5.4500000000000002 116.738 -170.084 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -79.99 -36.49 35.92 Favored 'General case' 0 CA--C 1.549 0.931 0 O-C-N 120.337 -1.477 . . . . 4.0099999999999998 114.076 176.236 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -70.27 -48.2 57.85 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 108.831 -0.803 . . . . 1.8400000000000001 108.831 173.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.43 HD11 ' CG1' ' B' ' 67' ' ' ILE . 15.7 mt -52.09 -45.88 65.0 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.714 1.605 . . . . 3.1499999999999999 113.498 175.406 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -52.77 -41.95 64.54 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.373 0.533 . . . . 3.0 111.518 178.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -71.91 -38.75 69.86 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.498 0.925 . . . . 3.2400000000000002 113.498 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 7.2 tt -57.13 -59.6 4.85 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.473 0.709 . . . . 1.9199999999999999 109.876 173.517 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 41.8 mt -54.84 -54.57 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.957 0.903 . . . . 1.03 109.974 -172.077 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -72.61 -22.64 60.93 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 118.507 -1.277 . . . . 6.4000000000000004 114.135 -171.465 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -83.31 -34.89 25.61 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 117.457 -1.258 . . . . 4.4000000000000004 113.531 173.699 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 80.7 mt-10 -72.43 -58.12 3.64 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.736 1.153 . . . . 3.7400000000000002 111.143 172.005 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mp -91.97 91.47 7.87 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.72 -0.844 . . . . 3.4399999999999999 108.72 175.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 89.0 m -55.75 -37.61 68.74 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 121.599 -0.688 . . . . 3.46 112.526 174.15 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.46 -156.93 0.29 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 127.492 2.317 . . . . 3.6400000000000001 114.354 -171.358 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.11 162.07 33.57 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.186 1.85 . . . . 3.8199999999999998 113.547 177.382 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -79.47 43.81 0.57 Allowed 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 122.498 1.142 . . . . 6.2000000000000002 109.995 165.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 4.2 tpt -80.49 65.55 5.68 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.519 1.527 . . . . 2.04 112.533 -157.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -71.16 164.79 24.93 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.089 1.755 . . . . 3.8500000000000001 111.646 175.197 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -45.15 -53.53 7.97 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.789 1.636 . . . . 4.7599999999999998 112.581 175.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -66.32 -29.3 69.47 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.2 -0.938 . . . . 2.6499999999999999 113.104 -178.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 24.4 t -76.66 -18.06 58.78 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 118.089 -0.958 . . . . 2.5600000000000001 112.201 175.118 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 81.2 mt -86.39 -36.5 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 126.451 1.9 . . . . 1.3799999999999999 109.834 173.849 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -59.01 -58.4 8.82 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.704 2.002 . . . . 4.1399999999999997 111.248 168.771 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -67.63 -26.42 66.23 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.305 0.957 . . . . 2.9199999999999999 113.58 176.456 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.19 -56.59 19.66 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.209 0.913 . . . . 2.5299999999999998 110.282 165.278 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -69.26 -29.57 67.5 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 117.75 -1.119 . . . . 2.23 112.108 -172.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 18.5 mtpt -64.48 -36.64 84.84 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 120.397 1.453 . . . . 3.7400000000000002 113.076 164.189 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 22.7 t -69.18 -31.76 70.6 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.868 -1.145 . . . . 2.8599999999999999 112.599 175.11 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 59' ' ' LEU . . . . . 0.462 ' HB3' HD12 ' B' ' 67' ' ' ILE . 10.4 mp -69.93 -55.62 9.19 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 120.666 -1.271 . . . . 2.75 110.79 167.061 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -79.21 61.59 3.36 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 129.029 2.932 . . . . 1.3600000000000001 113.079 -173.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 22.8 mttp -54.85 -18.75 5.25 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 115.117 1.525 . . . . 3.25 115.117 -172.895 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -105.79 -3.57 21.86 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.003 1.721 . . . . 2.3700000000000001 115.106 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 15.0 t 68.79 25.36 6.3 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 114.678 1.362 . . . . 2.0800000000000001 114.678 177.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 13.6 p30 -78.27 -14.31 59.48 Favored 'General case' 0 CA--C 1.552 1.022 0 O-C-N 120.682 -1.261 . . . . 2.2999999999999998 112.001 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 75.79 -6.13 2.04 Favored 'General case' 0 CA--C 1.543 0.705 1 C-N-CA 133.243 4.617 . . . . 4.6500000000000004 115.052 177.395 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -97.43 152.86 18.53 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 127.347 2.259 . . . . 2.73 109.304 169.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 67' ' ' ILE . . . . . 0.462 HD12 ' HB3' ' B' ' 59' ' ' LEU . 29.6 mm -115.22 97.07 5.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-O 122.322 1.058 . . . . 1.8899999999999999 109.816 171.714 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.92 153.4 43.63 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.297 1.839 . . . . 2.8300000000000001 110.771 159.433 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.97 -33.91 39.97 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.298 1.222 . . . . 2.4900000000000002 114.298 -174.312 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -25.83 61.77 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.778 -1.202 . . . . 3.6099999999999999 112.09 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -78.87 -47.58 16.26 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.892 1.277 . . . . 1.6799999999999999 109.342 169.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -52.92 -48.53 67.21 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 127.61 2.364 . . . . 2.8999999999999999 114.228 -174.176 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 97.2 p -61.17 -25.64 67.16 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.236 -0.915 . . . . 1.71 113.149 -172.764 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 37.3 t -65.56 -21.74 29.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 123.784 0.834 . . . . 2.4300000000000002 111.964 178.232 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -57.48 -58.44 8.28 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.487 1.115 . . . . 2.7000000000000002 111.595 168.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 76' ' ' LEU . . . . . 0.4 HD22 ' H ' ' B' ' 76' ' ' LEU . 2.9 mm? -61.62 -40.6 95.41 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.788 0.835 . . . . 3.3599999999999999 111.037 179.054 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 52.3 m -53.39 -52.55 58.96 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 118.191 -0.909 . . . . 1.52 112.358 172.483 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 74.6 mtm -57.74 -49.94 74.9 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 119.808 1.186 . . . . 1.8300000000000001 112.452 177.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 84.5 mt -62.49 -37.93 87.88 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.724 0.41 . . . . 1.5 111.598 -179.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 8.5 t -69.22 -31.64 70.36 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.02 0.928 . . . . 1.96 112.921 175.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 67.3 mtp -61.46 -46.43 90.09 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 119.029 0.831 . . . . 1.9199999999999999 110.73 167.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.31 -45.63 90.42 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 118.728 0.695 . . . . 0.73999999999999999 112.836 177.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -59.12 -27.03 65.23 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.651 -0.656 . . . . 2.4199999999999999 112.759 176.219 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -72.86 -35.55 67.21 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.337 1.426 . . . . 2.0 112.685 176.341 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.79 -39.89 72.89 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.81 0.844 . . . . 2.8399999999999999 110.261 175.127 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.56 -50.87 68.9 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.167 1.387 . . . . 2.0299999999999998 110.812 170.808 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -58.04 -29.85 65.69 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.175 1.39 . . . . 2.3700000000000001 113.123 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 24.8 mt -73.65 -24.44 60.0 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.324 1.05 . . . . 2.0699999999999998 113.547 177.546 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -97.74 -32.48 11.72 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 114.388 1.255 . . . . 4.1699999999999999 114.388 175.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -74.33 -27.42 60.69 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.365 1.466 . . . . 4.2800000000000002 113.568 -170.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -88.13 -1.85 58.25 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.898 0.879 . . . . 4.8799999999999999 112.853 176.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.042 0 C-N-CA 126.277 1.831 . . . . 6.1100000000000003 114.25 -159.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.4 mp0 . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 109.145 -0.687 . . . . 3.2200000000000002 109.145 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.4 p -118.27 163.99 22.41 Favored Pre-proline 0 C--O 1.238 0.481 0 C-N-CA 125.059 1.344 . . . . 2.21 108.954 172.019 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -64.38 -12.75 34.59 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 121.985 1.79 . . . . 1.8799999999999999 113.516 175.467 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.8 tt -79.7 -35.09 39.53 Favored 'General case' 0 C--N 1.347 0.492 0 CA-C-N 120.238 1.381 . . . . 3.1899999999999999 112.512 170.496 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -52.69 52.68 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.339 1.427 . . . . 3.8599999999999999 108.7 167.18 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.521 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -57.5 -26.14 60.86 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 113.096 0.776 . . . . 4.2000000000000002 113.096 -179.137 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.64 -53.62 44.68 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-O 118.335 -0.841 . . . . 1.29 111.844 168.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 47.5 mt -54.45 -48.36 71.82 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 120.041 1.292 . . . . 1.71 111.597 177.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.7 p -67.52 -36.31 80.79 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 117.636 -1.174 . . . . 2.8500000000000001 113.289 177.754 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.42 -29.12 66.77 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 121.149 1.795 . . . . 2.1299999999999999 112.078 170.745 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.96 -55.97 18.58 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.378 1.071 . . . . 3.77 110.815 -178.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.7 m -62.56 -25.13 37.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 113.021 0.749 . . . . 2.2799999999999998 113.021 177.768 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.1 m -70.17 -49.22 52.63 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.697 1.599 . . . . 1.3899999999999999 112.512 175.467 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -48.13 81.22 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.054 0.843 . . . . 2.25 109.68 167.274 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -62.85 -50.96 68.9 Favored 'General case' 0 N--CA 1.465 0.319 0 O-C-N 124.222 0.951 . . . . 2.5299999999999998 111.1 -166.178 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 24.0 m170 -68.21 -34.81 76.95 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 118.394 -0.812 . . . . 2.79 112.42 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -70.81 -43.02 69.49 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 120.056 1.298 . . . . 4.4800000000000004 113.315 177.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -70.53 -23.16 62.58 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.312 0.96 . . . . 2.0800000000000001 112.045 170.406 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.0 p -69.88 -36.67 75.66 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.326 -1.484 . . . . 2.7000000000000002 111.181 169.502 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.47 -15.37 75.17 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 125.871 1.7 . . . . 1.6000000000000001 113.516 175.677 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -64.11 92.94 0.08 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 106.999 -1.482 . . . . 4.6699999999999999 106.999 157.256 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 60.63 178.08 0.1 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.764 2.026 . . . . 6.7800000000000002 115.635 169.28 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.36 -140.3 44.79 Favored Glycine 0 C--N 1.343 0.938 0 C-N-CA 126.294 1.902 . . . . 2.21 112.522 166.494 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.5 t -54.14 132.38 42.92 Favored 'General case' 0 C--O 1.241 0.613 0 O-C-N 121.817 -0.813 . . . . 2.7200000000000002 110.343 156.082 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.5 ptmm? -86.31 16.79 4.14 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.063 0.945 . . . . 4.0999999999999996 113.546 171.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.2 mt -128.85 -39.6 1.59 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.561 1.144 . . . . 4.3099999999999996 111.475 178.021 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 12.5 p -101.0 162.33 12.96 Favored 'General case' 0 C--O 1.248 0.995 0 C-N-CA 124.996 1.318 . . . . 1.3700000000000001 111.508 174.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 92.6 mt -90.48 98.17 11.62 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 112.304 -2.225 . . . . 1.72 109.127 172.768 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.2 t -63.0 166.15 6.11 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 121.59 0.709 . . . . 1.8300000000000001 112.242 170.541 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.65 -40.61 1.99 Allowed 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 127.008 2.123 . . . . 3.6400000000000001 115.419 -175.547 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -79.71 -36.87 36.82 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.06 1.133 . . . . 6.3899999999999997 114.06 176.367 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -66.09 -47.72 73.29 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.533 1.533 . . . . 1.54 109.615 -175.811 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 38.1 tp -53.93 -50.41 66.48 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.569 1.148 . . . . 1.8400000000000001 111.049 175.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -57.46 -44.74 85.04 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 112.958 0.725 . . . . 3.46 112.958 176.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -58.31 -38.8 77.81 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 119.264 0.938 . . . . 3.77 112.488 174.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.7 -57.84 5.08 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.482 1.113 . . . . 2.6600000000000001 110.734 177.032 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.6 mt -58.27 -49.37 82.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 118.517 0.599 . . . . 0.79000000000000004 110.107 -175.363 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.62 -8.18 53.99 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 120.818 -1.176 . . . . 4.6699999999999999 111.874 -173.181 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -95.42 -39.03 10.21 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.998 1.319 . . . . 3.3599999999999999 113.455 166.178 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -72.72 -64.94 0.86 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.761 1.225 . . . . 4.5300000000000002 109.637 177.525 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -82.33 72.99 9.39 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 123.177 1.465 . . . . 2.3300000000000001 107.399 165.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.9 t -65.58 7.56 0.23 Allowed 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 114.877 1.436 . . . . 2.9900000000000002 114.877 178.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -49.71 157.19 0.59 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 129.452 3.101 . . . . 4.4299999999999997 114.322 -177.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -83.1 -19.64 62.43 Favored Glycine 0 N--CA 1.474 1.222 0 C-N-CA 124.313 0.959 . . . . 3.5499999999999998 112.165 168.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -69.47 -29.45 67.12 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 128.806 2.842 . . . . 5.5 111.34 170.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.7 85.35 2.72 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.578 1.551 . . . . 2.2799999999999998 110.943 173.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.6 mmtp -111.53 170.71 7.94 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.728 2.411 . . . . 4.21 110.081 176.037 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -57.01 -42.11 79.73 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.637 -0.664 . . . . 4.3600000000000003 112.477 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -70.92 -4.2 23.31 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.824 1.416 . . . . 3.3500000000000001 114.824 173.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.4 m -101.56 -39.07 7.67 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.586 1.154 . . . . 2.1299999999999999 110.715 172.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 34.8 mm -71.3 -36.24 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 125.213 1.405 . . . . 2.04 112.242 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -66.55 -33.92 76.76 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.82 1.044 . . . . 4.04 113.82 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -83.57 -34.2 25.24 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 113.201 0.815 . . . . 2.8799999999999999 113.201 176.011 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.9 tt -54.51 -50.96 66.6 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.816 0.846 . . . . 2.23 109.313 169.404 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.2 ttt -60.34 -40.42 90.62 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.254 1.022 . . . . 1.4399999999999999 113.009 172.353 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.2 ttmm -58.74 -35.25 72.41 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.206 1.002 . . . . 4.4000000000000004 112.553 176.564 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 68.1 m -80.44 -23.2 40.45 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.529 1.931 . . . . 1.8600000000000001 113.442 177.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.2 mt -73.66 -54.03 9.05 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.018 -1.051 . . . . 1.8600000000000001 113.5 176.35 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -88.03 143.96 26.79 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.562 1.074 . . . . 1.9299999999999999 113.843 -167.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -115.83 7.08 14.45 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 125.252 1.421 . . . . 2.8500000000000001 113.424 -177.405 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 54.5 m-20 -118.8 -23.44 6.99 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.95 1.3 . . . . 2.8700000000000001 114.224 -170.302 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 54.3 m 58.77 39.55 24.05 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.448 2.299 . . . . 2.8799999999999999 112.577 -157.402 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.6 p30 -87.73 -26.02 23.14 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.018 1.327 . . . . 2.75 112.93 -173.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 75.35 4.4 4.09 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 130.693 3.597 . . . . 3.73 114.346 -170.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -116.38 121.6 42.4 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.386 2.274 . . . . 2.7400000000000002 109.599 -179.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 29.0 mm -78.83 106.4 9.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 115.36 -0.836 . . . . 1.02 109.431 177.202 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -58.67 147.99 30.81 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.037 1.335 . . . . 4.0999999999999996 109.468 169.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -57.29 -35.39 69.74 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 120.062 -1.649 . . . . 2.8900000000000001 111.726 173.026 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -50.38 -44.15 54.76 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.989 1.716 . . . . 3.9100000000000001 113.142 167.62 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -79.41 -40.96 28.78 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.284 1.834 . . . . 1.7 111.275 -177.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -58.16 -28.21 64.53 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.558 1.143 . . . . 2.0099999999999998 112.625 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 53.2 p -53.34 -33.23 52.72 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 121.025 -1.047 . . . . 2.8799999999999999 113.676 168.664 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.4 t -67.16 -41.63 87.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.298 1.039 . . . . 1.8999999999999999 109.725 -178.178 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -55.51 -57.15 13.12 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.648 0.779 . . . . 2.2599999999999998 111.202 171.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.31 -33.91 73.05 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 113.06 0.763 . . . . 1.5700000000000001 113.06 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 63.7 m -70.32 -44.38 68.37 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.554 0.742 . . . . 0.68999999999999995 111.481 -179.274 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 79.5 mtm -55.56 -41.01 72.67 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.482 0.583 . . . . 1.3300000000000001 111.556 172.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.5 mt -73.23 -41.49 63.66 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.777 0.831 . . . . 1.29 113.177 -179.176 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 3.5 p -67.75 -31.84 72.03 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 119.29 0.95 . . . . 3.1200000000000001 112.643 175.769 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 70.8 mtp -71.57 -37.73 71.03 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.791 -0.568 . . . . 1.6799999999999999 111.919 170.138 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.88 -36.6 83.87 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.461 1.028 . . . . 0.76000000000000001 113.213 176.678 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -66.76 -18.1 65.2 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.254 -0.904 . . . . 2.3999999999999999 113.347 170.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 17.7 t30 -74.57 -39.85 62.0 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 119.938 1.245 . . . . 2.1800000000000002 112.915 174.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -58.53 -48.98 79.05 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.115 0.966 . . . . 4.3300000000000001 110.103 171.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.82 -46.09 64.19 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.468 1.507 . . . . 2.1000000000000001 112.876 174.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -67.09 -22.92 65.8 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.994 1.318 . . . . 2.4199999999999999 112.943 -179.285 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.1 mt -86.45 -24.99 25.45 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.425 1.09 . . . . 1.6299999999999999 112.232 172.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -89.23 -20.8 23.71 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 115.479 1.659 . . . . 2.7599999999999998 115.479 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 . . . . . 0 N--CA 1.477 0.89 0 C-N-CA 124.55 1.14 . . . . 2.9199999999999999 112.39 167.026 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 2.6 t . . . . . 0 N--CA 1.47 0.557 0 N-CA-C 108.022 -1.103 . . . . 3.1499999999999999 108.022 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -60.39 -11.51 16.83 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.186 1.924 . . . . 1.8 113.677 175.416 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.21 -33.19 59.26 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 119.356 0.98 . . . . 2.7599999999999998 112.574 171.02 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -58.97 -46.28 88.47 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 121.144 -0.973 . . . . 4.8399999999999999 109.484 167.292 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 8.5 mmtm -65.43 -29.95 70.69 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.134 1.161 . . . . 4.3300000000000001 114.134 175.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.46 -43.99 79.73 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.661 0.784 . . . . 1.0 111.795 170.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 48.8 mt -62.7 -41.63 99.22 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.014 0.926 . . . . 1.6399999999999999 112.057 174.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -55.7 24.34 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 118.814 0.734 . . . . 1.26 109.845 167.313 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 42.0 m -54.91 -38.8 68.08 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.202 1.801 . . . . 1.29 112.623 -174.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 88.4 mtp -53.37 -43.49 67.84 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.973 0.806 . . . . 3.0099999999999998 111.602 175.273 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 19.5 t -71.36 -34.81 55.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.824 1.249 . . . . 2.2799999999999998 111.47 176.254 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.9 m -62.3 -47.37 84.61 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 121.123 -0.986 . . . . 1.05 112.387 174.011 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 p -62.55 -28.53 69.93 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.404 1.082 . . . . 2.0699999999999998 112.065 170.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -63.56 -59.53 4.5 Favored 'General case' 0 C--O 1.225 -0.202 0 O-C-N 124.001 0.813 . . . . 2.4100000000000001 109.63 -178.442 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -74.67 -27.96 60.64 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 117.426 -1.273 . . . . 2.9399999999999999 114.139 -177.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 24.8 mtpt -41.05 -47.75 3.16 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.773 1.229 . . . . 6.6399999999999997 112.322 167.6 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -108.09 -36.64 6.27 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.786 1.234 . . . . 2.0600000000000001 113.06 -175.269 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 29.2 t -58.47 -26.57 63.52 Favored 'General case' 0 C--O 1.246 0.874 0 O-C-N 120.824 -1.173 . . . . 1.9099999999999999 112.95 173.121 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.7 -7.25 87.3 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 127.61 2.529 . . . . 1.76 115.402 175.401 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 11.7 mmp_? -57.92 -73.33 0.07 Allowed 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 120.118 1.959 . . . . 4.3700000000000001 110.362 168.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -127.06 161.92 27.27 Favored 'General case' 0 C--O 1.246 0.909 0 C-N-CA 126.546 1.938 . . . . 3.7799999999999998 110.65 -156.661 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.06 -136.26 48.44 Favored Glycine 0 C--N 1.338 0.686 0 C-N-CA 125.709 1.623 . . . . 2.1699999999999999 110.978 174.352 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 46.1 t -63.09 141.21 58.85 Favored 'General case' 0 C--O 1.248 1.011 0 CA-C-O 123.207 1.48 . . . . 3.8799999999999999 110.828 162.022 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 55.4 mttm -85.86 1.29 50.41 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.902 1.281 . . . . 8.1099999999999994 112.695 173.367 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 76.3 mt -88.96 -33.85 17.08 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.662 1.585 . . . . 4.8700000000000001 112.083 164.606 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 65.5 p -109.2 152.05 25.68 Favored 'General case' 0 C--O 1.249 1.032 0 C-N-CA 125.292 1.437 . . . . 1.73 112.686 -176.258 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.7 pp -105.47 112.88 26.14 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 114.932 -1.031 . . . . 1.95 111.492 170.113 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 2.3 p -77.74 171.01 15.6 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.853 1.261 . . . . 2.0099999999999998 112.229 170.098 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 -41.19 -32.69 0.29 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 117.026 2.232 . . . . 3.77 117.026 174.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.65 -41.78 15.99 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 120.161 -1.587 . . . . 4.7199999999999998 112.196 179.263 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -57.85 -38.4 75.62 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.561 1.544 . . . . 1.9099999999999999 109.821 169.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 tt -68.47 -50.66 50.78 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.019 1.728 . . . . 3.0299999999999998 113.129 176.147 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 7.6 ptpt -71.19 -15.57 62.48 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 120.085 1.311 . . . . 3.02 114.27 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -72.99 -56.46 5.1 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.925 0.89 . . . . 3.8999999999999999 110.974 163.108 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.1 tt -52.21 -58.99 4.94 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 126.197 1.799 . . . . 2.1200000000000001 112.598 -175.458 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 33.1 mt -56.55 -50.06 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 N-CA-C 109.084 -0.71 . . . . 0.88 109.084 -172.283 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -71.24 -13.24 61.84 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 124.047 0.939 . . . . 3.96 113.482 -171.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -99.59 -33.28 10.7 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 114.195 1.183 . . . . 4.0599999999999996 114.195 174.816 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -79.95 -50.04 11.0 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.011 0.823 . . . . 4.8600000000000003 110.29 173.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 39.6 mt -81.07 64.31 5.76 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 122.955 1.359 . . . . 2.4500000000000002 109.606 160.617 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 8.2 p -65.64 37.19 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.034 2.534 . . . . 3.8799999999999999 112.772 164.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 98.5 mt -121.41 172.38 8.09 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 126.689 1.996 . . . . 4.2999999999999998 111.178 -171.182 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -75.39 22.44 1.67 Allowed Glycine 0 CA--C 1.535 1.312 0 CA-C-O 117.738 -1.59 . . . . 3.5299999999999998 114.666 176.274 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.19 -128.65 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 126.005 1.722 . . . . 9.4299999999999997 112.181 -171.658 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 14.3 ptp -62.85 146.07 53.57 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.813 1.642 . . . . 3.3700000000000001 114.494 -172.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -121.59 161.21 22.82 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.547 1.139 . . . . 4.3200000000000003 109.364 -173.033 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -66.79 -12.83 60.36 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 117.783 2.512 . . . . 3.2799999999999998 117.783 -155.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 12.9 t -72.75 -12.16 60.9 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 120.617 1.553 . . . . 2.6099999999999999 114.199 167.142 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 7.7 m -103.73 -16.21 15.51 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.055 1.342 . . . . 2.4300000000000002 112.534 175.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 10.7 mm -64.53 -34.28 68.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.793 1.237 . . . . 1.6299999999999999 111.757 177.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.25 -18.97 57.21 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.195 0.998 . . . . 2.9100000000000001 112.646 176.456 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -80.47 -42.63 22.23 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.272 -0.893 . . . . 3.0299999999999998 110.802 166.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -57.25 -46.9 82.59 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.931 1.293 . . . . 2.71 109.967 175.015 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 6.9 tpt -48.31 -57.73 5.59 Favored 'General case' 0 C--O 1.217 -0.648 0 C-N-CA 125.782 1.633 . . . . 1.75 111.134 167.199 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.04 -25.44 67.83 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.25 1.42 . . . . 4.2000000000000002 114.017 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 15.1 m -82.11 -39.6 23.12 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.44 1.896 . . . . 1.9199999999999999 111.764 -178.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 12.4 mt -57.33 -59.06 5.69 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.116 1.366 . . . . 2.8599999999999999 111.044 158.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -80.77 47.92 1.02 Allowed 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 127.574 2.349 . . . . 1.7 112.103 -173.614 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -51.57 -24.42 5.34 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.31 1.844 . . . . 5.3799999999999999 112.954 170.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 52.5 p30 -88.74 -6.88 57.13 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 115.616 1.709 . . . . 2.0800000000000001 115.616 172.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 19.1 m 69.42 25.22 5.53 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.258 1.823 . . . . 2.8799999999999999 115.417 163.146 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 p30 -100.71 -2.87 31.39 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.818 1.647 . . . . 2.48 113.048 -177.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 63.99 -7.64 0.2 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 131.154 3.782 . . . . 4.25 115.989 -174.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -92.83 145.78 24.13 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 123.706 0.802 . . . . 3.6200000000000001 108.965 174.005 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 42.6 mm -117.63 113.14 41.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 125.313 1.445 . . . . 1.54 108.875 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.28 173.23 9.31 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.615 1.166 . . . . 2.73 110.571 161.344 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -54.39 -38.4 66.12 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.933 1.086 . . . . 2.9199999999999999 113.933 175.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 18.1 mtpp -71.47 -25.2 62.18 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.492 0.717 . . . . 4.5 112.447 -177.404 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -75.66 -53.45 8.54 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.073 0.949 . . . . 1.6799999999999999 110.188 161.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -51.58 -37.49 50.05 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.498 1.919 . . . . 2.3300000000000001 114.874 -173.125 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 4.8 m -59.44 -26.49 65.24 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 117.791 -1.1 . . . . 2.2400000000000002 113.848 173.622 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 68.0 t -62.46 -47.12 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 CA-C-N 120.679 1.581 . . . . 1.6399999999999999 110.277 178.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -57.89 -50.75 72.27 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.488 1.115 . . . . 1.6299999999999999 112.219 172.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 82.9 mt -67.85 -29.0 68.03 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 118.693 -0.67 . . . . 1.73 112.31 -176.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 31.5 m -65.16 -50.75 64.77 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.219 1.008 . . . . 0.82999999999999996 110.538 167.544 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 72.8 mtp -55.78 -41.61 74.32 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.207 1.003 . . . . 1.9399999999999999 113.197 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 39.8 mt -69.16 -50.56 46.56 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 118.531 0.605 . . . . 1.54 112.094 174.892 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -65.84 -26.7 67.78 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 121.513 -0.742 . . . . 1.6899999999999999 111.984 -177.519 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 60.7 mmm -63.19 -44.49 95.22 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.554 1.142 . . . . 2.27 112.553 165.476 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.1 -36.92 80.99 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.863 1.21 . . . . 0.90000000000000002 112.455 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -69.96 -23.31 63.16 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.966 1.099 . . . . 2.25 113.966 171.468 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -63.26 -48.59 77.55 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.463 1.029 . . . . 2.4300000000000002 111.452 175.269 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -63.27 -43.71 97.17 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.764 1.225 . . . . 3.1400000000000001 112.214 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -54.36 -50.93 66.33 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.363 1.465 . . . . 2.79 111.649 176.694 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -63.76 -27.44 69.2 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.121 0.968 . . . . 2.5 111.882 -176.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 82.3 mt -81.17 -14.27 57.77 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 117.749 -1.12 . . . . 1.8300000000000001 112.834 177.756 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -92.96 -21.45 19.78 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.405 1.261 . . . . 4.3499999999999996 114.405 166.71 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -73.99 -36.5 64.52 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.372 1.469 . . . . 3.9900000000000002 112.816 175.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -99.25 47.06 0.97 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.745 1.218 . . . . 2.7799999999999998 112.655 -167.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt . . . . . 0 C--O 1.249 1.052 0 C-N-CA 127.752 2.421 . . . . 4.9900000000000002 114.797 -174.864 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 . . . . . 0 CA--C 1.548 0.887 0 N-CA-C 113.884 1.068 . . . . 6.3499999999999996 113.884 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.445 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 9.9 p -107.19 178.19 1.14 Allowed Pre-proline 0 N--CA 1.48 1.069 0 C-N-CA 127.169 2.187 . . . . 1.5900000000000001 113.059 -159.195 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.445 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 56.7 Cg_endo -72.34 -24.9 19.03 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 122.201 1.934 . . . . 1.6499999999999999 113.986 170.196 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.2 tt -75.12 -41.37 58.61 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 119.645 1.112 . . . . 2.9100000000000001 111.173 173.829 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -59.29 -43.8 92.55 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.654 0.782 . . . . 4.4100000000000001 110.772 173.667 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.3 mttp -68.34 -32.86 73.27 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.453 -1.404 . . . . 3.3199999999999998 113.224 173.614 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.538 ' HB1' ' HB1' ' B' ' 8' ' ' ALA . . . -60.96 -50.25 74.17 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.81 0.732 . . . . 1.04 112.016 174.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.5 mt -69.75 -33.49 72.5 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.179 0.9 . . . . 2.3599999999999999 111.873 178.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 88.7 m -57.84 -45.34 86.37 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 118.055 -0.974 . . . . 1.5600000000000001 111.111 169.323 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.4 m -58.16 -40.08 80.5 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.742 1.156 . . . . 1.3300000000000001 111.648 175.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 16.3 mtp -62.67 -52.37 63.59 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 118.65 0.659 . . . . 3.3999999999999999 110.779 174.539 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.0 t -58.0 -37.24 60.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 121.217 -0.927 . . . . 2.21 112.725 176.572 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.4 m -67.15 -57.0 7.58 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.587 1.555 . . . . 1.26 110.73 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.4 p -58.79 -41.08 85.86 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.329 0.651 . . . . 1.9199999999999999 109.976 176.729 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.43 -65.61 0.66 Allowed 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 118.687 -0.673 . . . . 2.2000000000000002 109.241 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -58.07 -36.21 72.48 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 120.078 1.308 . . . . 2.7200000000000002 112.446 -177.683 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -63.37 -56.11 19.02 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 120.52 -1.363 . . . . 4.9400000000000004 113.348 174.356 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -70.95 -31.24 67.75 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.188 0.995 . . . . 2.9500000000000002 111.459 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.412 ' HA ' ' OE1' ' A' ' 33' ' ' GLU . 13.0 t -58.23 -37.64 75.26 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 124.908 1.283 . . . . 2.02 111.017 169.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.98 6.88 11.01 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 127.906 2.67 . . . . 1.8 116.379 175.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -94.48 123.25 37.78 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 105.332 -2.099 . . . . 5.1900000000000004 105.332 150.135 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 60.77 169.42 0.09 Allowed 'General case' 0 CA--C 1.559 1.303 0 N-CA-C 116.069 1.877 . . . . 5.7199999999999998 116.069 161.15 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.25 -106.33 1.56 Allowed Glycine 0 N--CA 1.472 1.078 0 N-CA-C 108.39 -1.884 . . . . 2.5699999999999998 108.39 -175.211 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.7 m -129.63 -179.85 5.41 Favored 'General case' 0 C--O 1.24 0.592 0 O-C-N 121.741 -0.858 . . . . 3.48 111.946 141.277 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.2 ttmm -66.87 -9.62 39.72 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 127.973 2.509 . . . . 4.4199999999999999 113.326 174.142 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.9 mt -84.5 -43.62 14.39 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.698 1.599 . . . . 3.7599999999999998 111.302 170.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.7 p -101.51 134.6 44.37 Favored 'General case' 0 C--O 1.243 0.712 0 C-N-CA 125.862 1.665 . . . . 1.55 112.241 -168.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 68.4 mt -88.02 96.04 10.36 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.354 1.462 . . . . 1.6200000000000001 108.848 162.485 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.429 ' H ' ' CD ' ' A' ' 33' ' ' GLU . 2.4 m -66.87 157.62 32.66 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.227 -0.921 . . . . 2.6099999999999999 112.133 171.651 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 45.5 ttt-85 -50.63 -9.88 0.06 Allowed 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 128.115 2.566 . . . . 3.3300000000000001 117.527 -177.461 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.43 -44.0 7.04 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 119.895 -1.753 . . . . 4.8399999999999999 113.259 167.607 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.429 ' CD ' ' H ' ' A' ' 30' ' ' SER . 17.2 mt-10 -54.42 -45.95 73.1 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.084 1.354 . . . . 1.5600000000000001 109.711 170.566 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.3 tp -67.28 -40.41 86.13 Favored 'General case' 0 C--N 1.344 0.368 0 C-N-CA 123.203 0.601 . . . . 2.2000000000000002 112.307 -179.505 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -59.51 -44.54 93.09 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.88 0.764 . . . . 3.27 111.658 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.511 ' HG2' ' HE2' ' A' ' 40' ' ' LYS . 53.3 tt0 -63.92 -52.19 60.98 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-O 119.035 -0.507 . . . . 3.8999999999999999 112.096 173.329 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -61.69 -47.39 85.53 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.843 1.257 . . . . 2.8599999999999999 112.647 -174.842 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 48.0 mt -49.77 -47.39 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 119.378 0.99 . . . . 1.25 109.291 170.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.3 tptt -74.08 -12.7 60.68 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 112.995 0.739 . . . . 5.5 112.995 -173.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.511 ' HE2' ' HG2' ' A' ' 36' ' ' GLU . 68.1 mmtt -79.69 -40.32 29.26 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.894 1.224 . . . . 2.7799999999999998 112.573 163.57 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -67.06 -71.76 0.19 Allowed 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 108.973 -0.751 . . . . 4.71 108.973 175.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.5 mt -76.45 65.5 2.33 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.956 1.302 . . . . 3.0499999999999998 111.824 172.473 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 14.9 t -79.63 -27.02 40.98 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.885 1.674 . . . . 3.5299999999999998 112.942 174.508 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -54.7 1.63 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 130.159 3.384 . . . . 4.5599999999999996 120.086 -161.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 104.8 -23.49 30.96 Favored Glycine 0 N--CA 1.473 1.118 0 C-N-CA 125.861 1.696 . . . . 3.7999999999999998 113.465 -175.496 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -80.87 171.36 15.11 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 117.475 0.637 . . . . 5.0899999999999999 112.19 160.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 31.1 tpp 72.6 106.3 0.07 Allowed 'General case' 0 C--O 1.235 0.328 0 C-N-CA 129.165 2.986 . . . . 2.5499999999999998 112.49 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -131.1 157.3 43.48 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.429 1.892 . . . . 5.5099999999999998 111.129 -174.103 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -26.46 -74.88 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 128.34 2.656 . . . . 4.6699999999999999 114.921 -168.745 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.1 m -65.14 -17.0 64.11 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.543 1.312 . . . . 2.71 114.543 -169.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -76.17 -15.69 60.01 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.246 -0.909 . . . . 2.6299999999999999 112.919 173.065 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 81.0 mt -75.11 -30.15 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.1 0.96 . . . . 1.55 110.482 -178.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.2 -22.09 36.12 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.543 0.942 . . . . 2.6299999999999999 113.543 -179.643 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -68.75 -44.13 74.39 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 121.188 -0.945 . . . . 3.2400000000000002 109.886 157.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 17.1 tp -62.57 -39.03 92.36 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 117.684 -1.15 . . . . 1.78 110.958 -176.366 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.6 mmm -51.95 -56.79 12.01 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 126.022 1.729 . . . . 1.8200000000000001 112.113 167.453 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.4 tmmm? -58.91 -31.34 68.54 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.567 1.547 . . . . 3.2599999999999998 112.874 177.074 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 20.6 m -88.72 -26.86 21.56 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.82 1.648 . . . . 1.8999999999999999 112.775 -175.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.6 mp -66.52 -44.0 83.71 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.099 0.863 . . . . 3.2599999999999998 110.76 160.499 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -58.69 147.07 34.24 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 123.134 1.445 . . . . 2.5699999999999998 113.617 174.245 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.38 15.24 13.87 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.852 1.261 . . . . 2.9199999999999999 111.876 161.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 27.7 p-10 -137.85 -48.63 0.56 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.099 1.759 . . . . 3.3199999999999998 112.851 -177.153 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 2.9 t 95.62 104.18 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 129.163 2.985 . . . . 2.8900000000000001 108.383 -173.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.8 p30 -145.64 -139.31 0.1 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.736 1.215 . . . . 4.1799999999999997 109.349 -178.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -141.38 24.56 2.09 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.085 0.954 . . . . 4.2999999999999998 111.068 164.515 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -144.89 136.78 25.73 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 126.026 1.73 . . . . 3.2999999999999998 112.683 -173.372 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 39.8 mm -120.94 124.31 72.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 125.515 1.526 . . . . 1.0900000000000001 110.274 -173.431 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.4 -176.23 3.33 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.967 1.707 . . . . 2.9700000000000002 111.794 168.604 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -57.44 -37.5 72.92 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 116.326 1.973 . . . . 3.2999999999999998 116.326 175.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 43.5 mtmt -74.58 -31.95 62.22 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.835 0.854 . . . . 3.6600000000000001 111.964 -178.5 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.407 ' O ' HG12 ' A' ' 74' ' ' VAL . 77.4 mt-10 -69.76 -65.04 0.77 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.63 0.772 . . . . 2.2200000000000002 109.337 162.796 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -47.34 -36.45 9.49 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.996 2.119 . . . . 2.29 115.224 -174.764 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.5 m -70.0 -19.38 63.33 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 120.314 -1.491 . . . . 2.1699999999999999 111.97 -177.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.407 HG12 ' O ' ' A' ' 71' ' ' GLU . 0.8 OUTLIER -74.05 -22.29 18.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 O-C-N 121.292 -0.88 . . . . 2.0499999999999998 112.696 173.845 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -65.28 -66.5 0.54 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.449 1.5 . . . . 2.6600000000000001 110.477 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.418 ' H ' HD23 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -53.75 -33.2 55.01 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.316 1.446 . . . . 2.3700000000000001 112.523 170.101 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.6 m -59.57 -44.72 93.2 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.854 1.206 . . . . 0.94999999999999996 112.139 173.37 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 51.4 mtp -60.23 -42.94 96.28 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.933 0.788 . . . . 1.8700000000000001 111.234 178.025 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 44.0 mt -66.57 -50.04 64.41 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.332 1.053 . . . . 1.22 110.87 178.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 3.2 t -64.31 -27.26 68.91 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.269 1.428 . . . . 1.4099999999999999 113.051 -177.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 71.8 mtm -72.63 -39.39 67.25 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.051 1.13 . . . . 3.6699999999999999 114.051 165.445 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.6 -44.37 82.29 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.612 1.096 . . . . 1.3999999999999999 112.036 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -60.9 -24.75 66.22 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.669 0.618 . . . . 2.3100000000000001 112.669 173.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -65.93 -51.98 53.83 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 118.978 0.808 . . . . 2.4199999999999999 112.083 175.71 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -58.8 -51.05 71.63 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.207 1.803 . . . . 2.9199999999999999 111.581 174.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -50.93 -47.14 61.02 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.62 1.568 . . . . 2.8199999999999998 111.439 178.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -64.41 -33.76 76.62 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.913 0.885 . . . . 2.5600000000000001 112.852 -178.754 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.3 mt -74.61 -18.39 60.57 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.819 0.848 . . . . 2.1200000000000001 112.745 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -96.96 -13.91 22.05 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.742 1.386 . . . . 4.8499999999999996 114.742 172.383 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 28.8 t70 . . . . . 0 CA--C 1.539 0.551 0 C-N-CA 125.343 1.457 . . . . 3.1499999999999999 112.668 179.415 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 74.1 p . . . . . 0 N--CA 1.47 0.552 0 N-CA-C 110.225 -0.287 . . . . 1.8899999999999999 110.225 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -64.72 -6.62 12.74 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 123.04 2.493 . . . . 1.3899999999999999 114.692 175.491 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 10.6 mp -76.91 -55.52 5.4 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.907 1.231 . . . . 3.5699999999999998 111.165 174.833 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -59.62 -29.85 68.29 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-O 122.297 1.046 . . . . 4.3099999999999996 111.82 170.128 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.74 -37.15 65.17 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 119.411 -2.055 . . . . 4.7999999999999998 113.869 170.495 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.538 ' HB1' ' HB1' ' A' ' 8' ' ' ALA . . . -62.02 -45.46 93.47 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.507 1.123 . . . . 0.97999999999999998 112.467 170.107 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 58.8 mt -58.45 -44.64 89.31 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 124.758 1.223 . . . . 1.55 111.425 173.034 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 64.7 m -53.48 -56.17 19.2 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 118.272 -0.871 . . . . 1.47 110.711 169.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 94.9 m -58.86 -37.1 75.73 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.144 1.378 . . . . 1.6100000000000001 111.811 -178.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.2 mmm -59.06 -51.81 68.45 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.304 1.042 . . . . 3.23 112.674 171.059 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 85.6 t -68.79 -31.67 51.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 121.126 -0.984 . . . . 1.8899999999999999 111.909 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 31.8 m -59.02 -59.86 4.8 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.131 1.373 . . . . 1.1899999999999999 110.178 175.179 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.7 -31.48 71.47 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 124.743 1.217 . . . . 2.7799999999999998 110.046 -174.093 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -63.06 -46.73 86.13 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.892 0.701 . . . . 1.8600000000000001 112.892 174.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -61.99 -39.32 91.82 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.996 -1.065 . . . . 2.3500000000000001 112.408 175.137 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.475 ' HE2' ' CZ ' ' B' ' 19' ' ' TYR . 4.9 tttt -53.65 -33.44 55.24 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 125.501 1.52 . . . . 5.4900000000000002 113.468 171.341 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.475 ' CZ ' ' HE2' ' B' ' 18' ' ' LYS . 67.1 m-85 -96.02 -37.25 10.72 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 115.614 1.709 . . . . 2.1499999999999999 115.614 176.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 62.8 m -66.66 -22.69 66.09 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 116.661 2.097 . . . . 1.9099999999999999 116.661 -172.169 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.02 -17.18 63.56 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-O 118.43 -1.206 . . . . 2.0600000000000001 113.982 179.643 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 28.7 ttt-85 -58.07 -26.99 63.23 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.408 2.283 . . . . 3.79 114.107 -175.283 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -151.33 144.41 24.62 Favored 'General case' 0 C--O 1.243 0.76 0 C-N-CA 128.617 2.767 . . . . 3.79 108.382 178.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.18 -12.76 0.58 Allowed Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.318 1.437 . . . . 2.2200000000000002 114.766 -172.075 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 63.72 -159.66 0.3 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.56 1.944 . . . . 5.8300000000000001 110.747 -161.173 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 31.5 mmtm 73.62 -176.28 0.16 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.306 2.242 . . . . 8.8000000000000007 113.193 163.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -72.82 -9.3 58.51 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.79 1.236 . . . . 2.8100000000000001 113.521 168.859 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 28' ' ' THR . . . . . 0.435 ' HB ' ' HB3' ' B' ' 66' ' ' GLU . 5.9 p -90.43 135.21 33.83 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.974 1.309 . . . . 1.3400000000000001 110.954 -171.484 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -114.93 108.42 16.69 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.42 1.888 . . . . 2.0499999999999998 110.691 -159.758 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.487 ' HA ' ' HA ' ' B' ' 66' ' ' GLU . 0.9 OUTLIER -76.17 162.29 28.1 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 119.394 -2.066 . . . . 2.6400000000000001 115.364 -171.278 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -44.23 -38.28 3.71 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.728 0.811 . . . . 3.6499999999999999 112.176 169.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.66 -41.51 26.76 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.773 -1.204 . . . . 4.6799999999999997 114.055 177.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -58.31 -40.16 81.3 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.139 0.575 . . . . 1.76 109.978 173.565 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 18.3 tp -65.68 -41.86 91.93 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.818 1.247 . . . . 2.0099999999999998 112.669 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 20.7 mtpt -49.73 -53.06 27.08 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 120.305 1.411 . . . . 3.4399999999999999 111.483 176.171 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -67.14 -41.61 85.79 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 117.959 -1.02 . . . . 3.1200000000000001 113.305 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.6 tt -54.87 -54.21 45.41 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.618 1.099 . . . . 1.9399999999999999 110.471 175.346 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 29.1 mt -57.88 -48.57 83.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 118.186 -0.911 . . . . 1.3200000000000001 109.856 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -75.65 -8.12 56.01 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 115.205 1.557 . . . . 5.0700000000000003 115.205 -172.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -108.29 -45.24 3.95 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.162 1.385 . . . . 3.6499999999999999 112.353 174.755 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -80.23 -19.83 46.01 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.122 0.569 . . . . 5.5099999999999998 111.357 -178.238 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mp -128.66 174.14 9.68 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.351 1.861 . . . . 3.71 108.77 156.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 27.0 p -150.91 4.17 0.47 Allowed 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 116.755 2.132 . . . . 3.1400000000000001 116.755 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.422 ' H ' HD12 ' B' ' 44' ' ' LEU . 4.5 mp -43.16 -32.34 0.72 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 117.405 2.372 . . . . 3.0699999999999998 117.405 -168.24 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.64 -26.98 2.6 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 124.82 1.2 . . . . 2.9300000000000002 113.515 -178.408 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -61.03 -25.82 67.18 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.471 1.135 . . . . 5.7599999999999998 113.007 167.66 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.92 72.97 0.18 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 122.839 1.304 . . . . 2.7400000000000002 110.622 147.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.1 mppt? -66.13 159.23 26.64 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.05 -0.977 . . . . 4.9199999999999999 108.742 166.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -52.2 -37.66 55.55 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 113.359 0.874 . . . . 4.96 113.359 -177.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 35.2 t -62.37 -16.7 56.18 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 115.021 1.489 . . . . 4.1100000000000003 115.021 174.51 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 3.3 t -106.33 -3.38 21.22 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.419 1.488 . . . . 3.0800000000000001 112.264 173.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 19.6 mm -80.2 -44.0 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 O-C-N 120.025 -1.672 . . . . 1.8799999999999999 110.839 175.088 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -70.98 -42.58 69.48 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.55 0.574 . . . . 3.3700000000000001 112.55 -178.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.95 -35.08 69.48 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 120.43 -1.419 . . . . 2.4300000000000002 112.483 -177.732 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -54.42 -47.88 72.28 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.324 1.049 . . . . 2.5299999999999998 110.285 164.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.49 -44.33 89.35 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.849 1.26 . . . . 1.7 112.378 177.202 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -69.6 -27.22 64.91 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 120.832 -1.167 . . . . 4.1299999999999999 113.597 176.083 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 23.0 t -71.71 -36.13 70.44 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 121.125 -0.984 . . . . 2.8599999999999999 111.523 170.729 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 8.7 mp -62.78 -50.33 71.47 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-O 118.352 -0.833 . . . . 2.71 112.102 168.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -87.57 82.4 7.46 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 122.086 0.946 . . . . 1.6699999999999999 113.293 -169.32 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -21.65 58.74 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.121 1.156 . . . . 3.8100000000000001 114.121 -177.583 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -84.69 -22.89 29.62 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.28 0.945 . . . . 2.3700000000000001 112.101 175.599 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 32.2 t 58.5 38.92 25.44 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.576 1.151 . . . . 2.21 112.138 -167.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -88.54 -119.24 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.478 1.511 . . . . 3.04 107.152 176.405 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -148.6 -3.82 0.46 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 117.447 2.388 . . . . 4.5499999999999998 117.447 166.318 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 66' ' ' GLU . . . . . 0.487 ' HA ' ' HA ' ' B' ' 30' ' ' SER . 16.8 mt-10 -118.5 146.69 44.33 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 123.175 1.464 . . . . 3.25 112.702 166.699 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 67' ' ' ILE . . . . . 0.432 HG22 ' HB2' ' B' ' 72' ' ' TYR . 79.1 mt -103.07 115.62 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 126.958 2.103 . . . . 1.77 109.405 -175.6 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.74 161.73 25.57 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.808 2.043 . . . . 2.6299999999999999 111.2 169.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.2 -31.93 67.79 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 119.982 -1.699 . . . . 2.4300000000000002 114.749 -174.323 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.9 mtmp? -83.11 -16.98 44.7 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.222 1.409 . . . . 3.5099999999999998 113.151 177.048 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -70.66 -61.85 1.61 Allowed 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 107.389 -1.338 . . . . 1.99 107.389 156.466 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 72' ' ' TYR . . . . . 0.432 ' HB2' HG22 ' B' ' 67' ' ' ILE . 32.0 t80 -58.45 -29.86 66.49 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 127.975 2.51 . . . . 2.48 117.3 -171.117 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 60.2 p -58.29 -24.01 58.15 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 120.777 1.626 . . . . 2.3399999999999999 113.745 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.9 p -67.56 -22.82 28.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 O-C-N 121.529 -0.732 . . . . 2.0099999999999998 112.578 174.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -63.73 -51.15 66.21 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.233 1.013 . . . . 3.0800000000000001 110.397 174.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 39.5 mt -60.74 -44.56 96.52 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 124.183 0.993 . . . . 2.1000000000000001 110.39 176.693 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 43.4 m -54.69 -54.35 42.94 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.743 0.817 . . . . 1.03 111.423 176.459 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 48.5 mtm -60.32 -45.15 94.43 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.403 0.681 . . . . 1.78 112.124 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 82.4 mt -63.17 -43.71 97.5 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 118.467 0.576 . . . . 2.04 112.354 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 93.3 m -67.76 -33.82 75.6 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 122.742 0.417 . . . . 1.6899999999999999 112.073 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 64.5 mtp -68.56 -38.76 81.04 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 118.777 0.717 . . . . 2.04 112.847 172.477 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.23 -38.19 66.13 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.482 1.037 . . . . 0.89000000000000001 112.351 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -68.31 -25.66 65.24 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.403 1.001 . . . . 2.04 113.362 177.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 17.7 t30 -59.54 -46.09 89.89 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.358 0.981 . . . . 2.27 111.499 169.082 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.89 -34.69 44.55 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.307 1.443 . . . . 3.1400000000000001 111.973 -175.797 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -53.32 -54.49 35.77 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.331 1.452 . . . . 2.9500000000000002 110.019 166.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -54.11 -36.28 63.05 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.895 1.278 . . . . 2.7400000000000002 112.757 177.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 55.1 mt -74.16 -19.16 60.65 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.916 1.08 . . . . 2.1800000000000002 113.916 178.778 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -101.83 -14.94 17.07 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.567 1.321 . . . . 3.5699999999999998 114.567 171.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -96.47 -48.45 5.56 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.312 1.845 . . . . 4.7599999999999998 112.548 -176.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -87.83 46.75 1.41 Allowed 'General case' 0 CA--C 1.548 0.866 0 CA-C-O 122.903 1.335 . . . . 4.2699999999999996 111.316 173.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm . . . . . 0 C--O 1.25 1.107 0 CA-C-O 114.903 -2.475 . . . . 5.5700000000000003 114.894 168.874 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 . . . . . 0 CA--C 1.531 0.22 0 N-CA-C 108.648 -0.871 . . . . 3.8300000000000001 108.648 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.407 HG21 ' O ' ' B' ' 41' ' ' GLU . 7.9 t 174.13 150.76 0.25 Allowed Pre-proline 0 C--O 1.236 0.386 0 C-N-CA 127.331 2.253 . . . . 2.3999999999999999 107.612 -163.498 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -73.51 -24.25 16.38 Favored 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 121.925 1.75 . . . . 1.6399999999999999 112.437 175.564 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -69.54 -43.05 73.79 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.141 -0.933 . . . . 3.48 112.584 -171.557 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -53.08 -34.52 56.96 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 122.137 0.97 . . . . 4.2400000000000002 112.563 171.262 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 46.9 mttt -80.68 -25.52 38.16 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.67 -1.269 . . . . 4.2000000000000002 111.455 -179.037 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.47 -42.23 62.16 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.027 0.931 . . . . 1.05 111.198 169.461 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 83.7 mt -64.3 -43.02 96.04 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.185 0.994 . . . . 1.4099999999999999 111.224 171.741 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 87.2 m -55.35 -42.84 74.41 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.136 -0.977 . . . . 1.53 111.664 167.912 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.5 m -61.63 -38.34 87.3 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 119.763 1.165 . . . . 1.3700000000000001 111.387 178.73 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 33.1 ttm -56.34 -53.88 52.06 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 118.473 0.579 . . . . 3.0 111.388 169.924 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 93.2 t -62.39 -37.07 77.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-N 118.798 0.727 . . . . 1.8999999999999999 112.498 178.685 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 76.0 m -57.43 -59.17 5.55 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.907 1.283 . . . . 0.79000000000000004 110.408 177.315 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.21 -34.28 70.7 Favored 'General case' 0 CA--C 1.521 -0.167 0 C-N-CA 123.789 0.836 . . . . 2.5800000000000001 110.599 -170.109 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -57.59 -40.35 78.84 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.344 0.658 . . . . 2.2999999999999998 110.976 174.612 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 36.6 m170 -78.81 -28.17 44.45 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.931 1.086 . . . . 2.5299999999999998 113.931 176.972 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.1 mtmp? -60.27 -55.72 30.33 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.366 1.439 . . . . 4.6200000000000001 111.438 166.553 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -71.24 -32.28 68.57 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.516 -0.74 . . . . 2.1299999999999999 111.96 -177.485 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.0 t -73.04 -6.43 45.49 Favored 'General case' 0 C--O 1.247 0.948 0 N-CA-C 116.465 2.024 . . . . 2.4300000000000002 116.465 -178.389 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.7 -12.62 74.34 Favored Glycine 0 CA--C 1.539 1.551 0 CA-C-O 119.061 -0.855 . . . . 2.2400000000000002 113.02 166.338 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -60.98 -31.35 70.94 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.507 1.523 . . . . 6.7999999999999998 113.652 -177.315 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 173.13 -149.95 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 129.662 3.185 . . . . 4.2199999999999998 111.706 164.337 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.04 -149.44 21.8 Favored Glycine 0 N--CA 1.476 1.352 0 O-C-N 120.351 -1.468 . . . . 2.2200000000000002 111.973 -175.229 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.7 m -78.48 -177.49 5.31 Favored 'General case' 0 CA--C 1.55 0.975 0 O-C-N 121.007 -1.29 . . . . 2.2799999999999998 112.072 158.351 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.48 ' HZ2' ' C ' ' B' ' 92' ' ' LYS . 38.1 ttmt -84.54 -32.99 23.58 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.191 1.397 . . . . 4.4299999999999997 111.726 169.579 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.424 ' H ' HD23 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -82.07 6.84 14.99 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.923 1.689 . . . . 3.1800000000000002 114.711 178.022 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 24.1 p -146.95 150.9 36.09 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.843 1.657 . . . . 1.1499999999999999 110.554 -170.141 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 79.1 mt -116.82 109.36 16.99 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.248 1.019 . . . . 1.5 112.331 174.603 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.0 t -77.46 151.93 34.47 Favored 'General case' 0 CA--C 1.549 0.924 0 O-C-N 121.325 -0.859 . . . . 2.1499999999999999 111.886 173.316 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.42 -46.19 4.63 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 126.087 1.755 . . . . 5.5899999999999999 115.604 -172.169 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.38 -18.06 61.21 Favored 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 115.051 1.5 . . . . 4.8700000000000001 115.051 178.996 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -90.73 -45.57 8.77 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 128.77 2.828 . . . . 2.1299999999999999 109.837 175.276 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.19 -31.04 72.01 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.281 1.033 . . . . 2.7999999999999998 112.906 175.318 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.95 -17.72 65.05 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.754 1.39 . . . . 5.4000000000000004 114.754 177.097 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.22 -58.2 3.42 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.38 1.072 . . . . 3.6899999999999999 108.894 171.529 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.9 tt -50.03 -56.02 12.44 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.729 1.611 . . . . 1.8799999999999999 112.121 -179.145 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.5 mt -53.69 -60.19 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 CA-C-N 118.85 0.75 . . . . 0.82999999999999996 109.937 -175.142 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.4 tptt -72.39 -9.64 58.77 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 113.264 0.839 . . . . 5.8200000000000003 113.264 -174.794 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 46.0 mmtt -91.69 -35.91 13.91 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.82 1.648 . . . . 3.4300000000000002 114.988 173.702 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -104.25 -44.38 4.98 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.652 0.781 . . . . 5.1399999999999997 112.094 -175.04 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -104.47 61.4 0.72 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.434 1.894 . . . . 3.0099999999999998 107.92 175.131 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 59.1 m -45.8 -64.94 0.62 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.537 1.535 . . . . 3.6400000000000001 113.066 -166.955 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 95.9 mt 65.19 152.17 0.05 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 127.862 2.465 . . . . 4.5099999999999998 115.974 168.426 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.57 -25.29 63.35 Favored Glycine 0 N--CA 1.474 1.199 0 O-C-N 121.378 -0.826 . . . . 2.9300000000000002 111.336 171.513 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.48 -160.2 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 129.484 3.114 . . . . 6.7000000000000002 110.894 173.312 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 17.8 mmt 43.5 93.38 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.22 1.808 . . . . 2.9100000000000001 115.187 -179.729 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.53 126.96 50.99 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.131 -1.062 . . . . 4.2199999999999998 108.131 164.076 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -12.73 -83.7 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 127.705 2.402 . . . . 4.9299999999999997 114.951 -157.652 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.5 t -60.08 -11.44 5.98 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.884 1.809 . . . . 4.3600000000000003 115.884 -172.009 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.9 t -61.53 -13.88 24.97 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 120.749 -1.219 . . . . 1.96 113.513 164.684 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 88.9 mt -77.03 -21.35 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 126.585 1.954 . . . . 1.3500000000000001 111.828 171.156 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -70.66 -53.53 15.41 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.858 0.754 . . . . 3.0099999999999998 111.3 -169.462 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -67.47 -34.01 76.29 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 121.51 -0.744 . . . . 3.2999999999999998 111.889 172.467 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.6 tp -54.73 -59.37 4.8 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 118.52 -0.752 . . . . 1.9399999999999999 110.186 174.11 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -67.4 -33.02 74.32 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.465 0.575 . . . . 1.8100000000000001 112.161 -179.323 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.5 tmtm? -65.78 -22.25 66.56 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 120.782 -1.198 . . . . 6.1600000000000001 112.885 169.455 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.2 t -86.89 -28.33 22.88 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.352 1.861 . . . . 1.9099999999999999 112.637 170.054 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.7 mt -65.83 -33.71 76.48 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.436 -0.79 . . . . 1.97 111.335 167.444 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -68.32 99.14 0.89 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 122.636 1.208 . . . . 2.3999999999999999 111.818 176.925 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -67.42 -23.6 65.56 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.691 1.196 . . . . 5.0999999999999996 113.697 -176.764 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -83.9 -29.81 26.86 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.322 1.449 . . . . 2.98 112.079 167.81 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.7 t 72.25 41.67 0.61 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 128.707 2.803 . . . . 3.3700000000000001 112.143 -167.569 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -94.9 -117.82 0.1 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.736 1.615 . . . . 3.8599999999999999 106.775 -179.656 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -153.04 -9.12 0.17 Allowed 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 116.394 1.998 . . . . 4.4500000000000002 116.394 173.808 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -101.41 128.97 47.37 Favored 'General case' 0 C--O 1.242 0.665 0 N-CA-C 106.857 -1.534 . . . . 2.6000000000000001 106.857 171.788 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.413 HG22 ' HB2' ' A' ' 72' ' ' TYR . 20.1 mm -96.54 89.74 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 124.451 1.1 . . . . 1.25 109.586 174.086 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -56.68 151.95 13.02 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.698 1.199 . . . . 2.98 111.3 165.106 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -46.95 -39.92 13.31 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.356 1.243 . . . . 2.2999999999999998 114.356 -175.831 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.58 -10.04 58.53 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.708 1.203 . . . . 3.4100000000000001 113.906 -179.544 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -73.1 -63.2 1.23 Allowed 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 106.633 -1.617 . . . . 2.04 106.633 155.599 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.413 ' HB2' HG22 ' A' ' 67' ' ' ILE . 24.0 t80 -49.04 -30.84 6.75 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 128.375 2.67 . . . . 2.0800000000000001 115.74 -173.931 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.5 m -53.45 -30.54 41.15 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.597 -1.314 . . . . 1.9099999999999999 113.229 173.158 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.0 m -68.98 -27.01 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 CA-C-N 119.903 1.229 . . . . 2.6699999999999999 112.935 179.816 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -59.47 -55.09 39.06 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.11 0.964 . . . . 1.75 109.968 173.416 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 52.3 mt -71.12 -25.91 62.79 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.015 -0.993 . . . . 2.3799999999999999 111.481 -179.599 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 41.5 m -64.48 -51.53 62.56 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.154 0.888 . . . . 0.93999999999999995 111.33 169.582 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 29.3 mtm -58.1 -45.57 87.02 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.455 1.025 . . . . 1.6499999999999999 111.909 179.121 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 72.6 mt -67.15 -38.18 85.08 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.905 -0.497 . . . . 1.28 112.085 178.563 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 33.5 t -63.28 -31.6 72.8 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.248 0.619 . . . . 1.8400000000000001 112.387 172.541 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 71.1 mtp -68.39 -40.19 81.46 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 119.701 1.137 . . . . 1.6599999999999999 112.324 167.448 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.15 -42.52 99.47 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.762 0.71 . . . . 0.77000000000000002 112.654 -179.112 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -60.69 -26.68 67.3 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.876 1.065 . . . . 3.0699999999999998 113.876 173.354 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -69.96 -37.7 75.88 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.466 1.03 . . . . 1.9199999999999999 112.796 176.402 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -73.04 -38.5 66.48 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.687 0.795 . . . . 3.2000000000000002 111.253 176.866 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -53.16 -51.47 61.9 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.131 1.372 . . . . 2.3900000000000001 110.959 172.198 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -55.54 -27.35 48.38 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.387 1.475 . . . . 2.3399999999999999 113.156 178.2 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 44.3 mt -84.03 -12.21 55.55 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.589 1.156 . . . . 1.73 113.496 178.776 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 82.0 mm-40 -90.88 -38.34 12.99 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.266 1.026 . . . . 2.79 113.147 165.882 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 . . . . . 0 CA--C 1.544 0.721 0 C-N-CA 126.975 2.11 . . . . 3.4300000000000002 114.637 -178.245 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 64.2 p . . . . . 0 N--CA 1.475 0.808 0 N-CA-C 112.626 0.602 . . . . 2.1699999999999999 112.626 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -67.32 -21.25 47.82 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.899 2.4 . . . . 1.79 112.855 172.404 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -63.49 -45.79 89.14 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-N 118.877 0.762 . . . . 2.4100000000000001 110.487 166.219 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.51 -48.19 82.18 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 118.594 0.634 . . . . 3.7599999999999998 110.579 173.233 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 7' ' ' LYS . . . . . 0.499 ' HE3' ' HA ' ' B' ' 7' ' ' LYS . 0.0 OUTLIER -58.09 -25.17 60.98 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 120.576 -1.327 . . . . 4.29 114.508 175.026 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.57 -41.69 99.09 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.498 0.59 . . . . 1.3999999999999999 110.924 176.262 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 29.2 mt -57.78 -48.62 79.15 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.251 1.02 . . . . 1.8100000000000001 111.324 172.963 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.1 -48.27 79.03 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.919 0.888 . . . . 1.1599999999999999 111.018 177.622 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -72.54 -32.54 66.17 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.163 -0.922 . . . . 2.3399999999999999 111.932 -177.817 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 7.6 mtp -64.42 -41.5 96.57 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.486 1.114 . . . . 2.9399999999999999 112.328 171.796 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.78 -36.89 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 119.629 1.104 . . . . 1.8600000000000001 111.422 169.328 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 88.7 m -63.77 -54.77 30.04 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 118.069 -0.967 . . . . 0.90000000000000002 110.89 -176.524 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.7 p -63.7 -44.64 93.09 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.056 0.942 . . . . 1.74 110.03 176.949 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -65.17 -47.12 78.1 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.484 -0.486 . . . . 2.3999999999999999 110.886 -174.472 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -67.51 -44.81 77.53 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 120.796 -1.19 . . . . 2.5699999999999998 111.968 177.719 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -65.34 -20.81 66.56 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 120.78 -1.2 . . . . 4.5300000000000002 113.839 178.727 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -98.73 -1.18 41.18 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.625 0.972 . . . . 2.3599999999999999 113.625 164.814 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 41.8 m -87.26 -48.93 7.61 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 120.702 1.592 . . . . 1.6799999999999999 113.173 175.535 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.28 13.0 57.06 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.376 1.941 . . . . 1.78 112.693 174.478 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 8.8 ttm-85 -65.11 -59.33 4.23 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.033 1.333 . . . . 2.9900000000000002 109.507 169.451 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -156.35 -172.43 4.08 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 126.263 1.825 . . . . 3.6600000000000001 110.461 -169.506 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.59 -135.69 47.24 Favored Glycine 0 N--CA 1.472 1.092 0 O-C-N 120.962 -1.086 . . . . 2.5499999999999998 110.667 -178.972 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 6.6 t -82.19 158.89 23.41 Favored 'General case' 0 C--O 1.247 0.931 0 CA-C-O 123.329 1.538 . . . . 3.5 111.2 154.723 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -84.52 155.75 22.0 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.993 1.317 . . . . 7.54 110.33 170.899 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.5 tt 71.42 -21.59 0.21 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.516 1.927 . . . . 3.21 112.868 -166.45 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.3 p -107.2 150.58 26.47 Favored 'General case' 0 C--O 1.253 1.237 0 C-N-CA 126.223 1.809 . . . . 1.01 115.099 174.337 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -98.48 108.51 21.22 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 129.784 3.233 . . . . 2.1099999999999999 111.712 173.045 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 9.5 t -85.51 161.94 19.14 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.282 1.033 . . . . 2.0699999999999998 113.279 174.773 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 33.5 ttt85 -50.2 -19.53 0.8 Allowed 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 117.293 2.331 . . . . 3.6099999999999999 117.293 -174.964 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.21 -25.35 12.02 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.286 1.217 . . . . 4.4900000000000002 114.286 170.702 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -62.12 -51.91 66.0 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 108.362 -0.977 . . . . 2.0499999999999998 108.362 169.485 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 8.1 tp -60.31 -38.79 84.77 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 125.172 1.389 . . . . 1.9199999999999999 112.651 179.173 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -55.74 -41.75 74.37 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 122.098 -0.376 . . . . 3.0600000000000001 110.851 175.972 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -65.34 -49.52 69.08 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 117.834 -1.079 . . . . 3.4100000000000001 113.293 169.631 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 tt -53.25 -48.9 67.85 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 120.155 1.343 . . . . 2.1200000000000001 111.671 -179.259 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 5.8 mt -65.35 -40.18 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 120.087 1.312 . . . . 0.91000000000000003 110.583 178.915 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -65.2 0.17 1.48 Allowed 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 114.572 1.323 . . . . 5.1900000000000004 114.572 171.566 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -119.78 -45.93 2.47 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.662 1.585 . . . . 3.5 112.971 177.79 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 41' ' ' GLU . . . . . 0.407 ' O ' HG21 ' A' ' 3' ' ' THR . 28.5 mt-10 -72.72 -29.34 63.27 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-O 117.418 -1.277 . . . . 4.29 112.785 175.367 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -125.24 -81.7 0.63 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.909 1.684 . . . . 2.5299999999999998 110.469 -175.978 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.5 t 64.07 -44.24 0.27 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 129.01 2.924 . . . . 4.79 115.745 -175.555 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 4.3 pp -61.92 -15.39 42.67 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 127.771 2.429 . . . . 3.3399999999999999 115.941 -167.707 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -79.92 13.17 26.32 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 124.346 0.974 . . . . 3.3799999999999999 114.148 171.757 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 61.43 56.07 2.69 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.205 2.202 . . . . 7.1799999999999997 111.811 -176.965 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.77 74.41 0.59 Allowed 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 115.624 1.712 . . . . 3.3100000000000001 115.624 -161.639 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -88.38 168.88 12.29 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 127.367 2.267 . . . . 5.2599999999999998 112.443 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -48.1 -53.61 15.96 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.789 1.236 . . . . 4.6200000000000001 113.146 -178.83 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 21.5 t -66.13 5.11 0.56 Allowed 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 115.652 1.723 . . . . 3.3500000000000001 115.652 -179.605 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 43.0 t -119.41 -40.63 2.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.17 1.388 . . . . 2.2200000000000002 111.765 166.732 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 26.0 mm -59.67 -33.93 53.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.612 1.565 . . . . 1.3200000000000001 112.507 174.307 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -70.67 -42.09 71.2 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.998 1.319 . . . . 4.1500000000000004 112.339 179.729 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -74.36 -42.23 59.69 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 124.362 1.065 . . . . 2.98 111.61 177.49 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 49.2 tp -58.73 -46.62 86.97 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.05 0.94 . . . . 2.3199999999999998 110.513 171.465 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 17.4 tpp -54.26 -49.18 70.13 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.059 0.943 . . . . 2.1000000000000001 110.773 174.334 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.65 -22.49 45.97 Favored 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 114.307 1.225 . . . . 4.1100000000000003 114.307 175.605 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.8 t -92.85 -28.25 16.64 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 120.744 -1.223 . . . . 2.6299999999999999 113.427 171.477 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.81 -42.44 27.75 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 127.924 2.49 . . . . 2.0 112.724 -179.127 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -99.34 128.4 45.45 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 124.776 1.231 . . . . 1.9299999999999999 110.24 166.546 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -95.27 -11.34 28.09 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.741 -0.599 . . . . 3.6699999999999999 112.606 173.794 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 62' ' ' ASN . . . . . 0.555 ' HB2' ' H ' ' B' ' 64' ' ' ASP . 5.2 m120 -94.32 -32.98 13.38 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.515 1.302 . . . . 1.8100000000000001 114.515 -169.502 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 9.2 t 72.91 15.87 4.57 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.161 1.384 . . . . 2.9300000000000002 112.462 -156.048 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 64' ' ' ASP . . . . . 0.555 ' H ' ' HB2' ' B' ' 62' ' ' ASN . 53.9 p-10 -71.94 -18.45 62.01 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.382 1.073 . . . . 2.1000000000000001 109.802 169.741 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 61.08 21.23 11.64 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 128.98 2.912 . . . . 4.4199999999999999 111.853 -178.758 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -126.23 144.9 50.61 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 128.375 2.67 . . . . 2.1200000000000001 109.657 171.811 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 16.0 mt -128.3 130.26 69.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 125.791 1.637 . . . . 1.3200000000000001 109.428 -171.325 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.34 173.01 6.49 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.915 1.686 . . . . 2.9700000000000002 111.516 168.868 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -47.25 -40.77 17.26 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.235 1.414 . . . . 3.1899999999999999 114.811 176.881 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 24.2 mtmm -70.28 -43.93 69.42 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.526 -0.734 . . . . 3.4300000000000002 110.986 -176.651 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -61.34 -47.22 86.89 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.185 0.994 . . . . 2.2400000000000002 110.642 173.773 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -58.89 -22.0 58.59 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 128.499 2.719 . . . . 2.5899999999999999 113.647 177.448 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 9.4 t -53.31 -35.26 59.95 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 120.982 -1.074 . . . . 2.6099999999999999 111.714 168.491 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 65.0 t -66.14 -31.89 55.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 O-C-N 121.248 -0.907 . . . . 1.6799999999999999 112.15 -179.868 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 75' ' ' PHE . . . . . 0.434 ' CE1' HD11 ' B' ' 79' ' ' LEU . 36.0 t80 -67.53 -56.98 7.34 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.431 1.092 . . . . 2.6800000000000002 111.849 173.522 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 77.8 mt -55.43 -39.82 70.74 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.046 1.338 . . . . 1.71 111.397 179.309 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 58.6 m -65.39 -52.19 55.16 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.141 1.376 . . . . 0.96999999999999997 111.815 176.538 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 16.7 ptp -65.63 -38.0 88.16 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.426 1.012 . . . . 2.3900000000000001 112.677 -177.412 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.434 HD11 ' CE1' ' B' ' 75' ' ' PHE . 92.3 mt -65.78 -47.01 76.58 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.269 0.628 . . . . 1.53 111.101 175.73 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 94.0 m -65.61 -32.58 74.23 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.462 -0.774 . . . . 1.71 112.611 176.864 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 52.9 mtm -65.85 -37.04 85.12 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.923 1.238 . . . . 3.1899999999999999 112.715 172.238 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.28 -42.42 98.61 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.602 1.092 . . . . 0.96999999999999997 112.593 173.313 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -69.67 -32.9 71.8 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.533 0.938 . . . . 2.79 113.533 172.682 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -58.8 -48.97 79.43 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.175 0.898 . . . . 2.6499999999999999 112.062 172.282 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -59.26 -48.66 80.79 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.163 1.385 . . . . 3.1800000000000002 111.44 177.78 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.09 -45.44 68.2 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.448 1.499 . . . . 2.6099999999999999 112.326 175.242 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -71.21 -28.18 64.03 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.31 1.444 . . . . 2.2400000000000002 112.861 -177.665 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 78.9 mt -77.74 -8.95 58.69 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.883 1.068 . . . . 2.3399999999999999 113.883 177.677 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -92.69 -3.38 54.96 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 119.298 0.954 . . . . 5.1200000000000001 113.333 167.564 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -99.7 -74.84 0.58 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.237 1.415 . . . . 4.96 110.203 166.926 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.32 -7.78 54.9 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 116.311 1.967 . . . . 5.1100000000000003 116.311 -167.159 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 92' ' ' LYS . . . . . 0.48 ' C ' ' HZ2' ' A' ' 26' ' ' LYS 0.26 4.0 tttp . . . . . 0 C--O 1.248 0.976 1 C-N-CA 131.827 4.051 . . . . 9.0399999999999991 116.897 -158.704 . . . . . . . . 3 2 . 1 . 022 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 . . . . . 0 CA--C 1.529 0.168 0 N-CA-C 107.711 -1.218 . . . . 3.3100000000000001 107.711 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 66.4 p -135.96 162.39 57.03 Favored Pre-proline 0 C--O 1.238 0.474 0 C-N-CA 124.96 1.304 . . . . 1.55 109.846 160.914 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -64.31 -22.78 66.22 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 121.826 1.684 . . . . 1.3400000000000001 112.091 166.551 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -69.68 -52.01 29.55 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.532 1.133 . . . . 3.5600000000000001 111.649 177.071 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -52.28 -44.22 64.86 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.563 1.145 . . . . 4.0599999999999996 111.041 175.196 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.537 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -77.35 -34.35 55.18 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 115.317 1.599 . . . . 5.8799999999999999 115.317 -178.936 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.39 -42.17 77.47 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 123.441 0.697 . . . . 1.23 112.001 165.039 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 74.0 mt -70.39 -34.19 72.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.264 0.938 . . . . 1.8400000000000001 112.37 173.911 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 5.1 m -60.56 -46.51 89.94 Favored 'General case' 0 N--CA 1.479 0.981 0 O-C-N 121.063 -1.023 . . . . 1.5800000000000001 110.937 167.463 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.5 m -57.86 -41.36 82.28 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.868 1.667 . . . . 1.6200000000000001 111.221 -179.003 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 19.0 tpp -52.93 -56.78 13.41 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 117.953 -1.023 . . . . 3.75 111.852 168.702 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -62.35 -32.8 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 CA-C-N 120.983 1.719 . . . . 2.3100000000000001 113.106 -176.425 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.4 m -60.83 -58.93 6.39 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.631 1.172 . . . . 1.1299999999999999 111.069 173.787 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 t -73.54 -30.03 62.82 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 117.332 -1.318 . . . . 3.1299999999999999 110.399 -171.141 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -53.82 -53.03 58.16 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 125.677 1.591 . . . . 2.4300000000000002 110.01 170.708 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -59.15 -29.04 67.13 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.123 1.157 . . . . 2.2799999999999998 114.123 175.141 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.9 tttp -64.67 -31.72 73.07 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 120.724 -1.235 . . . . 4.1699999999999999 112.57 176.258 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -94.84 -38.7 10.62 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.729 1.212 . . . . 2.1299999999999999 112.778 177.452 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.3 p -70.05 -25.97 63.8 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.109 1.322 . . . . 2.2599999999999998 113.343 174.304 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.24 40.74 2.94 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 126.807 2.146 . . . . 2.4100000000000001 113.871 171.729 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -96.27 -26.34 15.44 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 118.941 1.371 . . . . 5.0499999999999998 112.349 166.059 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.02 153.38 42.16 Favored 'General case' 0 C--O 1.245 0.856 0 C-N-CA 128.722 2.809 . . . . 5.4400000000000004 110.24 177.984 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 46.46 -108.52 0.27 Allowed Glycine 0 C--N 1.345 1.038 0 C-N-CA 127.255 2.36 . . . . 3.0 114.996 147.396 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 m -59.9 102.82 0.17 Allowed 'General case' 0 C--O 1.241 0.635 0 N-CA-C 108.77 -0.826 . . . . 2.7400000000000002 108.77 166.669 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.7 -15.47 56.41 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.04 0.755 . . . . 5.0 113.04 -176.381 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 10.7 mp -83.96 -49.23 9.17 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 126.012 1.725 . . . . 4.6299999999999999 110.986 177.098 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.4 p -111.31 170.36 8.17 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.939 2.096 . . . . 2.0800000000000001 113.331 -168.748 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 46.7 mt -116.55 103.73 10.7 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.456 1.502 . . . . 1.48 113.04 -162.796 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.94 172.47 10.87 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 121.18 -0.95 . . . . 2.1600000000000001 112.114 165.804 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.53 -48.64 2.86 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.593 1.957 . . . . 3.9500000000000002 114.594 -177.667 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -41.53 74.55 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.657 -0.652 . . . . 6.5199999999999996 112.239 -178.616 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 87.8 mt-10 -67.55 -44.38 78.41 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.369 -0.604 . . . . 1.96 109.369 -178.06 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.83 -52.31 66.0 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.728 1.211 . . . . 2.1499999999999999 112.156 177.264 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 15.5 ptmt -63.75 -25.81 68.36 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 120.288 1.404 . . . . 3.52 114.217 -176.204 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -81.84 -50.94 8.63 Favored 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 124.927 1.291 . . . . 3.27 110.634 -177.726 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.1 tt -46.68 -55.22 8.09 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 125.407 1.483 . . . . 2.1400000000000001 110.209 177.245 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.0 mt -51.59 -55.55 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 118.701 0.682 . . . . 1.3 110.689 -178.903 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -68.8 -23.45 64.29 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.984 0.735 . . . . 3.9700000000000002 112.984 -172.768 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.78 -14.99 22.85 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 126.81 2.044 . . . . 5.9500000000000002 113.258 -179.22 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -79.42 -54.82 5.55 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.977 1.311 . . . . 4.4800000000000004 109.487 161.374 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.0 mt -119.3 91.31 3.52 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.85 1.66 . . . . 3.2200000000000002 110.729 -179.167 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 4.6 t -84.74 71.18 10.86 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.282 -0.886 . . . . 3.0600000000000001 109.756 168.121 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 pp -171.41 -179.39 2.59 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 128.067 2.547 . . . . 3.8700000000000001 110.112 -172.222 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 65.12 13.4 57.59 Favored Glycine 0 N--CA 1.477 1.404 0 O-C-N 121.707 -0.621 . . . . 4.5700000000000003 112.339 -173.796 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 44.5 53.03 7.27 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 129.568 3.147 . . . . 6.0499999999999998 109.878 178.934 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.1 tpp -67.36 80.69 0.15 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.344 1.858 . . . . 1.95 113.962 -157.425 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -74.11 129.67 38.29 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.956 2.503 . . . . 5.2199999999999998 109.467 178.602 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -64.87 -10.29 27.46 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 116.348 1.981 . . . . 3.9199999999999999 116.348 -159.757 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.8 t -60.21 -28.81 68.29 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.245 -1.535 . . . . 4.2300000000000004 113.555 166.329 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.0 p -90.53 1.12 57.01 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.929 1.241 . . . . 2.5299999999999998 113.194 172.251 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 19.8 mm -82.18 -40.45 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 119.121 0.873 . . . . 2.0899999999999999 110.924 167.534 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -67.73 -52.47 37.26 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 118.649 0.658 . . . . 4.9699999999999998 112.751 -171.024 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -72.69 -26.47 61.63 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.929 -0.482 . . . . 3.2200000000000002 112.025 -179.173 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.32 -51.27 70.22 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 117.669 -1.158 . . . . 2.3700000000000001 109.551 165.771 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ttt -52.76 -46.26 67.42 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 119.932 1.242 . . . . 1.4299999999999999 111.838 174.132 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -68.69 -26.24 65.19 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 120.952 1.705 . . . . 3.52 113.442 177.651 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.1 t -71.69 -28.68 63.87 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 120.953 -1.092 . . . . 2.9399999999999999 111.741 172.239 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 11.8 mt -72.88 -58.82 3.05 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.915 -1.115 . . . . 1.8799999999999999 109.855 165.559 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -84.25 61.3 6.46 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.542 1.937 . . . . 1.5600000000000001 111.665 -177.253 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.0 mttp -52.01 -20.7 2.55 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 127.561 2.344 . . . . 3.1099999999999999 114.472 -171.253 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 35.1 p-10 -111.27 -0.85 16.28 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 129.074 2.95 . . . . 2.5099999999999998 114.125 -175.499 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.6 t 67.42 30.59 6.81 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.775 1.23 . . . . 2.2599999999999998 114.268 168.134 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -90.17 -9.13 49.32 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.42 1.488 . . . . 2.7400000000000002 112.826 -176.408 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.28 -9.64 1.43 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 129.69 3.196 . . . . 4.3200000000000003 116.9 178.088 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -106.51 142.0 36.89 Favored 'General case' 0 C--O 1.247 0.971 0 C-N-CA 125.701 1.6 . . . . 2.8300000000000001 112.205 173.738 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.5 mt -120.37 101.06 10.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-O 122.854 1.312 . . . . 1.5 111.867 -167.852 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.45 ' OD1' ' HE3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -74.27 158.45 34.04 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 129.053 2.941 . . . . 3.27 111.998 171.527 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.79 -25.8 67.41 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 120.636 -1.29 . . . . 2.5600000000000001 114.09 -174.425 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.455 ' HE2' ' SD ' ' B' ' 81' ' ' MET . 2.5 mtmt -81.55 -33.47 31.68 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 120.548 1.522 . . . . 3.3399999999999999 111.872 173.535 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -54.94 -53.59 53.67 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.027 0.831 . . . . 2.1699999999999999 109.003 165.27 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -66.01 -33.73 76.47 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 127.196 2.199 . . . . 2.1000000000000001 114.751 -175.943 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.33 -21.37 61.98 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 120.443 -1.411 . . . . 1.97 113.304 -175.348 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 p -60.13 -26.98 38.03 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 O-C-N 121.315 -0.865 . . . . 2.3300000000000001 112.477 171.697 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -68.0 -51.59 45.41 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 126.679 1.992 . . . . 2.4199999999999999 111.361 178.971 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.75 -46.85 67.65 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.178 0.991 . . . . 2.23 109.841 169.786 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 20.6 m -61.42 -55.53 30.33 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.974 0.909 . . . . 0.94999999999999996 111.238 -176.675 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 21.1 ptm -66.53 -36.33 82.43 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.814 0.672 . . . . 1.95 112.814 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.4 mt -66.54 -41.56 88.51 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.177 -0.916 . . . . 1.26 111.43 173.437 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.5 m -64.25 -36.73 85.05 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 120.051 1.296 . . . . 1.4099999999999999 112.731 175.57 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 38.1 mmm -61.17 -44.82 96.71 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.054 0.542 . . . . 2.0600000000000001 111.202 174.063 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.27 -38.5 81.8 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.772 0.829 . . . . 0.95999999999999996 112.236 -178.608 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -65.93 -27.46 68.2 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.319 0.859 . . . . 2.3700000000000001 113.319 175.036 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -70.14 -36.66 74.93 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 119.254 0.934 . . . . 2.5699999999999998 112.15 173.809 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -67.14 -43.58 82.0 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.885 0.874 . . . . 3.4500000000000002 110.847 175.926 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -52.6 -44.73 66.18 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.719 1.608 . . . . 2.9100000000000001 112.358 173.361 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -62.61 -27.23 69.06 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.069 1.748 . . . . 2.6800000000000002 112.541 178.892 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 45.3 mt -83.07 -18.6 39.06 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.403 1.081 . . . . 2.5699999999999998 112.84 177.156 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -90.26 -10.32 44.68 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.718 1.377 . . . . 3.2200000000000002 114.718 171.854 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 18.1 t70 . . . . . 0 N--CA 1.468 0.471 0 C-N-CA 126.034 1.734 . . . . 3.0600000000000001 112.591 169.011 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 9.6 t . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 112.256 0.465 . . . . 3.9500000000000002 112.256 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -66.95 -9.11 23.74 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.181 1.921 . . . . 2.4199999999999999 113.081 172.691 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.404 ' O ' HD13 ' B' ' 5' ' ' LEU . 0.3 OUTLIER -69.56 -37.7 77.11 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 117.098 -1.43 . . . . 2.8199999999999998 112.6 176.931 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 13.4 tm-20 -54.34 -42.04 69.78 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 121.427 1.921 . . . . 5.0 110.137 179.118 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 38.5 mtmt -55.05 -23.72 21.4 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.603 0.964 . . . . 7.3899999999999997 113.603 175.961 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.82 -49.03 61.87 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 120.731 -1.231 . . . . 0.94999999999999996 111.007 176.274 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -57.42 -48.91 77.88 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 119.393 0.997 . . . . 2.8900000000000001 109.886 178.858 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 13.9 p -64.15 -44.22 92.79 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.394 1.078 . . . . 2.0899999999999999 112.684 177.937 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 26.9 m -70.2 -32.16 69.94 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.64 1.109 . . . . 1.53 110.813 178.853 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -70.78 -50.26 37.7 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.12 0.968 . . . . 3.5699999999999998 111.045 176.682 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 6.3 p -59.83 -27.3 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-N 120.509 1.504 . . . . 2.2999999999999998 112.104 175.122 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 60.7 m -64.81 -57.8 7.93 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 116.921 -1.514 . . . . 0.92000000000000004 111.593 175.159 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.9 p -61.61 -41.48 97.53 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.147 1.34 . . . . 1.6100000000000001 109.07 175.317 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -64.45 -49.56 70.95 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 120.515 -0.474 . . . . 2.1299999999999999 111.604 -170.369 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 12.0 t60 -69.23 -44.69 71.5 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.774 -0.579 . . . . 2.4199999999999999 111.225 178.532 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -66.78 -39.47 87.83 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.015 -1.053 . . . . 4.2800000000000002 112.91 -175.289 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -80.18 -27.31 38.96 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.62 0.768 . . . . 2.29 112.424 173.016 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 57.0 m -68.91 -22.92 64.13 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.169 1.349 . . . . 2.4900000000000002 112.716 168.292 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.08 11.33 72.48 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 125.656 1.598 . . . . 1.77 115.45 178.127 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.478 HH11 ' HG3' ' B' ' 22' ' ' ARG . 7.9 mmt85 -80.77 -23.38 39.38 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.196 1.398 . . . . 4.29 114.181 177.994 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -164.01 149.64 10.86 Favored 'General case' 0 C--O 1.25 1.088 0 C-N-CA 126.481 1.913 . . . . 3.2400000000000002 108.738 -171.215 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.78 -142.32 16.6 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-O 121.702 0.612 . . . . 2.3100000000000001 111.855 -174.301 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 58.9 m -75.17 151.51 38.51 Favored 'General case' 0 C--O 1.242 0.661 0 O-C-N 121.331 -1.099 . . . . 3.8599999999999999 112.55 178.714 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -71.84 56.55 0.3 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.759 2.024 . . . . 5.9100000000000001 111.915 167.038 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 59.5 tp -160.2 -42.81 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.116 1.366 . . . . 4.0 110.0 -170.556 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.4 p -101.45 140.25 35.99 Favored 'General case' 0 C--O 1.251 1.15 0 C-N-CA 125.066 1.346 . . . . 1.77 110.297 173.842 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.45 ' H ' HD23 ' B' ' 29' ' ' LEU 0.263 1.8 pt? -98.58 94.72 6.83 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 122.334 1.064 . . . . 3.27 109.493 158.042 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 5.6 m -65.33 165.24 12.07 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 126.729 2.012 . . . . 3.0899999999999999 112.532 -176.004 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 31' ' ' ARG . . . . . 0.5 HH22 ' CG ' ' B' ' 53' ' ' ASP . 0.9 OUTLIER -30.07 -39.07 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 128.394 2.678 . . . . 5.25 117.14 -178.191 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.4 -37.9 11.22 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.793 1.405 . . . . 4.3300000000000001 114.793 174.115 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -53.44 -41.54 66.2 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.71 1.204 . . . . 2.0699999999999998 109.579 174.305 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.453 HD23 ' HB2' ' B' ' 56' ' ' MET . 24.7 tp -71.41 -40.89 70.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.108 0.963 . . . . 1.8200000000000001 113.473 179.7 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 24.1 ttmt -62.84 -45.09 94.21 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 120.837 -1.165 . . . . 3.1099999999999999 111.949 176.003 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -52.81 -56.83 12.86 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.378 1.471 . . . . 3.2200000000000002 111.993 167.006 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -60.05 -47.82 84.28 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.707 1.603 . . . . 2.5800000000000001 112.846 -174.71 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.8 mt -59.24 -48.27 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 CA-C-N 120.254 1.388 . . . . 1.05 109.547 175.485 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -62.53 -22.86 66.62 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.107 0.78 . . . . 4.0499999999999998 113.107 -179.489 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -82.06 -53.62 5.96 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 117.353 -1.308 . . . . 3.6899999999999999 113.383 168.806 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -67.45 -35.97 80.27 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.632 1.173 . . . . 4.2300000000000004 112.527 -172.961 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -92.03 -73.89 0.53 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.924 1.29 . . . . 3.1600000000000001 110.263 174.178 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 11.9 t 66.13 -40.76 0.35 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 127.908 2.483 . . . . 3.8399999999999999 113.616 -168.858 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 pp -62.5 174.31 1.02 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 128.063 2.545 . . . . 3.4900000000000002 113.787 172.087 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.04 -142.04 23.88 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 115.456 -0.793 . . . . 3.0699999999999998 111.836 167.131 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -119.32 57.47 0.89 Allowed 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 122.399 1.095 . . . . 5.1900000000000004 109.564 178.206 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.76 47.53 1.4 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 124.234 1.969 . . . . 2.5899999999999999 113.401 -175.059 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 37.5 mttp -81.42 152.56 27.35 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.121 2.168 . . . . 4.1299999999999999 112.169 172.192 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -47.44 -54.04 12.45 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.49 1.293 . . . . 3.3399999999999999 114.49 -163.155 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 9.0 t -61.25 -23.7 65.84 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 120.184 1.356 . . . . 3.1699999999999999 113.945 -176.292 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 9.8 t -86.71 -9.37 56.08 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.978 0.808 . . . . 2.1600000000000001 112.94 174.95 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 22.3 mt -97.52 -40.05 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 125.9 1.68 . . . . 1.3400000000000001 110.833 172.32 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.5 ' CG ' HH22 ' B' ' 31' ' ' ARG . 0.9 OUTLIER -67.52 -39.2 85.08 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 126.076 1.75 . . . . 4.0099999999999998 110.08 176.567 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -69.8 -44.92 69.07 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 118.559 0.618 . . . . 2.96 112.337 166.102 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 7.4 tt -57.85 -44.37 86.48 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.466 1.03 . . . . 2.2799999999999998 111.186 -177.893 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 56' ' ' MET . . . . . 0.453 ' HB2' HD23 ' B' ' 34' ' ' LEU . 1.9 ppp? -67.06 -38.8 86.43 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.453 1.024 . . . . 2.1699999999999999 111.959 176.972 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 1.4 tmpt? -62.74 -23.39 67.16 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.905 1.282 . . . . 3.9700000000000002 112.812 169.317 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 22.1 m -92.31 -22.45 19.72 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.639 1.576 . . . . 2.6299999999999999 112.95 178.218 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 19.2 mt -67.09 -47.67 70.51 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 118.643 0.656 . . . . 1.9199999999999999 109.731 163.403 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -78.08 141.66 38.66 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.949 1.3 . . . . 2.5899999999999999 113.832 -173.266 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -115.5 3.31 14.04 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.018 1.327 . . . . 3.3999999999999999 112.2 178.523 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -117.37 -28.94 5.99 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.612 1.565 . . . . 2.7799999999999998 112.933 -162.378 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 46.0 m 67.83 29.37 6.74 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 129.227 3.011 . . . . 2.79 112.52 -161.983 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 37.2 p30 -85.31 -14.32 46.88 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 120.695 -1.253 . . . . 2.4700000000000002 112.383 -170.92 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 58.99 4.63 0.43 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 129.901 3.28 . . . . 4.7999999999999998 115.236 -168.2 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -105.22 122.34 45.73 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 127.472 2.309 . . . . 2.8399999999999999 110.589 176.535 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 32.1 mm -101.87 107.03 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 114.646 -1.161 . . . . 1.8100000000000001 109.823 175.391 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.48 158.29 32.22 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.829 2.051 . . . . 4.1900000000000004 112.516 173.243 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -50.39 -25.57 4.03 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.278 1.431 . . . . 3.1200000000000001 113.219 163.114 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm -91.72 -16.96 26.15 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 115.623 1.712 . . . . 5.1299999999999999 115.623 176.283 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -89.89 -44.18 10.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.586 1.154 . . . . 1.8899999999999999 109.725 172.703 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -54.42 -22.12 11.64 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.518 1.927 . . . . 1.8500000000000001 114.297 179.17 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 41.0 p -55.76 -29.57 59.82 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 119.869 -1.769 . . . . 2.2000000000000002 113.068 168.393 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 88.2 t -61.12 -34.83 61.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 CA-C-N 119.412 1.005 . . . . 1.7 111.034 173.497 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -66.56 -54.63 21.52 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.038 0.835 . . . . 2.4300000000000002 110.968 177.476 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 76.2 mt -56.86 -36.33 69.92 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.329 0.652 . . . . 1.4099999999999999 112.269 177.463 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 60.8 m -61.63 -46.63 88.99 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.185 0.994 . . . . 0.98999999999999999 111.072 177.087 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.2 mtm -61.26 -43.53 98.72 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 118.845 0.748 . . . . 1.74 112.252 178.32 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -57.6 -54.59 45.16 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 118.714 0.688 . . . . 2.6899999999999999 110.883 173.733 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 89.7 m -66.85 -30.43 70.61 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.298 1.221 . . . . 1.54 114.298 -176.676 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 81' ' ' MET . . . . . 0.455 ' SD ' ' HE2' ' A' ' 70' ' ' LYS . 14.3 mtp -75.09 -33.56 61.65 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.777 1.171 . . . . 2.23 112.562 171.514 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.21 -50.21 66.73 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 119.333 0.97 . . . . 0.91000000000000003 111.376 172.158 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -60.67 -24.45 65.6 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.403 0.89 . . . . 3.0499999999999998 113.403 175.917 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -66.64 -46.92 74.23 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 117.955 -1.022 . . . . 2.7599999999999998 112.484 170.394 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -65.14 -30.16 71.07 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 120.429 1.468 . . . . 3.2799999999999998 112.108 177.626 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.443 ' HA ' ' HG2' ' B' ' 89' ' ' GLU . 0.5 OUTLIER -63.94 -46.64 83.82 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 127.407 2.283 . . . . 3.2000000000000002 111.953 175.15 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -81.13 4.24 20.71 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 119.704 -1.873 . . . . 2.3599999999999999 113.253 171.092 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 81.8 mt -109.57 -0.9 18.51 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 114.376 1.25 . . . . 2.0499999999999998 114.376 165.696 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 89' ' ' GLU . . . . . 0.443 ' HG2' ' HA ' ' B' ' 86' ' ' PHE . 21.4 pt-20 -97.23 -27.3 14.59 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.59 1.541 . . . . 5.6200000000000001 113.601 170.869 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -46.33 -42.51 14.87 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.519 1.128 . . . . 5.9299999999999997 111.273 149.015 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -85.14 -0.95 56.21 Favored 'General case' 0 CA--C 1.559 1.306 0 N-CA-C 116.258 1.947 . . . . 5.3300000000000001 116.258 177.303 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 19.0 mttp . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 116.279 -1.82 . . . . 5.96 115.468 -172.301 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.3 mp0 . . . . . 0 C--O 1.235 0.301 0 N-CA-C 108.758 -0.83 . . . . 4.04 108.758 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -55.24 157.05 6.85 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 127.583 2.353 . . . . 2.54 112.852 172.454 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -65.21 -28.96 55.75 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.41 2.073 . . . . 2.0899999999999999 113.5 -168.174 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 27.9 tp -66.57 -47.79 71.67 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 120.042 1.292 . . . . 4.0199999999999996 110.974 174.321 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -60.15 -34.13 73.14 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.794 -0.566 . . . . 4.9400000000000004 110.819 174.192 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.514 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 5.4 mmpt? -72.84 -33.16 65.98 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 120.152 -1.592 . . . . 4.3399999999999999 113.988 173.478 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.64 -45.73 85.54 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 118.808 0.731 . . . . 1.3700000000000001 110.729 170.432 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 55.8 mt -67.02 -35.19 79.38 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.945 -1.097 . . . . 1.71 112.872 174.328 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 84.8 m -55.54 -46.75 77.05 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.479 1.112 . . . . 1.72 110.709 169.165 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 81.6 m -57.24 -48.53 78.6 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.746 0.818 . . . . 1.76 109.678 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.1 tpp -51.3 -55.66 17.11 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.09 0.956 . . . . 3.1499999999999999 113.563 179.554 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.76 -29.15 46.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 123.689 0.795 . . . . 2.52 112.489 -177.599 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.5 m -72.75 -46.28 54.3 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.184 1.394 . . . . 1.02 110.578 -179.372 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.44 -37.27 77.7 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 118.634 -0.698 . . . . 2.1699999999999999 111.084 165.371 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -66.81 -60.19 2.88 Favored 'General case' 0 C--O 1.222 -0.343 0 O-C-N 123.532 0.52 . . . . 2.1000000000000001 110.845 -170.116 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.9 m170 -72.12 -1.94 16.76 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.892 1.441 . . . . 2.2999999999999998 114.892 -178.322 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -88.56 -62.58 1.46 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.413 1.085 . . . . 4.3099999999999996 112.535 164.957 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -72.64 -39.3 67.31 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.795 1.18 . . . . 2.5899999999999999 113.261 -179.215 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.0 t -62.29 -22.74 66.26 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.498 -0.751 . . . . 2.25 111.818 -176.035 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -157.03 106.8 0.3 Allowed Glycine 0 C--N 1.343 0.924 0 N-CA-C 116.181 1.232 . . . . 2.3100000000000001 116.181 164.479 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -79.86 -13.55 59.31 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 114.736 -0.732 . . . . 5.0800000000000001 111.777 132.307 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -165.14 -167.94 1.3 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.0 2.12 . . . . 3.8500000000000001 109.022 -161.879 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 39.2 53.94 2.62 Favored Glycine 0 N--CA 1.474 1.184 0 C-N-CA 125.936 1.732 . . . . 3.4300000000000002 113.84 160.96 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.2 t 56.11 138.55 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.686 1.994 . . . . 2.96 114.186 -167.424 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.0 mmmt -70.32 -18.61 63.1 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 120.864 -1.147 . . . . 5.6900000000000004 113.983 172.751 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.5 mt -102.16 -6.61 23.04 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.518 1.127 . . . . 3.6000000000000001 113.076 -171.338 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.2 p -136.98 139.45 41.47 Favored 'General case' 0 C--O 1.247 0.962 0 C-N-CA 126.231 1.812 . . . . 1.03 109.771 -174.478 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -94.61 103.31 15.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.064 0.946 . . . . 1.8300000000000001 110.136 170.408 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -74.15 161.31 30.12 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 119.973 -1.704 . . . . 2.2599999999999998 111.113 165.7 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -39.57 -46.77 1.82 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.285 1.834 . . . . 4.2999999999999998 114.481 -167.605 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.478 ' H ' ' HD3' ' A' ' 32' ' ' LYS . 0.6 OUTLIER -69.36 -42.27 75.46 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.927 1.084 . . . . 4.3399999999999999 113.927 -179.108 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -60.56 -48.7 80.6 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.846 1.658 . . . . 1.5900000000000001 108.641 176.426 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.1 tp -61.4 -43.39 98.95 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.654 0.782 . . . . 1.8899999999999999 111.502 178.253 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -66.48 -37.91 86.15 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 118.363 -0.827 . . . . 3.6600000000000001 112.732 -173.049 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -56.86 -54.44 46.46 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 117.792 -1.099 . . . . 3.9100000000000001 112.543 166.376 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.6 tt -53.42 -60.81 2.82 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.907 0.883 . . . . 1.99 110.514 -179.214 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.9 mt -56.96 -51.65 65.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 N-CA-C 108.831 -0.803 . . . . 0.81999999999999995 108.831 -175.801 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -61.96 -35.79 79.5 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.172 0.896 . . . . 4.0 113.115 -175.328 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 60.8 mttm -66.28 -34.87 78.97 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.503 1.047 . . . . 2.96 112.956 172.116 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -72.47 -51.61 19.42 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.454 1.102 . . . . 4.6600000000000001 111.793 179.521 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -82.12 25.82 0.56 Allowed 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 126.45 1.9 . . . . 2.6899999999999999 113.025 -176.453 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.0 m -60.87 6.6 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 126.544 1.938 . . . . 3.1099999999999999 115.766 177.866 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.597 HD12 ' H ' ' A' ' 44' ' ' LEU . 5.0 mp -60.67 -21.51 62.9 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.417 1.887 . . . . 4.0199999999999996 112.8 162.333 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 119.26 14.87 5.75 Favored Glycine 0 N--CA 1.473 1.163 0 C-N-CA 126.335 1.921 . . . . 2.9100000000000001 114.552 175.929 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -88.06 -174.28 4.61 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.291 0.848 . . . . 5.54 113.291 -174.069 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 77.07 -8.05 1.75 Allowed 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.994 1.85 . . . . 3.1000000000000001 115.994 154.575 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.2 mptt -8.82 114.51 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 130.075 3.35 . . . . 6.0199999999999996 114.92 178.405 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -9.91 -56.12 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 130.656 3.582 . . . . 4.4500000000000002 119.891 -149.007 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.1 t -77.57 -17.35 57.95 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.855 1.057 . . . . 2.9399999999999999 113.855 -178.036 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.9 t -75.41 -10.65 59.64 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.0 1.273 . . . . 2.1600000000000001 112.08 173.554 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 70.3 mt -73.98 -27.41 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.693 1.197 . . . . 1.3700000000000001 111.483 161.095 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -91.98 -30.29 16.17 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.672 0.789 . . . . 3.6800000000000002 112.339 -174.384 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -68.44 -37.82 80.59 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.436 -0.79 . . . . 2.29 111.507 161.739 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 58.8 tp -57.49 -46.72 83.41 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 116.747 -1.596 . . . . 1.6899999999999999 110.574 168.706 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.8 mtp -51.35 -48.5 62.45 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 121.239 1.836 . . . . 1.8200000000000001 112.248 173.596 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.68 -21.26 62.64 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.413 1.485 . . . . 3.9199999999999999 113.005 175.975 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -82.22 -39.14 23.51 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 120.51 -1.369 . . . . 1.8200000000000001 113.476 167.326 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 84.4 mt -83.77 -37.43 22.63 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.4 1.48 . . . . 2.0899999999999999 114.771 -172.808 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.428 ' C ' ' HE2' ' A' ' 61' ' ' LYS . 7.2 t70 -79.1 129.04 34.03 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.605 0.717 . . . . 2.54 110.419 177.568 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.428 ' HE2' ' C ' ' A' ' 60' ' ' ASP . 0.8 OUTLIER -101.69 -17.52 16.26 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.6 0.76 . . . . 3.3799999999999999 112.741 178.125 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.7 m120 -95.27 -26.03 16.1 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 115.097 1.518 . . . . 2.3700000000000001 115.097 -170.745 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.6 m 61.61 36.42 16.73 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.735 1.614 . . . . 2.3599999999999999 111.48 -163.334 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 48.4 p30 -92.34 -11.93 33.73 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 127.134 2.174 . . . . 2.4100000000000001 111.828 178.039 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 65.4 18.46 11.33 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 128.758 2.823 . . . . 5.3899999999999997 113.053 -177.153 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -139.18 139.43 37.55 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 122.703 1.239 . . . . 3.0600000000000001 112.377 170.26 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 1.9 mt -98.19 97.82 6.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 124.074 0.95 . . . . 1.8 109.644 -171.531 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -47.64 143.56 3.74 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 127.814 2.445 . . . . 2.3900000000000001 110.665 162.393 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -47.08 -36.99 8.88 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 122.196 0.998 . . . . 2.5299999999999998 112.337 172.619 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -69.79 -29.59 66.93 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.088 1.755 . . . . 3.0800000000000001 114.346 175.965 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.416 ' O ' HG12 ' A' ' 74' ' ' VAL . 51.2 mt-10 -74.13 -54.73 7.19 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 108.324 -0.991 . . . . 1.8999999999999999 108.324 166.418 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -53.99 -25.61 21.86 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 127.063 2.145 . . . . 1.96 114.627 -178.552 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.3 t -62.07 -31.9 72.38 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.767 -1.208 . . . . 1.6299999999999999 111.714 173.027 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.416 HG12 ' O ' ' A' ' 71' ' ' GLU . 2.0 p -74.61 -23.83 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-N 119.635 1.107 . . . . 2.0499999999999998 112.123 -177.483 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -63.65 -50.74 68.08 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.131 0.972 . . . . 2.04 110.115 169.466 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 44.7 mt -59.38 -41.47 89.44 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.394 1.078 . . . . 1.8500000000000001 111.161 177.24 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 88.0 m -58.96 -52.51 65.47 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.314 1.046 . . . . 0.90000000000000002 111.72 171.726 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 36.1 mtp -56.53 -45.94 80.88 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.839 0.855 . . . . 1.8600000000000001 112.281 179.275 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 92.7 mt -62.63 -47.07 85.34 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 123.338 0.655 . . . . 1.3700000000000001 111.488 177.179 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 79.1 m -64.45 -34.88 79.22 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.543 0.942 . . . . 1.76 113.543 178.564 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.5 mmm -65.67 -42.51 91.24 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 118.009 0.368 . . . . 2.3700000000000001 111.065 174.598 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.24 -35.8 78.48 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.761 -0.638 . . . . 1.1599999999999999 112.308 179.769 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -76.98 -30.23 55.86 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.187 1.18 . . . . 2.5099999999999998 114.187 177.683 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -58.55 -49.44 77.42 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.987 0.812 . . . . 2.1200000000000001 110.926 167.936 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.44 -33.13 75.02 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.107 1.363 . . . . 4.5999999999999996 111.84 178.292 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -59.98 -45.51 92.47 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.86 1.264 . . . . 2.48 112.625 174.468 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -63.26 -34.13 77.0 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.867 1.267 . . . . 2.6600000000000001 111.922 177.058 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 71.2 mt -74.68 -7.84 54.51 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.222 1.409 . . . . 2.5699999999999998 113.477 178.166 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -101.38 -1.09 34.22 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.217 1.407 . . . . 3.5699999999999998 114.139 170.518 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.8 t70 . . . . . 0 CA--C 1.543 0.709 0 C-N-CA 125.844 1.658 . . . . 3.5699999999999998 111.977 179.13 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 3' ' ' THR . . . . . 0.552 HG23 ' H ' ' B' ' 6' ' ' GLU . 4.7 t . . . . . 0 C--O 1.236 0.362 0 N-CA-C 108.01 -1.107 . . . . 3.2400000000000002 108.01 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -63.74 -16.68 56.18 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 121.726 1.618 . . . . 1.7 112.22 167.58 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 24.8 tp -68.38 -50.65 51.48 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.64 1.109 . . . . 2.8999999999999999 112.204 -177.111 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 6' ' ' GLU . . . . . 0.552 ' H ' HG23 ' B' ' 3' ' ' THR . 2.6 tm-20 -47.95 -54.58 12.33 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.055 1.342 . . . . 4.0300000000000002 110.63 167.303 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -70.34 -26.33 63.7 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.496 -0.752 . . . . 4.8499999999999996 112.278 -171.969 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.61 -38.93 74.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.894 1.278 . . . . 0.93000000000000005 111.933 170.623 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.93 -44.24 81.18 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.897 1.226 . . . . 1.8899999999999999 110.388 171.906 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 59.1 m -55.6 -43.46 76.05 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.616 1.566 . . . . 1.8799999999999999 111.991 172.232 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.15 -32.12 58.93 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 121.036 -1.04 . . . . 1.77 113.17 175.949 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -55.98 -49.07 74.62 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.959 1.254 . . . . 3.2799999999999998 110.218 167.755 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 29.9 t -59.21 -30.6 44.26 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 C-N-CA 124.938 1.295 . . . . 2.25 112.906 172.152 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 29.8 m -71.39 -45.49 62.66 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 120.881 -1.137 . . . . 0.82999999999999996 111.785 175.483 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.22 -32.29 64.29 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.923 0.783 . . . . 1.8899999999999999 110.248 167.604 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -64.06 -58.24 7.25 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 118.473 -0.775 . . . . 2.0499999999999998 110.563 179.632 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 47.2 m-70 -57.23 -43.94 83.35 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 120.589 1.54 . . . . 4.5499999999999998 112.184 178.494 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -56.71 -36.8 70.08 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.086 1.354 . . . . 5.21 113.961 -177.794 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -108.87 -34.11 6.75 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.725 1.009 . . . . 2.3100000000000001 113.725 -179.308 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -67.96 -27.5 66.65 Favored 'General case' 0 C--O 1.249 1.067 0 C-N-CA 125.251 1.42 . . . . 1.75 111.774 175.463 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.81 4.51 60.8 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 128.119 2.771 . . . . 1.8100000000000001 115.222 177.551 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 17.9 mtp180 -78.83 -113.1 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.117 1.459 . . . . 4.1600000000000001 110.575 172.496 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.51 -178.16 1.7 Allowed 'General case' 0 C--O 1.248 0.979 0 C-N-CA 124.954 1.302 . . . . 3.9199999999999999 113.018 178.144 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 62.97 -145.73 50.17 Favored Glycine 0 C--N 1.34 0.783 0 C-N-CA 125.036 1.303 . . . . 2.1600000000000001 111.531 171.412 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.6 m -66.51 153.37 43.09 Favored 'General case' 0 C--O 1.248 0.984 0 CA-C-O 123.723 1.725 . . . . 3.6600000000000001 110.31 155.28 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -82.71 -4.05 57.29 Favored 'General case' 0 CA--C 1.552 1.048 0 O-C-N 120.364 -1.46 . . . . 6.9100000000000001 113.555 175.593 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 4.9 mp -103.04 0.39 31.97 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 128.175 2.59 . . . . 3.5499999999999998 112.592 171.924 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 81.9 p -132.13 157.57 43.89 Favored 'General case' 0 C--O 1.245 0.846 0 C-N-CA 125.356 1.462 . . . . 1.1299999999999999 112.0 -178.562 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -95.29 128.45 42.14 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.395 1.478 . . . . 2.1299999999999999 110.552 167.229 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 23.0 t -101.1 171.99 7.28 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.27 1.428 . . . . 2.0 112.062 162.754 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 48.6 ttm-85 -58.87 -20.29 49.85 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.986 1.714 . . . . 3.8500000000000001 114.96 -165.143 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -95.74 -39.8 9.68 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.46 1.482 . . . . 5.7999999999999998 113.791 169.704 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -46.48 -44.87 17.92 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.224 1.01 . . . . 1.73 111.806 168.679 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 8.6 tp -77.67 -44.65 27.38 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 119.44 -0.314 . . . . 2.1200000000000001 111.687 -175.922 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 35' ' ' LYS . . . . . 0.465 ' HG2' HG21 ' B' ' 52' ' ' ILE . 52.3 mttm -54.87 -46.38 74.71 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 118.858 0.754 . . . . 3.1299999999999999 111.662 172.837 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -56.54 -53.92 51.95 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 123.852 0.72 . . . . 2.9300000000000002 111.469 174.379 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 64.0 tp -56.6 -57.67 11.36 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 125.26 1.424 . . . . 2.2999999999999998 112.375 -177.109 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 34.5 mt -56.95 -39.24 64.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.87 0.868 . . . . 1.53 110.268 179.225 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -68.62 -9.25 48.68 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 120.689 -1.257 . . . . 4.0700000000000003 113.768 -176.387 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -104.8 -60.72 1.56 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.067 0.947 . . . . 3.7799999999999998 109.219 164.107 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -82.6 67.3 8.6 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 127.473 2.309 . . . . 5.6600000000000001 110.543 -176.578 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -173.73 29.58 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 127.861 2.465 . . . . 2.6899999999999999 111.075 166.878 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 33.5 t -50.96 -16.25 0.41 Allowed 'General case' 0 CA--C 1.557 1.246 0 N-CA-C 117.71 2.485 . . . . 3.46 117.71 -159.688 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.482 HD23 ' H ' ' B' ' 44' ' ' LEU . 1.9 pt? -96.93 -7.4 33.32 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 116.226 1.936 . . . . 3.4700000000000002 116.226 174.459 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -110.35 105.96 2.04 Favored Glycine 0 N--CA 1.469 0.882 0 C-N-CA 125.148 1.356 . . . . 3.71 112.547 -175.751 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -75.4 84.95 2.53 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-O 122.247 1.023 . . . . 6.0099999999999998 111.218 179.17 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 8.0 mmt -84.93 117.87 24.19 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 126.378 1.871 . . . . 3.2799999999999998 113.093 -178.289 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -70.71 140.94 51.55 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.892 1.277 . . . . 3.1600000000000001 110.126 171.431 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -53.21 -47.94 68.54 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 114.333 1.235 . . . . 3.8700000000000001 114.333 -168.147 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 15.4 t -70.83 -19.31 62.67 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.025 1.12 . . . . 4.2400000000000002 114.025 178.835 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 38.0 m -76.12 -18.92 58.93 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 120.884 -1.135 . . . . 3.9399999999999999 111.884 172.35 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 52' ' ' ILE . . . . . 0.465 HG21 ' HG2' ' B' ' 35' ' ' LYS . 11.9 mm -66.28 -34.22 68.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 118.828 0.74 . . . . 1.75 110.908 167.531 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -78.31 -21.88 48.99 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.044 0.838 . . . . 3.75 113.13 -177.83 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.636 ' HA ' ' HE3' ' B' ' 57' ' ' LYS . 9.8 t70 -77.78 -41.19 38.28 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 118.438 0.563 . . . . 2.71 111.357 166.23 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 50.7 tp -59.98 -48.31 82.21 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-O 118.411 -0.804 . . . . 2.3599999999999999 111.227 173.143 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 2.5 ppp? -59.93 -40.46 89.0 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.203 0.91 . . . . 2.1600000000000001 110.187 -179.493 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 57' ' ' LYS . . . . . 0.636 ' HE3' ' HA ' ' B' ' 54' ' ' ASP . 11.7 ttpp -61.51 -36.06 79.47 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.099 1.76 . . . . 3.3599999999999999 113.227 172.6 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 5.6 t -75.16 -34.06 61.55 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.844 -1.16 . . . . 1.97 111.581 176.417 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 70.9 mt -69.09 -34.26 74.83 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 117.437 -1.268 . . . . 1.8500000000000001 111.389 170.568 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -96.8 90.34 5.22 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.474 1.51 . . . . 1.99 113.919 -179.339 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 61' ' ' LYS . . . . . 0.412 ' H ' ' HD2' ' B' ' 61' ' ' LYS . 3.8 mptt -67.18 -19.8 65.63 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.904 1.281 . . . . 3.6600000000000001 113.28 -178.732 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 62' ' ' ASN . . . . . 0.4 ' HB2' ' H ' ' B' ' 64' ' ' ASP . 1.7 m120 -78.7 -31.76 46.67 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.161 0.892 . . . . 2.3100000000000001 112.886 173.065 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 12.5 t 63.51 24.03 13.89 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.951 1.3 . . . . 2.8900000000000001 113.637 -159.29 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 64' ' ' ASP . . . . . 0.4 ' H ' ' HB2' ' B' ' 62' ' ' ASN . 54.3 p-10 -81.57 -18.43 44.89 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.496 1.518 . . . . 2.5899999999999999 112.52 176.477 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 76.88 1.53 3.23 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 131.504 3.921 . . . . 4.3600000000000003 113.186 179.066 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -92.77 112.8 24.88 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 125.465 1.506 . . . . 2.4199999999999999 107.109 164.503 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 2.7 mt -97.65 107.46 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 O-C-N 121.045 -1.035 . . . . 1.5 109.816 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -56.71 154.04 9.64 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.487 1.115 . . . . 3.7400000000000002 110.272 173.691 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -49.4 -46.11 47.0 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 120.727 -1.233 . . . . 2.4199999999999999 110.842 163.176 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -53.28 -31.18 42.54 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 127.958 2.503 . . . . 4.0599999999999996 115.319 173.054 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -87.19 -53.69 4.71 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.476 1.511 . . . . 1.75 109.371 176.84 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -58.42 -31.28 67.57 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 129.12 2.968 . . . . 2.3399999999999999 113.982 -177.54 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 23.3 t -56.74 -23.16 40.72 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 120.703 1.592 . . . . 2.3900000000000001 112.837 178.786 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 78.2 t -64.79 -25.71 38.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 124.051 0.94 . . . . 1.47 112.011 176.423 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -57.2 -53.16 61.29 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.489 1.516 . . . . 2.3999999999999999 110.803 169.206 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 25.7 mt -57.93 -43.48 86.32 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.18 1.392 . . . . 1.3500000000000001 109.985 179.387 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 65.3 m -58.26 -53.08 62.36 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 117.807 -1.092 . . . . 0.84999999999999998 111.478 176.654 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.6 mtm -57.1 -47.76 80.28 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.602 1.092 . . . . 1.6000000000000001 112.019 -179.536 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 84.0 mt -68.68 -39.45 80.58 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.786 0.834 . . . . 1.6200000000000001 112.677 -178.174 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.8 t -73.16 -31.83 64.49 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.645 -0.659 . . . . 1.6499999999999999 111.877 177.66 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 47.6 mtt -63.77 -43.74 95.48 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.787 0.721 . . . . 2.8399999999999999 110.994 169.637 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.2 -37.53 85.68 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.412 0.523 . . . . 0.68999999999999995 112.412 176.349 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -70.07 -35.77 74.47 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.612 0.967 . . . . 2.3100000000000001 113.612 172.645 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -65.88 -37.4 86.03 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 119.306 0.957 . . . . 2.6200000000000001 112.28 175.199 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -68.19 -42.37 80.01 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.337 1.055 . . . . 2.6499999999999999 111.983 173.028 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -52.51 -43.97 65.42 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.912 1.285 . . . . 2.3500000000000001 112.185 175.758 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -63.08 -25.74 68.51 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.809 1.643 . . . . 2.4300000000000002 112.438 179.023 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 39.4 mt -85.3 -12.33 52.6 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.638 1.175 . . . . 2.1499999999999999 113.072 178.158 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 89' ' ' GLU . . . . . 0.485 ' CD ' ' HZ2' ' B' ' 92' ' ' LYS . 14.3 mm-40 -93.19 -8.11 43.35 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.277 1.831 . . . . 3.6000000000000001 114.234 169.307 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -89.44 -46.93 8.34 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.836 2.055 . . . . 4.1299999999999999 111.425 169.801 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -71.17 0.27 8.17 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.433 1.493 . . . . 3.8100000000000001 114.848 -172.003 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 92' ' ' LYS . . . . . 0.485 ' HZ2' ' CD ' ' B' ' 89' ' ' GLU . 16.7 pttm . . . . . 0 C--O 1.249 1.033 0 N-CA-C 117.186 2.291 . . . . 5.2000000000000002 117.186 -168.464 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 . . . . . 0 CA--C 1.536 0.415 0 N-CA-C 109.541 -0.54 . . . . 3.52 109.541 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.455 HG21 ' HA ' ' B' ' 41' ' ' GLU . 67.1 p -133.96 157.86 76.74 Favored Pre-proline 0 N--CA 1.471 0.619 0 C-N-CA 124.463 1.105 . . . . 1.49 111.1 -169.571 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.99 -21.54 32.27 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 122.305 2.004 . . . . 1.4199999999999999 112.216 176.7 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.24 -44.56 52.56 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.479 1.111 . . . . 2.2999999999999998 110.886 176.45 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -67.15 -33.63 75.84 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.451 -0.781 . . . . 4.0 111.7 170.134 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -62.97 -35.9 81.72 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 119.957 -1.714 . . . . 5.9400000000000004 112.037 168.765 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.59 -56.17 17.98 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 120.405 1.457 . . . . 1.1299999999999999 110.954 176.451 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 70.2 mt -57.58 -39.97 77.97 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.567 1.147 . . . . 1.48 112.847 -178.384 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 19.7 p -67.3 -39.17 85.9 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 117.83 -1.081 . . . . 2.4300000000000002 112.097 174.089 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.0 m -65.48 -32.51 74.17 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.375 0.989 . . . . 1.5 111.562 179.921 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -55.34 -57.12 13.13 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 118.227 0.467 . . . . 3.5499999999999998 110.016 168.91 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 74.9 t -60.93 -37.79 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.024 0.53 . . . . 1.9299999999999999 111.797 -176.573 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.7 m -56.26 -57.92 10.18 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.216 1.006 . . . . 1.0700000000000001 111.424 175.974 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.74 -28.45 55.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 118.688 -0.672 . . . . 2.9700000000000002 110.885 -170.749 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -63.05 -41.55 99.52 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.855 1.662 . . . . 1.8500000000000001 112.596 173.892 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 18.7 m170 -66.14 -20.93 66.3 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.756 1.021 . . . . 2.2200000000000002 113.756 175.873 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -65.34 -36.76 85.0 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.77 1.168 . . . . 5.1600000000000001 111.906 172.545 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -102.81 -38.46 7.41 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 114.176 1.176 . . . . 2.1899999999999999 114.176 -170.292 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.3 t -59.02 -32.87 70.12 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 120.106 1.321 . . . . 1.95 112.686 179.61 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -93.56 34.16 4.76 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 126.845 2.164 . . . . 1.3200000000000001 113.95 179.705 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.41 52.76 0.28 Allowed 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.202 1.501 . . . . 4.0899999999999999 110.089 162.912 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . 0.254 6.3 tp10 -6.53 -92.99 0.0 OUTLIER 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.854 1.057 . . . . 9.5399999999999991 113.854 -114.911 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 43.24 63.47 2.06 Favored Glycine 0 C--N 1.34 0.798 0 C-N-CA 124.71 1.148 . . . . 3.71 110.979 172.255 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.9 t 66.25 141.08 0.03 OUTLIER 'General case' 0 C--O 1.25 1.125 0 C-N-CA 125.745 1.618 . . . . 2.96 113.361 -175.309 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.4 tttp -127.59 117.5 22.15 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.133 1.373 . . . . 4.5599999999999996 110.608 -154.556 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 97.45 -17.27 0.06 Allowed 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 130.419 3.488 . . . . 4.1299999999999999 110.513 -163.27 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 47.3 p -109.74 156.63 20.06 Favored 'General case' 0 C--O 1.245 0.86 0 C-N-CA 125.939 1.695 . . . . 1.28 112.348 176.564 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -109.58 105.42 14.72 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 125.764 1.625 . . . . 2.4199999999999999 109.651 169.85 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.4 t -64.77 159.59 22.03 Favored 'General case' 0 C--N 1.318 -0.763 0 O-C-N 121.955 -0.465 . . . . 2.2999999999999998 111.304 168.749 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.4 ttp85 -45.34 -40.09 7.46 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.56 1.544 . . . . 4.0700000000000003 115.014 -175.305 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 24.6 tptp -52.7 -57.92 8.54 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 119.203 -2.186 . . . . 5.0800000000000001 115.217 163.791 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -61.76 -41.33 97.54 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.558 1.543 . . . . 1.8300000000000001 109.715 -167.906 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.37 -43.03 95.79 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.717 1.207 . . . . 2.54 111.668 177.443 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -63.57 -44.33 94.42 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.539 -1.351 . . . . 4.9400000000000004 111.61 176.989 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -59.17 -44.5 92.15 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.668 0.787 . . . . 4.3899999999999997 112.504 176.352 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.3 tt -58.16 -54.31 48.44 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.226 1.41 . . . . 1.8400000000000001 111.324 176.566 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 27.6 mt -58.78 -46.17 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 119.0 0.818 . . . . 1.21 109.87 -175.45 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -72.93 -3.33 25.16 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.987 1.106 . . . . 4.0300000000000002 113.987 -174.975 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 56.6 mmtt -99.22 -49.89 4.32 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.346 1.858 . . . . 3.1800000000000002 111.534 168.392 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.505 ' HA ' HG21 ' B' ' 3' ' ' THR . 1.1 mp0 -75.04 -48.44 23.99 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.162 0.985 . . . . 5.4500000000000002 112.244 -173.89 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -89.59 -48.46 7.28 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.966 1.306 . . . . 2.8100000000000001 110.202 176.329 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 9.7 t 75.66 -40.59 0.42 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 128.1 2.56 . . . . 4.4500000000000002 113.673 -175.314 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -38.97 135.19 0.92 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.183 1.793 . . . . 5.3099999999999996 114.598 -169.71 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -81.85 -23.04 58.54 Favored Glycine 0 N--CA 1.477 1.384 0 C-N-CA 125.273 1.416 . . . . 4.54 111.514 169.432 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -57.04 -16.65 7.64 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 127.923 2.489 . . . . 6.1200000000000001 112.563 169.041 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 9.9 tpt -66.57 -28.04 68.21 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.642 1.577 . . . . 4.96 113.377 169.683 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.42 109.51 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 130.078 3.351 . . . . 8.3499999999999996 112.382 -171.139 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -50.04 -52.32 35.28 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.985 1.714 . . . . 5.3099999999999996 114.147 -170.948 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.9 t -73.11 -15.35 61.48 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 120.098 -1.626 . . . . 3.46 114.005 177.643 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 20.1 t -75.5 -10.48 59.49 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.661 1.118 . . . . 3.27 112.393 169.391 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 82.2 mt -70.92 -29.49 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-N 119.103 0.865 . . . . 1.4099999999999999 111.278 172.795 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.25 -32.51 70.06 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 118.775 0.716 . . . . 3.2000000000000002 111.38 174.537 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -81.38 -40.07 24.05 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.862 1.265 . . . . 2.6099999999999999 112.862 176.366 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.4 tt -66.26 -42.57 88.3 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 117.767 -1.111 . . . . 2.0099999999999998 111.503 176.493 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ppp? -65.04 -40.42 94.77 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.592 1.087 . . . . 2.04 110.084 177.013 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.48 -38.97 82.21 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.068 0.947 . . . . 3.52 112.375 172.173 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.3 t -57.98 -27.09 63.15 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.773 1.17 . . . . 2.4100000000000001 113.963 176.139 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 12.5 mt -74.27 -24.84 59.33 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.339 -0.85 . . . . 2.0 112.372 178.584 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -102.31 115.64 30.98 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.58 1.552 . . . . 2.3700000000000001 111.685 -154.702 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -81.5 -14.04 57.42 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.133 1.16 . . . . 3.8900000000000001 114.133 -169.585 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 36.9 p-10 -124.49 -10.56 7.4 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.519 1.528 . . . . 1.95 113.963 -178.097 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.3 m 58.57 42.27 21.01 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.516 1.527 . . . . 3.2000000000000002 111.861 -173.577 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.4 p30 -72.98 -29.24 62.9 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.073 1.749 . . . . 2.3599999999999999 111.347 -175.896 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 114.76 -6.2 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.456 1 C-N-CA 135.225 5.41 . . . . 4.4000000000000004 113.431 175.795 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -132.54 129.36 38.96 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.021 1.728 . . . . 4.1299999999999999 110.812 -168.506 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 10.6 mm -92.46 99.9 10.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 126.076 1.75 . . . . 1.0700000000000001 108.979 -173.02 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.92 161.91 6.07 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.727 2.011 . . . . 3.1600000000000001 111.467 165.624 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.404 ' CE1' ' HB3' ' B' ' 80' ' ' CYS . 0.3 OUTLIER -55.78 -43.0 76.35 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.658 -1.276 . . . . 2.2599999999999998 113.318 -177.537 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.558 ' HE2' ' SD ' ' B' ' 81' ' ' MET . 3.4 mtmt -73.3 -19.23 61.09 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 120.502 -1.374 . . . . 3.1000000000000001 112.964 176.415 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -69.25 -56.46 7.51 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 107.85 -1.167 . . . . 2.1000000000000001 107.85 166.074 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -58.03 -28.94 64.93 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 127.915 2.486 . . . . 2.1099999999999999 114.844 -177.976 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 53.1 m -53.04 -30.15 33.97 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 120.456 -1.402 . . . . 1.6799999999999999 113.048 168.122 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 97.8 t -65.58 -31.89 55.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 CA-C-N 120.251 1.387 . . . . 2.04 111.559 179.094 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -67.28 -51.56 51.4 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.122 0.969 . . . . 1.8300000000000001 109.473 176.396 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 59.9 mt -57.62 -37.1 72.7 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.859 1.264 . . . . 1.6200000000000001 111.647 174.253 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 28.0 m -66.48 -48.83 68.62 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.758 0.823 . . . . 0.87 111.023 176.082 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 19.4 ttp -62.93 -47.08 84.78 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.969 0.907 . . . . 2.4900000000000002 111.656 -177.038 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 97.4 mt -65.73 -43.41 89.13 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.318 0.647 . . . . 1.3200000000000001 112.203 177.385 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 7.7 t -65.21 -32.83 74.7 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 119.689 1.131 . . . . 1.8700000000000001 112.691 177.158 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 27.5 mtp -68.18 -34.62 76.63 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 118.689 -0.672 . . . . 1.78 112.546 170.864 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.63 -40.65 88.85 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.627 1.103 . . . . 0.94999999999999996 112.42 173.244 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -61.78 -24.6 66.94 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 113.56 0.948 . . . . 2.0099999999999998 113.56 172.002 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -72.95 -41.21 64.68 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.537 1.062 . . . . 2.0899999999999999 112.682 172.3 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -66.66 -37.57 85.07 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 118.569 0.622 . . . . 2.79 111.084 179.23 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.96 -55.43 23.55 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.968 1.307 . . . . 2.23 111.322 167.8 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -58.02 -26.73 62.8 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.263 1.425 . . . . 2.3500000000000001 113.127 -176.898 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 76.0 mt -75.64 -20.56 58.42 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.625 1.17 . . . . 1.51 113.657 175.454 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -91.52 -37.14 13.32 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.967 0.907 . . . . 3.52 113.359 169.067 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 . . . . . 0 CA--C 1.541 0.607 0 C-N-CA 125.278 1.431 . . . . 3.5099999999999998 114.197 -175.845 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 3' ' ' THR . . . . . 0.505 HG21 ' HA ' ' A' ' 41' ' ' GLU . 72.4 p . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 111.999 0.37 . . . . 2.29 111.999 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -71.69 -17.18 29.77 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 121.944 1.762 . . . . 1.4399999999999999 113.371 -178.43 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tt -65.02 -39.04 92.81 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.402 1.001 . . . . 3.1099999999999999 111.57 176.081 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -60.24 -42.73 95.87 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.694 0.759 . . . . 4.9199999999999999 111.424 174.178 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -67.15 -29.88 69.71 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.065 -1.022 . . . . 4.4000000000000004 112.626 175.631 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.33 -42.99 82.67 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.734 1.214 . . . . 0.81999999999999995 110.744 171.837 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.83 -38.45 90.8 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.267 -0.895 . . . . 1.4399999999999999 112.026 173.92 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.15 -43.46 95.72 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.075 -1.016 . . . . 1.3100000000000001 111.286 171.187 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 93.8 m -57.62 -38.78 75.55 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.783 1.233 . . . . 1.23 111.425 -178.702 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -59.75 -38.83 82.86 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.758 1.022 . . . . 3.7200000000000002 113.758 172.87 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 21.1 t -69.88 -31.81 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 CA-C-N 119.627 1.103 . . . . 2.23 111.259 175.559 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 44.6 m -77.85 -30.28 50.9 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 126.947 2.099 . . . . 1.29 113.327 -174.807 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 12.7 p -78.13 -29.58 48.92 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.164 0.893 . . . . 1.6699999999999999 110.612 162.502 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.77 -57.29 13.3 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 118.261 0.482 . . . . 2.0600000000000001 110.59 -175.872 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 14.0 m80 -68.7 -8.62 44.3 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.673 1.36 . . . . 2.25 114.673 174.986 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -75.42 -49.97 17.28 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 120.903 -1.123 . . . . 4.1900000000000004 111.332 169.55 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -93.77 -23.99 17.97 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.185 0.994 . . . . 2.0 113.67 -174.104 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 97.6 p -65.59 -11.65 46.13 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 115.865 1.802 . . . . 2.8799999999999999 115.865 -175.578 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.79 -0.2 83.98 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-O 117.457 -1.746 . . . . 2.7999999999999998 114.344 171.769 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -62.43 -31.36 72.05 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 120.496 2.148 . . . . 3.3300000000000001 112.66 178.733 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -177.51 -148.84 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 128.71 2.804 . . . . 3.2200000000000002 108.939 165.385 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 26.29 87.43 0.01 OUTLIER Glycine 0 N--CA 1.477 1.376 0 C-N-CA 128.459 2.933 . . . . 4.3499999999999996 113.551 167.464 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 6.0 m 43.58 150.17 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 129.331 3.052 . . . . 3.4399999999999999 117.104 -172.001 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 71.8 tttt -80.32 -12.38 59.61 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 119.503 -1.998 . . . . 6.9299999999999997 113.579 179.53 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 62.7 tp -71.85 -54.56 9.71 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 119.265 0.939 . . . . 3.2200000000000002 109.828 164.058 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 35.8 p -93.94 162.43 13.9 Favored 'General case' 0 C--O 1.254 1.301 0 C-N-CA 125.503 1.521 . . . . 1.3200000000000001 114.832 -159.059 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 24.6 mt -105.87 86.59 2.41 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.422 2.289 . . . . 1.76 111.024 173.401 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 7.9 t -71.72 -178.41 2.25 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 119.768 -1.832 . . . . 2.9300000000000002 112.288 170.353 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -41.06 -60.2 1.28 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.634 1.574 . . . . 4.6900000000000004 114.758 -163.794 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.69 -32.7 58.06 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 120.12 1.327 . . . . 4.46 112.147 -174.398 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -52.5 -52.2 55.65 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.558 1.543 . . . . 1.8600000000000001 111.539 172.458 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.65 -48.21 80.32 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.919 1.288 . . . . 2.3999999999999999 111.748 -178.663 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -57.25 -46.14 83.3 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 121.018 -1.051 . . . . 4.5300000000000002 112.892 177.842 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -57.41 -47.57 81.38 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 118.074 -0.965 . . . . 3.0699999999999998 113.03 175.287 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.47 -53.09 40.86 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.619 1.168 . . . . 1.79 111.654 175.227 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 38.6 mt -55.78 -52.49 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 CA-C-N 118.949 0.795 . . . . 1.0700000000000001 109.18 177.581 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -66.94 -10.57 50.49 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 114.043 1.127 . . . . 4.8399999999999999 114.043 -174.917 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 34.6 mmtm -95.68 -39.22 10.0 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.584 1.954 . . . . 3.7200000000000002 113.392 176.649 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 41' ' ' GLU . . . . . 0.455 ' HA ' HG21 ' A' ' 3' ' ' THR . 20.7 mt-10 -118.71 -35.2 3.76 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 118.163 -0.922 . . . . 5.5099999999999998 113.066 -166.34 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -109.19 57.76 0.61 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.528 1.931 . . . . 2.6000000000000001 108.975 171.243 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 76.8 m -54.59 -56.46 18.7 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.061 -0.971 . . . . 4.1299999999999999 113.523 -167.169 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 95.7 mt 59.09 -23.89 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 129.256 3.023 . . . . 4.9199999999999999 118.973 164.437 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.44 -55.92 4.67 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 125.679 1.609 . . . . 3.8500000000000001 112.28 177.914 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -66.83 1.04 2.04 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.989 1.107 . . . . 5.6799999999999997 113.989 171.984 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.08 57.02 1.72 Allowed 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 125.008 2.337 . . . . 2.46 112.593 172.248 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -87.39 162.62 17.22 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 129.997 3.319 . . . . 4.1900000000000004 110.652 174.895 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -56.94 -36.46 70.27 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 120.761 -1.212 . . . . 4.0999999999999996 113.5 -173.389 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 7.0 m -72.08 -5.56 36.14 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 116.245 1.943 . . . . 2.9700000000000002 116.245 175.958 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 62.0 p -107.8 -39.69 5.49 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 120.426 1.466 . . . . 2.0299999999999998 111.516 165.982 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 11.8 mm -56.88 -49.3 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 126.678 1.991 . . . . 1.5600000000000001 113.245 176.759 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -76.31 -22.96 54.35 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.282 0.845 . . . . 3.1800000000000002 113.282 -166.891 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -77.77 -39.66 43.38 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.124 0.569 . . . . 3.7999999999999998 111.494 167.285 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.92 -42.83 90.63 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 122.994 0.518 . . . . 2.3900000000000001 110.537 174.707 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 7.2 tpt -57.77 -53.01 63.06 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.76 2.424 . . . . 1.97 112.137 169.171 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -54.76 -43.81 73.08 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 120.675 -1.266 . . . . 4.7699999999999996 112.646 174.444 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 73.4 m -82.46 -24.63 34.17 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.923 1.289 . . . . 2.1200000000000001 112.35 -171.067 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 mt -60.77 -57.79 11.21 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 126.445 1.898 . . . . 2.7000000000000002 110.942 157.192 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -89.92 65.75 6.73 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.645 1.578 . . . . 1.53 111.508 -168.721 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 61' ' ' LYS . . . . . 0.465 ' HE2' HG21 ' B' ' 74' ' ' VAL . 55.7 mttm -58.08 -31.91 67.54 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 115.177 1.547 . . . . 3.1499999999999999 115.177 -160.772 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -88.86 -5.49 57.99 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.288 1.218 . . . . 2.04 114.288 176.394 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 11.2 t 61.22 25.64 15.6 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.544 1.938 . . . . 2.29 114.065 178.838 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 55.7 p-10 -72.48 -16.15 61.8 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.838 1.255 . . . . 2.98 111.572 178.675 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 63.97 7.53 3.39 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 130.904 3.682 . . . . 4.4900000000000002 114.815 -177.485 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -89.92 127.73 36.07 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 107.053 -1.462 . . . . 3.0600000000000001 107.053 158.454 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 97.5 mt -111.81 110.35 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 N-CA-C 108.8 -0.815 . . . . 1.3300000000000001 108.8 169.68 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -87.58 164.31 16.16 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 128.577 2.751 . . . . 4.1799999999999997 110.54 166.514 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -43.73 -38.81 3.36 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.704 1.601 . . . . 2.4700000000000002 114.746 171.076 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 tpmt? -65.91 -28.42 68.92 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.04 0.936 . . . . 6.1600000000000001 112.938 179.834 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -85.27 -53.13 5.43 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.83 1.252 . . . . 2.02 109.858 167.517 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -47.63 -38.26 14.34 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 126.802 2.041 . . . . 2.5 114.603 -175.487 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 1.1 t -62.27 -17.13 57.7 Favored 'General case' 0 CA--C 1.549 0.904 0 O-C-N 120.342 -1.474 . . . . 3.1499999999999999 114.345 176.824 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.465 HG21 ' HE2' ' B' ' 61' ' ' LYS . 76.0 t -59.33 -45.1 93.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 O-C-N 120.269 -1.519 . . . . 1.5 110.991 169.75 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -60.29 -51.45 69.49 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.551 0.74 . . . . 1.71 110.249 175.893 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 31.9 mt -55.96 -39.28 71.52 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.745 0.818 . . . . 1.3700000000000001 112.383 176.576 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 95.0 m -60.61 -53.53 56.37 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.759 1.223 . . . . 0.89000000000000001 111.87 176.715 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 33.1 mtm -63.78 -36.33 83.52 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 118.727 0.694 . . . . 1.73 112.399 -177.134 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 82.1 mt -67.77 -45.82 73.81 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.91 0.884 . . . . 1.4199999999999999 111.947 176.814 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 80' ' ' CYS . . . . . 0.404 ' HB3' ' CE1' ' A' ' 69' ' ' PHE . 61.7 m -59.79 -37.63 79.67 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 118.083 -0.96 . . . . 1.5 112.719 173.744 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 81' ' ' MET . . . . . 0.558 ' SD ' ' HE2' ' A' ' 70' ' ' LYS . 21.9 mtp -66.44 -36.25 82.33 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.476 1.034 . . . . 2.5299999999999998 113.204 174.817 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.04 -47.65 73.67 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.856 0.753 . . . . 1.02 111.635 173.999 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -65.01 -30.46 71.44 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.429 0.9 . . . . 2.8100000000000001 113.429 176.354 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 26.5 t30 -61.84 -52.59 63.54 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 118.983 0.811 . . . . 3.0899999999999999 112.268 174.322 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -61.74 -47.22 86.21 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.229 1.411 . . . . 3.0 111.935 -179.774 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.27 -46.97 69.49 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.517 1.527 . . . . 3.4399999999999999 111.717 177.346 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -61.57 -29.93 70.33 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.347 1.059 . . . . 2.79 112.931 178.133 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 68.4 mt -77.19 -11.88 59.88 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.043 0.937 . . . . 2.3199999999999998 113.24 179.657 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 89' ' ' GLU . . . . . 0.454 ' O ' ' HE2' ' B' ' 92' ' ' LYS . 24.4 mm-40 -106.13 0.84 25.75 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.54 1.536 . . . . 5.1500000000000004 114.72 170.992 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -110.64 -50.91 2.91 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.235 1.814 . . . . 2.9700000000000002 112.46 -178.406 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -90.38 14.74 12.1 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 125.358 1.463 . . . . 3.8999999999999999 113.623 -177.136 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 92' ' ' LYS . . . . . 0.454 ' HE2' ' O ' ' B' ' 89' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 115.814 -2.041 . . . . 5.0 115.974 -177.246 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.239 0.525 0 N-CA-C 109.332 -0.618 . . . . 5.9400000000000004 109.332 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.765 HG23 ' H ' ' A' ' 6' ' ' GLU . 3.5 t -55.58 146.91 42.39 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.425 1.49 . . . . 2.2999999999999998 112.751 178.465 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -62.35 -14.75 40.65 Favored 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 122.084 1.856 . . . . 1.72 112.69 169.345 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.401 HD12 HG21 ' B' ' 15' ' ' THR . 1.1 tt -76.99 -34.64 57.52 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.387 0.994 . . . . 2.3500000000000001 111.705 173.313 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.765 ' H ' HG23 ' A' ' 3' ' ' THR . 2.8 tm-20 -59.77 -47.08 87.13 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.618 1.099 . . . . 4.7999999999999998 108.835 166.375 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.42 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -59.03 -27.26 65.3 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.916 -1.115 . . . . 4.0099999999999998 112.685 175.176 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -75.1 -48.56 23.21 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.798 1.239 . . . . 1.1299999999999999 112.589 172.992 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.4 mt -57.99 -42.67 85.62 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.693 1.133 . . . . 1.6200000000000001 111.538 172.479 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 8.2 m -57.36 -51.54 69.0 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.346 1.858 . . . . 1.8600000000000001 111.137 170.555 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.7 m -58.78 -44.22 90.64 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.272 1.396 . . . . 1.51 111.731 178.112 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 5.8 tmm? -55.95 -58.82 6.29 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.615 0.766 . . . . 3.6800000000000002 110.538 172.609 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.1 p -66.78 -26.6 37.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 CA-C-N 119.769 1.168 . . . . 2.1699999999999999 112.931 -177.75 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 98.7 m -60.86 -61.27 2.7 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.399 1.079 . . . . 0.89000000000000001 109.71 175.878 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.78 -31.87 65.19 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-O 118.383 -0.817 . . . . 2.9199999999999999 109.954 -173.746 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -65.11 -50.43 66.12 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.115 0.87 . . . . 2.27 112.547 171.854 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -68.28 -19.69 64.72 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.061 0.846 . . . . 1.98 111.887 -178.05 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.8 mtpp -68.93 -53.47 20.73 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 120.822 -1.174 . . . . 3.5499999999999998 111.928 163.48 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -73.53 -32.75 64.38 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.689 1.366 . . . . 2.5 114.689 -175.981 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.5 p -67.41 -22.37 65.54 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 121.298 1.863 . . . . 2.4100000000000001 112.439 172.736 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.53 -2.68 82.05 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.169 1.366 . . . . 1.7 114.959 171.425 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.415 ' HE ' ' CD ' ' A' ' 36' ' ' GLU . 49.6 tpt85 -64.0 -19.17 64.98 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.53 1.665 . . . . 4.3499999999999996 114.943 -172.222 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -155.68 -178.71 7.48 Favored 'General case' 0 C--O 1.247 0.938 0 C-N-CA 129.701 3.2 . . . . 3.8100000000000001 107.808 165.673 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 24.96 99.41 0.01 OUTLIER Glycine 0 C--N 1.346 1.133 0 C-N-CA 126.946 2.212 . . . . 2.8500000000000001 114.651 149.364 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t 60.28 136.78 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.822 1.649 . . . . 2.71 112.819 -176.931 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -80.5 -9.72 59.76 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.933 1.086 . . . . 5.1500000000000004 113.933 171.244 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 73.9 mt -79.91 -40.0 29.17 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 118.986 0.812 . . . . 3.77 110.597 174.523 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.7 p -121.94 150.18 42.37 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-O 122.877 1.322 . . . . 1.4299999999999999 112.545 -161.645 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.51 120.85 43.05 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 114.041 -1.436 . . . . 2.6299999999999999 111.706 176.888 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.5 p -68.85 169.43 11.5 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.911 1.285 . . . . 2.9199999999999999 113.202 167.636 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 46.2 ttt85 -50.35 -26.77 5.27 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 115.549 1.685 . . . . 4.3799999999999999 115.549 176.656 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.86 -28.71 14.59 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.575 1.324 . . . . 4.3499999999999996 114.575 174.455 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -58.37 -52.44 65.59 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.563 1.074 . . . . 1.6100000000000001 109.021 163.615 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.9 tt -57.01 -45.89 82.73 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 128.142 2.577 . . . . 3.8500000000000001 112.168 175.573 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.3 ttmt -70.38 -38.19 74.67 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 118.692 0.678 . . . . 3.79 111.63 -178.871 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.415 ' CD ' ' HE ' ' A' ' 22' ' ' ARG . 25.2 tt0 -60.1 -47.63 85.09 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 118.265 -0.874 . . . . 4.7800000000000002 111.729 169.097 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 tt -56.17 -59.87 4.31 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.46 1.104 . . . . 2.4399999999999999 110.652 179.289 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.7 mt -63.63 -54.37 33.15 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.523 0 CA-C-O 118.626 -0.702 . . . . 1.55 109.408 -177.843 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.1 ttpp -72.0 -8.24 53.4 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 120.978 1.717 . . . . 4.1900000000000004 114.097 -172.691 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -90.77 -54.28 4.04 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 120.288 1.404 . . . . 4.5599999999999996 112.874 165.365 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -71.91 -33.24 68.14 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.82 1.191 . . . . 5.1100000000000003 111.511 -177.362 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.4 mt -111.53 65.32 0.62 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.81 1.644 . . . . 2.8100000000000001 109.42 163.401 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 15.2 t -75.33 36.12 0.12 Allowed 'General case' 0 CA--C 1.55 0.975 0 O-C-N 120.68 -1.263 . . . . 4.5700000000000003 112.798 172.619 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 31.3 mt -96.23 169.88 9.63 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.488 1.515 . . . . 4.8600000000000003 111.466 -175.398 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.43 -25.44 74.8 Favored Glycine 0 N--CA 1.475 1.278 0 C-N-CA 123.929 0.776 . . . . 3.73 112.502 -179.481 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -59.09 -34.51 72.08 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.752 2.021 . . . . 5.2999999999999998 111.402 173.58 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.53 66.34 2.77 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 124.511 2.101 . . . . 2.6499999999999999 112.878 -172.376 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 ptpp? -72.78 161.95 30.09 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 112.315 -2.22 . . . . 4.6100000000000003 110.692 156.39 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -49.38 -44.91 45.32 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 118.916 0.78 . . . . 5.4000000000000004 112.518 -179.253 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.2 m -61.33 -19.31 61.66 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.797 1.406 . . . . 3.04 114.797 178.558 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.8 m -83.85 -27.18 28.89 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.555 1.071 . . . . 2.6400000000000001 112.675 170.219 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 88.4 mt -80.91 -32.94 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 126.195 1.798 . . . . 2.1099999999999999 111.113 -178.88 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -61.93 -55.84 25.4 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.555 1.142 . . . . 3.8100000000000001 112.028 176.875 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -66.67 -26.16 66.91 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.764 0.653 . . . . 3.3599999999999999 112.764 177.163 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.1 tt -69.95 -38.92 76.28 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.354 -0.841 . . . . 2.9399999999999999 110.657 172.261 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.4 ttt -59.72 -49.59 77.14 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-O 117.85 -1.071 . . . . 2.3799999999999999 111.83 165.515 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -66.08 -22.97 66.43 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 121.171 1.805 . . . . 5.1900000000000004 113.124 179.041 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 29.0 t -81.15 -38.9 26.41 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.035 1.334 . . . . 2.23 112.043 176.545 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 84.3 mt -81.8 -44.98 16.23 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 119.065 0.848 . . . . 1.8100000000000001 112.153 175.593 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -77.51 63.72 2.71 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.96 1.304 . . . . 2.73 111.327 -177.379 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -58.73 -22.31 57.33 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 125.813 1.645 . . . . 4.5800000000000001 113.936 -172.923 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -106.87 0.83 24.22 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 114.703 1.371 . . . . 2.4100000000000001 114.703 173.569 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.5 t 62.0 27.61 16.73 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.868 1.432 . . . . 3.2799999999999998 114.868 169.201 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.3 p-10 -86.69 2.6 48.01 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.171 1.788 . . . . 2.2400000000000002 111.914 -174.742 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.69 1.34 3.96 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 129.813 3.245 . . . . 4.3399999999999999 113.565 -173.802 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -119.59 131.99 55.62 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 123.691 1.71 . . . . 3.25 111.251 -179.392 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 3.6 mp -110.01 106.55 20.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 N-CA-C 107.653 -1.24 . . . . 2.3199999999999998 107.653 171.536 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -79.75 166.06 22.16 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.404 1.481 . . . . 3.4500000000000002 110.923 168.471 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -45.29 -38.26 5.49 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.556 1.142 . . . . 2.1499999999999999 112.817 171.77 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.87 -26.98 68.56 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 115.287 1.588 . . . . 5.29 115.287 177.012 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -90.74 -47.06 7.86 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.488 1.915 . . . . 2.5600000000000001 109.414 170.789 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -57.97 -34.35 69.86 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 126.825 2.05 . . . . 2.5600000000000001 114.399 -173.84 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.6 t -59.21 -18.74 39.43 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.878 1.217 . . . . 1.8799999999999999 112.884 -178.163 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 84.9 t -65.49 -25.35 36.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.804 0.841 . . . . 2.0099999999999998 112.024 172.135 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -63.21 -52.66 61.35 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.071 1.348 . . . . 2.6200000000000001 110.226 173.093 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.1 mt -58.28 -39.7 79.94 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.423 1.089 . . . . 2.2200000000000002 110.06 177.34 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.6 m -62.82 -52.44 63.14 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 117.707 -1.14 . . . . 1.2 112.045 174.254 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 70.2 mtm -55.66 -45.43 77.71 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.876 1.216 . . . . 1.97 111.754 -179.553 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 47.4 mt -76.68 -40.57 48.44 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.806 0.842 . . . . 1.49 112.444 -177.098 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 42.4 t -62.54 -36.66 83.33 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.53 1.059 . . . . 2.04 111.943 171.469 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 83.2 mtp -64.27 -39.46 93.98 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.223 0.92 . . . . 2.1000000000000001 112.149 170.408 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.11 -45.98 82.9 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 119.293 0.951 . . . . 1.0600000000000001 112.164 177.351 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -64.52 -36.12 83.18 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.248 0.833 . . . . 2.48 113.248 175.136 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.83 -46.33 89.94 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.016 0.825 . . . . 2.4900000000000002 112.079 174.542 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -67.33 -37.32 83.12 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.953 -0.467 . . . . 2.8500000000000001 111.163 -177.943 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.93 -54.98 26.96 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.027 1.331 . . . . 2.04 111.053 169.727 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -60.84 -30.66 70.24 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.318 1.047 . . . . 2.3999999999999999 112.612 -175.852 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 69.6 mt -74.56 -15.36 60.85 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.042 0.937 . . . . 2.0800000000000001 113.243 176.052 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -97.8 -23.99 15.64 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.295 1.221 . . . . 3.29 114.295 167.633 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 . . . . . 0 CA--C 1.542 0.649 0 C-N-CA 125.446 1.499 . . . . 4.0099999999999998 113.79 179.966 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.617 0 CA-C-O 118.508 -0.758 . . . . 3.0699999999999998 111.559 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -69.39 -31.59 21.85 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.489 2.126 . . . . 2.8799999999999999 115.237 -156.337 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 8.5 tt -68.67 -54.38 16.61 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 120.351 1.432 . . . . 3.9399999999999999 111.378 171.856 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -57.66 -43.6 85.08 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.718 0.807 . . . . 6.1799999999999997 111.241 -178.545 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.36 -38.03 40.2 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 125.449 1.5 . . . . 4.3300000000000001 112.926 175.371 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.08 -43.58 61.64 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.604 0.761 . . . . 1.1899999999999999 110.409 179.981 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 73.2 mt -60.54 -36.39 78.34 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 123.513 0.725 . . . . 2.0499999999999998 112.088 174.051 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.4 m -55.19 -45.31 75.82 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 118.61 0.641 . . . . 1.48 112.074 170.338 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.4 t -72.35 -29.82 64.16 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.084 -0.96 . . . . 2.04 112.612 179.352 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 43.3 mtp -61.32 -51.61 68.12 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 118.151 -0.928 . . . . 3.0699999999999998 111.529 176.02 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 26.3 m -62.65 -33.28 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 CA-C-N 119.037 0.835 . . . . 2.52 112.15 176.592 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 54.0 m -67.93 -37.94 82.24 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.19 1.396 . . . . 1.03 113.049 -178.224 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 15' ' ' THR . . . . . 0.401 HG21 HD12 ' A' ' 5' ' ' LEU . 0.8 OUTLIER -70.59 -38.35 74.0 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 118.798 0.726 . . . . 1.6200000000000001 111.277 165.408 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -65.88 -49.68 67.21 Favored 'General case' 0 N--CA 1.462 0.139 0 O-C-N 123.929 0.768 . . . . 2.0600000000000001 111.439 -167.422 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -64.73 -23.49 67.27 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.903 0.774 . . . . 3.71 112.44 -179.095 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -78.81 -52.04 8.91 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.659 -0.651 . . . . 4.6200000000000001 111.45 178.187 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -66.86 -43.0 84.74 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.069 -1.019 . . . . 2.1200000000000001 112.137 178.181 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 83.8 p -74.9 -16.7 60.65 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.137 1.162 . . . . 1.4099999999999999 114.137 176.491 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.65 -23.56 49.74 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-O 117.683 -1.621 . . . . 1.54 113.748 170.881 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.92 -19.18 60.77 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 119.939 1.87 . . . . 4.6100000000000003 114.037 -165.442 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -124.49 122.67 38.26 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 119.096 0.862 . . . . 3.77 108.875 169.805 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.11 -1.23 2.87 Favored Glycine 0 N--CA 1.477 1.428 0 C-N-CA 127.968 2.699 . . . . 3.1899999999999999 117.793 -144.718 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 52.8 p -56.66 75.74 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.973 0 CA-C-O 121.463 0.649 . . . . 5.5999999999999996 109.885 141.986 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -75.87 118.98 19.23 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 119.657 -1.902 . . . . 6.2999999999999998 111.208 -173.0 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 86.3 mt 96.37 -8.2 0.08 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 130.376 3.47 . . . . 4.5800000000000001 112.751 -179.361 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 45.2 p -108.19 144.09 36.1 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 124.904 1.282 . . . . 1.8899999999999999 111.635 168.047 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 29.1 mt -97.73 114.21 26.16 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.388 1.875 . . . . 1.72 112.527 177.361 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 20.3 p -68.86 167.86 14.72 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.533 1.533 . . . . 3.5600000000000001 113.798 165.292 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -58.58 -0.62 0.11 Allowed 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 115.958 1.836 . . . . 4.0899999999999999 115.958 172.554 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.0 -44.79 3.24 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.577 1.551 . . . . 3.8700000000000001 112.819 169.693 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -54.08 -44.97 71.63 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.478 1.036 . . . . 1.9299999999999999 109.538 171.819 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 56.1 tp -67.6 -44.08 78.95 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.599 1.559 . . . . 2.4100000000000001 112.448 179.449 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -55.39 -43.7 75.44 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.856 -0.592 . . . . 3.3300000000000001 111.147 172.537 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -60.73 -52.92 63.07 Favored 'General case' 0 C--O 1.224 -0.279 0 O-C-N 123.824 0.702 . . . . 2.8399999999999999 110.761 178.085 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.6 tt -59.14 -58.89 6.65 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.668 1.187 . . . . 2.1600000000000001 110.565 -178.534 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 25.7 mt -54.56 -46.47 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 119.304 0.956 . . . . 1.05 110.073 179.159 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -74.32 -17.91 60.78 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 115.111 1.522 . . . . 6.1500000000000004 115.111 -177.354 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -93.15 -14.32 27.34 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.358 1.863 . . . . 3.4199999999999999 112.66 171.811 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -96.54 -37.09 10.53 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.13 1.772 . . . . 5.21 111.537 176.497 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -127.33 120.86 29.52 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.637 1.575 . . . . 2.04 109.446 174.152 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 4.7 t -131.58 -9.42 3.62 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 115.255 1.576 . . . . 3.4500000000000002 115.255 174.088 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -47.46 -16.19 0.06 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 128.654 2.782 . . . . 3.5499999999999998 118.432 175.878 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.88 169.05 12.62 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-N 120.106 1.321 . . . . 3.5699999999999998 114.711 178.295 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 26.0 tp10 62.98 -22.19 0.05 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 129.775 3.23 . . . . 5.5300000000000002 117.203 172.776 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 32.9 tpp -75.74 82.11 2.7 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.459 -1.401 . . . . 2.4700000000000002 111.332 -179.621 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 41.9 mttt -89.45 173.98 8.04 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.668 2.387 . . . . 3.7599999999999998 110.771 179.753 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 44.8 tp10 -48.79 -52.72 22.44 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.856 0.862 . . . . 3.8700000000000001 111.202 171.574 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 2.8 m -64.67 -27.61 69.04 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.372 1.249 . . . . 3.1699999999999999 114.372 177.417 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 3.8 m -74.0 -31.72 63.07 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.399 -0.813 . . . . 2.9399999999999999 111.479 176.828 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 28.9 mm -68.72 -38.47 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.66 0.784 . . . . 1.46 111.11 171.575 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -70.55 -43.68 69.03 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.654 0.983 . . . . 3.3599999999999999 113.654 -167.542 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.99 -27.43 26.45 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 113.474 0.916 . . . . 3.7799999999999998 113.474 175.748 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 60.6 tp -56.22 -48.42 76.49 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 118.661 -0.685 . . . . 2.0 110.199 167.82 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.9 ppp? -62.03 -32.17 72.64 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.605 1.093 . . . . 2.79 113.681 -177.154 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 44.9 mttp -65.59 -25.25 67.32 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.041 0.837 . . . . 5.8499999999999996 112.685 174.494 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.1 t -92.17 -32.29 15.15 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.928 1.291 . . . . 1.96 113.896 177.007 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 69.3 mt -74.43 -25.44 59.45 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.947 0.899 . . . . 2.1699999999999999 112.81 175.143 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -80.81 121.5 26.02 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 122.457 1.122 . . . . 1.3799999999999999 111.013 174.32 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -85.57 -13.77 47.83 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.059 1.133 . . . . 5.8799999999999999 114.059 -156.533 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 45.5 p-10 -141.95 -6.46 0.97 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.385 2.274 . . . . 2.52 115.324 -169.566 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 68.73 43.59 1.26 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.927 1.291 . . . . 2.27 113.098 -175.086 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 40.0 p30 -87.96 -16.86 32.62 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.941 1.297 . . . . 2.1899999999999999 112.004 165.027 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 70.47 14.78 7.33 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 130.258 3.423 . . . . 6.6900000000000004 114.819 179.099 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -124.26 143.79 50.34 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.362 1.065 . . . . 3.6099999999999999 110.665 161.36 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 6.3 mm -97.34 105.38 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 O-C-N 121.33 -0.856 . . . . 1.4299999999999999 110.143 179.135 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.02 155.69 39.93 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.998 1.319 . . . . 2.8999999999999999 111.437 166.355 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -46.44 -47.2 19.1 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.711 1.374 . . . . 3.4399999999999999 114.711 177.224 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . 0.301 0.3 OUTLIER -85.38 -1.15 56.7 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 120.329 -1.482 . . . . 4.6500000000000004 114.598 177.688 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -77.03 -53.85 7.29 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 108.866 -0.79 . . . . 2.2400000000000002 108.866 152.15 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -52.82 -29.84 30.0 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 127.579 2.352 . . . . 2.29 115.272 -173.827 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 26.8 t -57.14 -21.63 34.04 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 120.588 -1.32 . . . . 1.74 113.679 170.589 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 87.5 t -66.83 -45.88 86.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 120.109 1.322 . . . . 2.23 110.666 174.991 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 75' ' ' PHE . . . . . 0.454 ' CZ ' HD11 ' B' ' 79' ' ' LEU . 30.1 t80 -56.38 -46.39 80.12 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.146 0.978 . . . . 1.7 111.512 172.532 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 33.7 mt -61.19 -41.88 97.59 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.426 -0.797 . . . . 1.79 111.533 178.231 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 93.7 m -56.53 -49.9 73.41 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.307 0.958 . . . . 1.3300000000000001 111.883 171.333 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 76.7 mtp -60.35 -46.4 90.05 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.838 0.744 . . . . 2.2999999999999998 111.922 -177.895 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.454 HD11 ' CZ ' ' B' ' 75' ' ' PHE . 82.3 mt -62.35 -50.67 70.65 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.064 0.546 . . . . 1.98 110.884 175.172 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 88.2 m -59.11 -33.02 70.36 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.151 0.887 . . . . 2.5499999999999998 113.279 179.942 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 63.8 mtt -74.45 -34.67 63.23 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.043 0.937 . . . . 3.9900000000000002 113.468 172.78 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.79 -41.35 71.76 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.737 1.153 . . . . 1.3200000000000001 111.662 176.446 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -57.52 -23.22 49.0 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.781 1.232 . . . . 2.8900000000000001 112.636 172.912 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -67.75 -42.72 81.36 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.178 -0.952 . . . . 2.0699999999999998 111.782 173.629 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -80.94 -32.63 34.51 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.291 1.036 . . . . 2.6400000000000001 111.563 -177.816 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -54.91 -37.28 66.16 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.255 1.822 . . . . 2.8900000000000001 111.644 166.56 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -74.27 -16.68 60.94 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.838 1.255 . . . . 2.0800000000000001 113.042 174.946 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 6.7 mp -79.29 -25.94 42.36 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 120.489 -1.382 . . . . 3.0 113.107 168.906 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -62.55 -22.03 66.03 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 113.187 0.81 . . . . 7.3300000000000001 113.187 169.87 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -85.33 -56.6 3.45 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.174 1.79 . . . . 4.1399999999999997 111.285 171.575 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.15 -8.24 29.58 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 115.472 1.656 . . . . 3.6099999999999999 115.472 -173.002 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.971 0 C-N-CA 126.608 1.963 . . . . 5.5899999999999999 115.691 -179.43 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.446 -0.673 0 N-CA-C 103.958 -2.608 . . . . 6.0700000000000003 103.958 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.41 162.71 13.57 Favored Pre-proline 0 N--CA 1.475 0.823 0 O-C-N 121.68 -0.638 . . . . 1.47 110.345 169.376 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.75 -21.22 21.88 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 121.447 1.431 . . . . 1.3300000000000001 111.569 173.731 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -77.08 -43.27 34.95 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.903 1.681 . . . . 3.1899999999999999 112.386 176.442 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -51.05 -49.36 60.72 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.887 0.875 . . . . 3.7400000000000002 109.249 168.015 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -64.44 -38.1 89.84 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 120.889 -1.132 . . . . 3.9100000000000001 113.781 174.952 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.04 -52.19 64.93 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.605 1.093 . . . . 0.96999999999999997 112.306 178.986 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.0 mt -66.64 -31.98 73.01 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.156 0.582 . . . . 2.0600000000000001 111.895 176.873 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.2 m -58.71 -52.05 67.36 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 117.899 -1.048 . . . . 1.6200000000000001 111.378 166.969 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 49.9 m -55.84 -41.27 74.05 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.918 1.235 . . . . 1.24 111.632 179.868 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 75.4 mmm -58.09 -54.43 47.08 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 122.951 0.501 . . . . 3.6800000000000002 111.495 174.521 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.4 t -63.96 -31.97 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 CA-C-N 119.019 0.827 . . . . 2.1699999999999999 112.083 179.03 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.7 m -64.0 -57.67 9.0 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.358 1.463 . . . . 0.75 111.244 -179.395 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 t -67.07 -36.1 81.26 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 118.854 -0.593 . . . . 2.9900000000000002 109.601 178.363 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -56.39 -48.07 77.64 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-O 117.746 -1.121 . . . . 1.8100000000000001 110.935 175.632 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.1 m80 -60.99 -43.65 98.56 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 120.816 1.643 . . . . 2.1800000000000002 112.584 173.283 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -62.69 -23.1 66.96 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.145 1.378 . . . . 4.1699999999999999 114.311 -176.069 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -95.38 -47.73 6.17 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.537 1.062 . . . . 2.7400000000000002 111.191 161.891 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.408 ' HA ' ' OE1' ' A' ' 33' ' ' GLU . 15.7 t -54.38 -39.25 67.03 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.461 1.904 . . . . 1.8500000000000001 115.286 -168.689 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.86 7.37 42.95 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 125.43 1.491 . . . . 2.48 115.472 179.747 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 -118.57 96.66 5.38 Favored 'General case' 0 C--O 1.221 -0.424 0 N-CA-C 106.854 -1.535 . . . . 4.21 106.854 174.994 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 88.26 148.67 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 127.897 2.479 . . . . 3.6499999999999999 111.623 -168.896 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.9 -145.44 49.76 Favored Glycine 0 CA--C 1.526 0.741 0 C-N-CA 124.182 0.896 . . . . 2.6499999999999999 112.168 177.155 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.4 m -88.35 164.53 15.5 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 122.085 -0.656 . . . . 3.0099999999999998 112.466 170.199 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -16.13 63.24 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 114.499 1.296 . . . . 7.9699999999999998 114.499 179.42 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.446 ' H ' HD23 ' A' ' 27' ' ' LEU . 2.5 pt? -117.13 10.95 14.02 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.496 1.919 . . . . 3.46 112.497 179.209 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.2 p -122.53 134.43 54.55 Favored 'General case' 0 C--O 1.249 1.043 0 N-CA-C 114.421 1.267 . . . . 1.0900000000000001 114.421 171.97 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 69.8 mt -95.62 104.27 16.18 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.413 1.085 . . . . 1.7 109.821 167.488 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.0 t -58.71 150.49 23.38 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.421 -0.799 . . . . 1.8500000000000001 109.965 161.284 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 34.3 ttp85 -45.47 -30.31 1.37 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 115.831 1.789 . . . . 3.1299999999999999 115.831 -172.56 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -36.9 38.87 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.029 1.122 . . . . 3.9500000000000002 114.029 176.012 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.408 ' OE1' ' HA ' ' A' ' 20' ' ' SER . 20.1 mt-10 -59.34 -50.63 73.22 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.827 0.851 . . . . 1.54 109.351 169.685 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.3 tp -57.84 -46.61 84.51 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.405 1.082 . . . . 1.8600000000000001 111.902 178.032 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -49.34 -50.88 37.76 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.395 1.078 . . . . 3.9900000000000002 112.92 -178.373 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -89.6 -11.96 41.12 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 115.25 1.574 . . . . 4.54 115.25 -178.678 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.4 tt -63.81 -60.93 2.67 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 120.063 1.301 . . . . 1.96 109.432 160.285 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.3 mt -58.03 -43.18 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 N-CA-C 110.215 -0.291 . . . . 0.95999999999999996 110.215 -175.353 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.8 mtpt -64.25 -12.15 38.37 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 114.15 1.166 . . . . 4.7000000000000002 114.15 -179.492 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -109.15 -24.02 11.35 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.186 1.794 . . . . 4.3899999999999997 112.335 -178.392 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 72.4 mt-10 -65.93 -48.07 72.63 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.793 1.178 . . . . 3.9900000000000002 111.372 163.056 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 77.3 mt -124.68 149.74 46.86 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.629 1.572 . . . . 2.4100000000000001 111.419 -163.516 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 1.7 t -156.01 11.86 0.3 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.149 1.38 . . . . 3.8300000000000001 112.713 179.184 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.97 28.79 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 126.382 1.873 . . . . 3.8700000000000001 116.005 178.034 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.5 -49.86 3.69 Favored Glycine 0 N--CA 1.474 1.201 0 C-N-CA 125.924 1.726 . . . . 2.9100000000000001 115.033 170.17 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.59 -35.3 80.56 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.841 1.257 . . . . 7.6600000000000001 112.7 -177.62 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 45.2 tpp -83.86 68.82 10.1 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 123.053 1.406 . . . . 2.3199999999999998 112.597 -179.025 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -66.14 163.27 17.98 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.227 1.411 . . . . 5.4299999999999997 112.726 174.59 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.59 -46.64 14.43 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.832 0.853 . . . . 4.7599999999999998 111.452 160.768 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.1 t -70.45 -37.71 74.38 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 114.852 1.427 . . . . 2.4100000000000001 114.852 175.077 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.0 m -62.91 -32.53 73.83 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 121.148 1.794 . . . . 1.9299999999999999 111.636 176.871 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.3 mt -63.85 -30.53 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 124.795 1.238 . . . . 1.6799999999999999 113.765 179.917 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -81.08 -24.45 37.77 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.813 1.188 . . . . 3.3900000000000001 112.64 -179.739 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -73.84 -42.15 61.25 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.406 -0.809 . . . . 3.0699999999999998 111.0 168.165 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 43.3 tp -57.75 -45.37 85.97 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.886 1.274 . . . . 2.0699999999999998 110.758 168.581 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -56.75 -47.2 80.59 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 125.543 1.537 . . . . 2.1200000000000001 110.886 175.315 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -26.34 64.75 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 121.205 -0.934 . . . . 3.9700000000000002 113.405 174.113 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 t -88.68 -32.8 17.81 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 120.714 -1.242 . . . . 2.23 113.468 176.917 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.441 ' CD2' ' HA ' ' A' ' 72' ' ' TYR . 7.1 mt -58.42 -50.59 73.16 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.815 1.246 . . . . 2.6400000000000001 110.938 165.06 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -102.57 76.47 1.53 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.375 1.87 . . . . 1.8899999999999999 112.791 -161.78 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -60.42 -21.33 62.12 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 113.67 0.989 . . . . 3.04 113.67 -167.689 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 51.6 p30 -100.5 -8.29 23.28 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.662 1.585 . . . . 2.2000000000000002 114.351 177.657 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 73.4 m 54.89 33.64 20.38 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.201 1.4 . . . . 2.5499999999999998 114.069 -174.687 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.4 p30 -71.02 -15.54 62.56 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.547 1.539 . . . . 2.1400000000000001 111.872 176.35 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 66.04 4.53 3.1 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 131.558 3.943 . . . . 4.0300000000000002 116.131 -174.9 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -103.99 126.86 51.43 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 127.193 2.197 . . . . 2.52 109.056 167.527 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 1.6 mm -104.3 100.74 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 O-C-N 120.953 -1.092 . . . . 1.05 111.024 -175.041 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -75.28 156.86 35.2 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 127.421 2.289 . . . . 2.54 111.275 170.561 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -45.41 -41.36 9.14 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.125 1.528 . . . . 3.5499999999999998 115.125 -179.994 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.6 pttm -80.14 -10.22 59.75 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 113.912 1.078 . . . . 3.23 113.912 -178.595 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -80.93 -53.67 6.24 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 108.043 -1.095 . . . . 1.79 108.043 158.278 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.441 ' HA ' ' CD2' ' A' ' 59' ' ' LEU . 30.9 t80 -54.48 -36.38 64.07 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.343 2.257 . . . . 2.79 116.178 -170.891 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.6 p -67.69 -23.12 65.26 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 120.725 -1.234 . . . . 2.29 112.79 -170.77 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 p -60.74 -28.13 42.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 CA-C-N 118.56 0.618 . . . . 2.2200000000000002 112.586 176.517 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -74.72 -58.9 3.0 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.921 0.889 . . . . 2.3100000000000001 110.469 -175.752 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.494 ' H ' HD23 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -61.83 -24.53 66.94 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 118.045 -0.978 . . . . 2.0299999999999998 113.126 172.452 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 53.7 m -58.59 -53.72 55.21 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.874 0.87 . . . . 0.84999999999999998 110.946 165.411 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 61.8 mtm -60.95 -40.18 92.31 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.822 0.737 . . . . 1.49 112.356 178.451 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 60.7 mt -60.09 -51.42 69.69 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.784 0.72 . . . . 1.48 110.729 174.698 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 82.0 m -63.84 -35.07 79.41 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.098 0.777 . . . . 1.8400000000000001 113.098 178.024 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 75.3 mtp -62.81 -44.35 96.38 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.892 1.224 . . . . 2.0800000000000001 111.325 171.57 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.44 -47.82 82.39 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.932 -0.556 . . . . 0.82999999999999996 111.452 177.249 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -62.85 -32.16 73.33 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.941 0.792 . . . . 3.1299999999999999 113.085 177.005 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -67.74 -39.98 84.17 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 119.88 1.218 . . . . 2.2599999999999998 111.358 177.133 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -72.69 -39.47 67.0 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.001 0.819 . . . . 2.98 110.965 178.465 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -53.62 -42.34 67.63 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.008 1.723 . . . . 2.3900000000000001 111.464 170.653 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -58.92 -29.31 66.99 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.23 1.012 . . . . 2.4199999999999999 112.886 -179.448 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.9 mp -74.7 -23.55 58.62 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.57 0.748 . . . . 2.23 112.916 174.494 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -91.82 -14.58 29.53 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.809 1.644 . . . . 2.6499999999999999 114.359 175.858 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 31.9 t70 . . . . . 0 CA--C 1.54 0.562 0 C-N-CA 128.045 2.538 . . . . 3.71 113.067 -170.475 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 17.2 p . . . . . 0 N--CA 1.469 0.476 0 N-CA-C 113.037 0.754 . . . . 1.8300000000000001 113.037 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -62.75 -18.93 66.87 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.701 2.267 . . . . 2.3900000000000001 112.257 166.713 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 9.7 tt -68.39 -51.99 37.94 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-O 118.482 -0.771 . . . . 2.7400000000000002 110.387 166.477 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.05 -30.62 71.74 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.755 1.161 . . . . 3.79 111.974 176.973 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -33.54 68.18 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 119.523 -1.986 . . . . 5.3300000000000001 111.963 172.494 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.03 -40.03 94.23 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 119.691 1.132 . . . . 1.8100000000000001 112.648 169.76 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 68.2 mt -64.77 -35.55 81.45 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.287 0.949 . . . . 2.1800000000000002 111.872 171.018 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 36.5 m -60.96 -52.01 66.83 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 118.061 -0.971 . . . . 1.3500000000000001 110.182 170.416 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 93.1 m -50.93 -38.75 52.23 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.069 1.348 . . . . 1.6499999999999999 111.802 175.776 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 5.1 ttp -53.45 -51.52 62.41 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.585 0.754 . . . . 3.3900000000000001 112.022 174.229 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 34.5 m -74.66 -27.84 21.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 N-CA-C 113.251 0.834 . . . . 2.25 113.251 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 17.9 m -59.22 -54.84 42.37 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.656 1.182 . . . . 1.29 110.745 176.446 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.93 -32.12 51.41 Favored 'General case' 0 C--O 1.224 -0.252 0 O-C-N 123.62 0.575 . . . . 3.6499999999999999 110.463 -175.989 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -54.49 -44.52 72.72 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.312 0.505 . . . . 1.96 110.718 172.418 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.21 -27.32 63.79 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.821 1.415 . . . . 2.02 114.821 179.04 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -63.71 -45.6 89.26 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 120.833 -1.167 . . . . 5.0700000000000003 111.537 172.541 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.503 ' CD2' HD13 ' B' ' 37' ' ' LEU . 21.5 m-85 -87.7 -10.27 51.7 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.428 1.091 . . . . 2.0299999999999998 113.098 -178.383 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 68.2 m -58.05 -56.52 20.96 Favored 'General case' 0 C--O 1.241 0.624 0 O-C-N 120.883 -1.136 . . . . 1.8300000000000001 112.009 164.018 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.12 -20.31 53.24 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-O 117.407 -1.774 . . . . 2.52 114.77 -168.439 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -47.85 -46.51 31.2 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.402 1.481 . . . . 3.7799999999999998 113.118 -169.572 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 57.0 mp0 -130.74 153.53 48.92 Favored 'General case' 0 C--O 1.248 0.981 0 CA-C-O 124.014 1.864 . . . . 3.5899999999999999 111.912 167.744 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.92 -8.15 2.65 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.32 1.438 . . . . 2.3700000000000001 113.903 -172.309 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 15.1 m 57.1 -142.83 0.73 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.485 1.114 . . . . 6.1500000000000004 109.781 -159.782 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 24.1 mttt 68.25 -172.48 0.19 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.274 1.83 . . . . 11.44 112.541 172.522 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 mp -82.91 -0.8 50.1 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.829 1.251 . . . . 3.71 112.843 173.683 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 21.8 p -113.57 152.47 30.25 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 115.765 1.765 . . . . 1.1200000000000001 115.765 -155.578 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -101.43 108.39 19.97 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 127.205 2.202 . . . . 2.0899999999999999 113.022 -172.215 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 12.9 t -84.1 162.46 20.29 Favored 'General case' 0 C--N 1.315 -0.896 0 O-C-N 120.247 -1.533 . . . . 2.0899999999999999 112.16 176.835 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 24.0 ttt85 -45.14 -41.11 7.69 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.603 1.561 . . . . 4.0099999999999998 114.426 -178.17 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.82 -36.36 42.71 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.898 -1.126 . . . . 6.3099999999999996 113.277 174.279 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -60.5 -46.11 91.32 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 120.041 1.291 . . . . 1.8 110.393 176.349 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 8.2 tp -65.69 -36.78 84.61 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.008 1.723 . . . . 1.9399999999999999 113.076 178.7 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -64.91 -28.03 69.26 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.362 1.065 . . . . 5.2599999999999998 112.363 174.506 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.03 -77.19 0.08 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.061 -0.971 . . . . 3.2400000000000002 108.541 158.822 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 37' ' ' LEU . . . . . 0.503 HD13 ' CD2' ' B' ' 19' ' ' TYR . 23.3 tp -48.69 -43.2 36.79 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.276 1.83 . . . . 2.1000000000000001 114.502 -163.684 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 58.6 mt -57.15 -64.51 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 120.191 1.36 . . . . 1.3 107.49 174.474 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 25.4 mtpt -62.09 -26.37 68.25 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.398 0.888 . . . . 4.6100000000000003 113.398 -174.803 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.73 -36.48 50.8 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.113 1.765 . . . . 5.7699999999999996 113.308 -179.534 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -122.17 -29.48 4.19 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.145 1.165 . . . . 6.04 114.145 -170.189 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -118.36 79.44 1.38 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.168 1.787 . . . . 3.9199999999999999 107.098 169.446 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 93.4 m -68.53 -47.81 65.96 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.36 -0.836 . . . . 3.9500000000000002 112.448 -155.722 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 6.7 mp 61.84 -34.86 0.11 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 129.755 3.222 . . . . 5.2999999999999998 118.604 170.519 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.68 -51.22 4.39 Favored Glycine 0 N--CA 1.473 1.164 0 C-N-CA 126.598 2.047 . . . . 2.6899999999999999 112.788 174.411 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -68.72 -4.36 15.58 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.497 1.119 . . . . 5.2000000000000002 112.217 168.322 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.55 63.84 0.42 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 124.542 2.115 . . . . 2.29 111.063 163.698 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -76.46 147.89 37.59 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 127.269 2.228 . . . . 3.7799999999999998 109.147 174.457 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.16 -37.1 66.56 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.674 1.361 . . . . 4.8300000000000001 114.674 -157.348 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 8.5 t -74.74 -24.17 58.68 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.884 1.439 . . . . 2.6800000000000002 114.884 174.389 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 4.8 m -63.55 -18.23 63.63 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 120.06 1.3 . . . . 2.2999999999999998 111.957 173.895 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 42.7 mm -67.62 -25.7 33.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 C-N-CA 124.805 1.242 . . . . 1.5800000000000001 111.834 174.299 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -70.75 -34.45 71.85 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.958 0.799 . . . . 5.0599999999999996 111.944 173.391 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.61 -32.95 47.73 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.203 1.001 . . . . 3.54 111.732 174.821 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.87 -44.38 93.25 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 118.414 -0.803 . . . . 2.48 111.211 167.453 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 14.0 mtp -57.64 -49.35 76.76 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.86 1.209 . . . . 1.8 110.71 171.453 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -60.87 -29.32 69.47 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.303 1.441 . . . . 3.4700000000000002 113.142 -178.607 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 33.2 t -76.09 -22.03 56.05 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 115.086 1.513 . . . . 3.5299999999999998 115.086 172.021 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mp -109.21 -45.91 3.66 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.736 1.614 . . . . 3.0600000000000001 114.775 -172.401 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -85.11 88.49 7.47 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.485 1.514 . . . . 1.6000000000000001 111.26 -163.587 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -62.82 -29.36 70.66 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.614 1.565 . . . . 5.1100000000000003 114.634 -173.431 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -85.04 -16.31 41.15 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 117.83 -1.081 . . . . 2.0499999999999998 112.711 169.059 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 20.6 m 49.64 66.1 1.22 Allowed 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 126.261 1.825 . . . . 3.9199999999999999 112.28 176.224 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -136.69 -102.12 0.2 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.377 0.671 . . . . 3.29 110.804 -148.851 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -145.19 -10.17 0.57 Allowed 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 115.592 1.701 . . . . 6.1500000000000004 115.592 167.17 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -137.87 146.12 43.0 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 125.357 1.463 . . . . 2.3900000000000001 112.961 175.541 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 2.6 mt -100.02 109.3 24.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 C-N-CA 127.89 2.476 . . . . 1.4399999999999999 107.284 173.321 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.07 160.2 30.02 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.752 1.621 . . . . 2.4900000000000002 111.181 168.334 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -56.46 -31.26 63.81 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 121.078 -1.014 . . . . 2.3999999999999999 112.999 -174.463 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.6 -11.06 43.74 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.304 1.841 . . . . 3.5899999999999999 112.81 -179.465 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -75.02 -57.18 4.06 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 108.468 -0.938 . . . . 1.6899999999999999 108.468 153.494 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -54.84 -24.88 25.15 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.653 2.381 . . . . 1.8500000000000001 115.663 -174.607 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 1.8 m -49.54 -31.08 9.61 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 120.754 -1.216 . . . . 2.4700000000000002 112.689 170.121 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 95.4 t -74.21 -25.46 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.159 0.583 . . . . 1.6499999999999999 111.959 -179.777 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -61.31 -56.98 14.29 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-N 119.199 0.908 . . . . 2.7599999999999998 111.037 171.039 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 76' ' ' LEU . . . . . 0.524 HD22 ' H ' ' B' ' 76' ' ' LEU . 2.7 mm? -56.75 -45.57 81.95 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.51 0.724 . . . . 3.04 110.772 179.242 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 76.4 m -53.19 -54.5 35.02 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.118 1.367 . . . . 1.1899999999999999 112.154 176.707 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 12.7 tmm? -65.73 -43.99 87.39 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.948 1.299 . . . . 3.2799999999999998 112.412 -176.293 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -55.27 -50.4 69.62 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.631 0.772 . . . . 2.23 110.978 170.149 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 9.6 t -61.71 -36.11 79.98 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.117 0.784 . . . . 2.6800000000000002 113.117 -179.254 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 94.0 mtp -67.79 -35.95 79.59 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.244 1.017 . . . . 2.46 113.004 173.926 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.91 -30.27 50.53 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 119.453 1.024 . . . . 1.1599999999999999 112.969 175.623 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -74.75 -18.39 60.5 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.668 -1.27 . . . . 2.9199999999999999 111.719 -177.537 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -55.9 -32.97 64.21 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.527 1.531 . . . . 2.5699999999999998 114.055 161.262 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -105.9 -28.94 10.3 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 127.408 2.283 . . . . 3.04 112.126 -167.752 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.67 -41.14 61.16 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.382 1.073 . . . . 3.1099999999999999 110.369 159.336 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -65.94 -24.23 66.77 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.288 1.835 . . . . 2.54 113.218 173.099 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 75.1 mt -90.05 -3.68 57.81 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.453 1.501 . . . . 2.9199999999999999 113.935 178.306 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 89' ' ' GLU . . . . . 0.454 ' CD ' ' HZ3' ' B' ' 92' ' ' LYS . 72.4 mm-40 -90.45 -4.72 56.8 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.085 0.954 . . . . 3.8900000000000001 112.685 162.014 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -119.02 -66.96 1.02 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.335 1.454 . . . . 3.0499999999999998 111.268 -174.798 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -81.75 47.83 1.13 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.401 1.481 . . . . 3.3300000000000001 111.372 169.544 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 92' ' ' LYS . . . . . 0.454 ' HZ3' ' CD ' ' B' ' 89' ' ' GLU . 22.2 tttp . . . . . 0 C--O 1.251 1.148 0 C-N-CA 129.748 3.219 . . . . 5.0199999999999996 115.839 -173.316 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 . . . . . 0 CA--C 1.534 0.355 0 N-CA-C 118.412 2.745 . . . . 7.0099999999999998 118.412 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 76.4 p -147.91 161.0 36.45 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 118.603 0.638 . . . . 2.04 112.146 -154.88 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -62.36 -23.86 75.4 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 121.933 1.755 . . . . 1.5600000000000001 111.836 165.384 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -69.87 -48.38 58.97 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.994 1.318 . . . . 2.5699999999999998 111.083 177.411 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -63.77 -44.01 94.69 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 122.522 1.153 . . . . 3.3900000000000001 110.611 177.363 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -66.04 -19.98 66.03 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.686 -1.259 . . . . 4.2300000000000004 112.282 175.105 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -81.94 -45.12 15.84 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.167 1.387 . . . . 1.29 112.379 171.54 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.4 pp -63.37 -30.14 71.32 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 121.999 2.182 . . . . 2.96 112.157 171.588 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 30.0 m -53.09 -56.75 13.8 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.223 1.009 . . . . 1.47 109.371 164.622 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.76 -34.72 73.35 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.926 1.291 . . . . 1.71 114.008 179.503 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -56.88 -44.46 82.28 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.335 1.054 . . . . 3.46 112.444 170.193 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.2 t -71.66 -32.03 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 CA-C-O 118.597 -0.716 . . . . 1.8999999999999999 112.178 173.235 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 54.3 m -57.34 -56.61 19.62 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 119.758 1.163 . . . . 0.93000000000000005 111.641 175.476 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -57.93 -43.12 86.12 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 123.344 0.657 . . . . 2.0699999999999998 110.068 173.537 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -64.5 -45.2 88.3 Favored 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 120.677 -0.409 . . . . 1.9099999999999999 111.99 -173.265 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.32 -45.59 92.56 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 120.379 -1.451 . . . . 2.1499999999999999 112.061 176.336 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.17 -41.36 67.15 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.948 0.721 . . . . 5.8600000000000003 112.948 -176.513 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -72.74 -43.4 62.98 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.083 0.856 . . . . 2.1899999999999999 112.99 173.096 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.2 m -72.45 -26.2 61.74 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 120.307 1.412 . . . . 2.8500000000000001 111.964 -179.407 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.02 -35.44 89.33 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 124.689 1.138 . . . . 2.04 113.164 173.891 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.3 ttt85 -45.55 -50.1 13.31 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 128.073 2.549 . . . . 5.1699999999999999 115.609 -168.775 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -138.6 161.95 35.83 Favored 'General case' 0 C--O 1.25 1.127 0 C-N-CA 126.167 1.787 . . . . 4.7199999999999998 111.465 -177.255 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.52 -87.81 0.27 Allowed Glycine 0 C--N 1.346 1.123 0 C-N-CA 127.234 2.349 . . . . 2.3500000000000001 109.62 179.678 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -146.36 -179.54 6.82 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 121.559 -0.965 . . . . 4.75 110.04 142.75 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.73 156.35 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.489 1.916 . . . . 6.4000000000000004 113.011 147.106 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.0 mt 78.85 -50.7 0.45 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 128.185 2.594 . . . . 3.0699999999999998 110.712 -169.857 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.6 p -86.18 136.6 33.13 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 113.243 0.831 . . . . 2.1200000000000001 113.243 -176.326 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 28.3 mt -90.7 107.4 19.15 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.56 -0.904 . . . . 1.54 108.56 149.394 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.0 t -71.01 161.22 31.52 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 120.646 -1.284 . . . . 1.8799999999999999 111.177 163.425 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 22.4 ttt180 -42.2 -35.34 0.93 Allowed 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.757 1.623 . . . . 3.48 114.209 179.819 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 mmmm -71.38 -55.74 7.35 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 116.071 1.878 . . . . 4.5599999999999996 116.071 173.507 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -49.9 -35.65 24.46 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.2 1.4 . . . . 2.0600000000000001 110.002 171.606 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.7 tp -81.57 -49.07 10.98 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.968 0.907 . . . . 1.8700000000000001 110.902 -174.814 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -55.34 -38.22 68.48 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.06 0.846 . . . . 6.3300000000000001 111.384 175.885 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -79.19 -8.61 59.14 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.83 1.419 . . . . 3.7599999999999998 114.83 -174.73 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 50.8 tp -92.27 -55.28 3.48 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.855 1.262 . . . . 2.8500000000000001 111.212 169.611 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 23.0 mt -57.86 -49.07 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 O-C-N 121.668 -0.645 . . . . 1.24 110.08 -174.133 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.09 -3.94 15.23 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 113.475 0.917 . . . . 4.3899999999999997 113.475 -178.008 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.6 mmtp -95.37 -45.82 6.97 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.948 1.299 . . . . 2.7000000000000002 110.88 167.942 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -64.82 -53.0 53.69 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.227 1.411 . . . . 5.2800000000000002 111.81 -177.131 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -82.47 41.5 0.71 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.029 1.332 . . . . 2.7799999999999998 112.245 -175.621 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 53.4 t -58.04 -33.52 69.09 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.17 1.388 . . . . 3.7799999999999998 112.646 177.916 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -71.42 -6.34 39.57 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.896 1.443 . . . . 4.5800000000000001 114.896 174.332 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -133.67 -8.96 2.09 Favored Glycine 0 N--CA 1.472 1.045 0 CA-C-O 118.195 -1.336 . . . . 3.7000000000000002 115.881 -178.173 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 52.32 41.38 30.47 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.157 1.783 . . . . 7.9100000000000001 113.509 -179.436 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.4 tpt -39.33 104.97 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.609 1.564 . . . . 2.3100000000000001 112.102 -173.509 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -73.53 158.79 34.22 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.393 0.516 . . . . 6.0199999999999996 112.393 -160.641 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.54 -47.02 73.68 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 119.761 1.164 . . . . 5.6299999999999999 111.822 175.447 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.8 t -65.34 -3.67 4.45 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 115.183 1.549 . . . . 2.7999999999999998 115.183 173.782 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -114.1 -18.46 11.67 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.833 1.253 . . . . 2.7599999999999998 113.086 170.317 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 24.8 mt -76.71 -31.15 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 125.908 1.683 . . . . 1.23 110.527 172.029 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -70.2 -41.22 73.96 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 118.127 -0.94 . . . . 2.8500000000000001 113.197 177.166 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -65.92 -44.59 84.7 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 120.385 1.448 . . . . 2.8700000000000001 110.348 168.316 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 49.1 tp -54.67 -48.45 72.35 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.109 -0.948 . . . . 1.96 110.403 179.847 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.6 ttt -55.9 -50.39 70.82 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.192 1.36 . . . . 1.5600000000000001 112.144 172.249 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.56 -18.56 30.72 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.549 1.54 . . . . 4.7400000000000002 113.322 175.345 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.5 m -101.17 -22.85 14.57 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 127.077 2.151 . . . . 2.3700000000000001 113.763 179.067 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.7 mp -72.9 -46.17 54.16 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.573 -1.33 . . . . 2.8700000000000001 110.79 162.328 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -78.48 63.13 3.25 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.826 2.05 . . . . 1.9399999999999999 112.577 -166.295 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -51.06 -39.62 56.41 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 125.804 1.642 . . . . 3.4300000000000002 113.962 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -82.02 -8.02 59.64 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.777 1.399 . . . . 2.6400000000000001 114.777 176.004 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.4 t 63.36 39.55 9.27 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.871 1.268 . . . . 2.3199999999999998 114.202 166.855 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 42.3 p-10 -109.45 1.96 20.23 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 127.946 2.499 . . . . 2.6000000000000001 112.976 -175.074 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 78.66 -7.35 1.8 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 128.157 2.583 . . . . 3.75 115.639 -178.385 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -116.0 141.94 47.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.049 1.34 . . . . 3.8500000000000001 109.895 -179.659 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 22.4 mm -100.22 103.82 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 O-C-N 120.514 -1.366 . . . . 1.1100000000000001 111.569 175.994 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.48 162.22 29.52 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 125.139 1.376 . . . . 2.3999999999999999 112.132 164.057 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.32 -40.72 74.86 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 120.544 -1.348 . . . . 2.0600000000000001 113.16 -174.818 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.63 -14.65 62.94 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 120.977 -1.077 . . . . 3.3700000000000001 112.744 174.855 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -84.88 -51.93 6.37 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.34 -0.85 . . . . 2.0699999999999998 110.789 168.682 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -52.97 -45.0 67.58 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 127.195 2.198 . . . . 2.1299999999999999 114.513 -171.571 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.0 t -54.09 -27.28 31.85 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.225 1.194 . . . . 1.9099999999999999 114.225 -171.214 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.3 m -68.24 -22.97 27.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 O-C-N 120.759 -1.213 . . . . 2.46 113.48 -179.556 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -60.54 -62.83 1.58 Allowed 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 123.704 0.802 . . . . 1.8700000000000001 110.542 171.712 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.408 ' H ' HD12 ' A' ' 76' ' ' LEU . 3.8 mp -60.91 -30.93 70.47 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.347 1.059 . . . . 2.3900000000000001 111.404 179.71 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.5 m -59.73 -58.93 6.42 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.958 0.903 . . . . 0.77000000000000002 111.318 172.167 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 13.6 ptp -65.32 -34.0 77.31 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 118.405 0.548 . . . . 1.6499999999999999 112.228 -178.493 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -54.18 46.42 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.489 1.116 . . . . 2.98 110.794 173.557 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 7.6 t -64.3 -33.76 76.57 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.024 0.53 . . . . 1.6399999999999999 112.08 179.741 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.8 mtp -61.46 -44.18 97.55 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 118.957 0.798 . . . . 2.5099999999999998 112.954 168.616 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.45 -40.84 89.65 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.176 0.898 . . . . 1.1299999999999999 111.293 178.66 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -64.27 -22.39 66.93 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 118.77 -0.633 . . . . 2.7000000000000002 112.705 175.098 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -67.44 -40.9 85.47 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 120.146 1.339 . . . . 1.9199999999999999 111.682 174.013 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -71.91 -40.54 68.76 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.976 0.911 . . . . 2.6899999999999999 110.463 178.806 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -52.89 -48.3 67.26 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.142 1.377 . . . . 2.96 111.871 170.068 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -58.37 -24.38 59.71 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.992 1.717 . . . . 2.7000000000000002 113.618 179.355 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.2 mp -72.27 -17.79 61.86 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.41 1.005 . . . . 2.54 113.37 171.998 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -112.58 6.26 18.31 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 126.889 2.076 . . . . 3.77 114.892 173.985 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 . . . . . 0 CA--C 1.546 0.813 0 O-C-N 120.262 -1.524 . . . . 4.4400000000000004 112.169 162.362 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 71.8 p . . . . . 0 N--CA 1.472 0.659 0 CA-C-O 119.659 -0.21 . . . . 1.9199999999999999 110.938 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.01 -13.07 35.85 Favored 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 122.43 2.086 . . . . 1.4199999999999999 112.757 167.053 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -82.01 -44.14 17.05 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.638 1.175 . . . . 2.73 112.986 -179.58 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -57.56 -40.88 79.92 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 122.343 1.068 . . . . 4.3200000000000003 110.045 168.981 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 49.9 mttm -76.79 -27.84 55.4 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 121.125 -0.985 . . . . 4.5599999999999996 112.259 179.599 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.81 -43.08 80.5 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.876 0.762 . . . . 0.90000000000000002 111.532 169.257 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 42.9 mt -58.22 -39.02 77.96 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.576 1.15 . . . . 1.52 111.12 169.557 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 71.1 m -65.19 -42.59 93.45 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.006 0.922 . . . . 1.48 112.131 171.977 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 63.2 m -58.48 -46.45 86.64 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 120.328 1.422 . . . . 1.3700000000000001 111.047 171.152 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 82.3 mtp -57.24 -49.37 76.25 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.531 1.532 . . . . 3.2000000000000002 111.756 173.754 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.73 -27.36 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.188 0.904 . . . . 1.8999999999999999 112.647 177.279 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 94.1 m -67.96 -54.75 16.21 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.127 1.371 . . . . 0.97999999999999998 110.458 174.012 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.2 p -59.28 -35.95 74.66 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.346 0.975 . . . . 1.97 110.702 173.538 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 16' ' ' PHE . . . . . 0.448 ' CE1' HD23 ' B' ' 29' ' ' LEU . 27.8 t80 -67.79 -45.72 74.01 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 118.729 -0.653 . . . . 2.1800000000000002 110.96 179.801 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -69.75 -46.78 65.1 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 120.432 1.469 . . . . 2.1600000000000001 111.345 176.42 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -58.69 -44.78 90.37 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.22 1.408 . . . . 5.8799999999999999 113.71 179.306 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -81.14 -19.9 42.48 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 120.641 -1.287 . . . . 2.3100000000000001 112.094 171.235 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 26.9 m -67.79 -22.33 65.19 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 121.112 1.778 . . . . 1.71 112.94 170.207 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.15 7.58 81.78 Favored Glycine 0 CA--C 1.53 1.02 0 C-N-CA 126.467 1.984 . . . . 1.77 114.73 176.216 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 5.0 mmm-85 -76.46 -14.22 60.06 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.477 1.638 . . . . 4.6900000000000004 113.868 178.897 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 171.28 -174.16 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 129.713 3.205 . . . . 3.2799999999999998 110.852 -176.572 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 62.72 -139.1 44.94 Favored Glycine 0 N--CA 1.472 1.096 0 O-C-N 120.731 -1.231 . . . . 1.8600000000000001 110.651 -179.624 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 8.1 t -82.28 158.89 23.3 Favored 'General case' 0 C--O 1.245 0.819 0 CA-C-N 118.054 0.927 . . . . 4.1799999999999997 110.418 157.012 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.6 51.23 1.44 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.89 1.676 . . . . 6.9199999999999999 111.421 172.476 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 63.3 tp -168.07 -35.05 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 126.878 2.071 . . . . 2.9199999999999999 110.678 -170.431 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 25.6 p -102.98 152.75 20.97 Favored 'General case' 0 C--O 1.248 1.001 0 C-N-CA 126.794 2.038 . . . . 1.6000000000000001 111.622 173.801 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.448 HD23 ' CE1' ' B' ' 16' ' ' PHE . 0.0 OUTLIER -122.4 78.48 1.51 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.919 1.287 . . . . 2.21 110.214 -163.807 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.463 ' HA ' ' HA ' ' B' ' 66' ' ' GLU . 1.0 OUTLIER -54.96 150.51 10.09 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.536 1.935 . . . . 2.1400000000000001 112.967 177.738 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 23.5 ttp85 -40.34 -55.23 2.26 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.547 0.943 . . . . 3.2400000000000002 113.547 178.144 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.22 -27.35 61.93 Favored 'General case' 0 CA--C 1.554 1.116 0 N-CA-C 117.15 2.278 . . . . 4.2300000000000004 117.15 177.655 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -76.6 -52.95 8.72 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.181 1.792 . . . . 1.76 108.022 175.284 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.07 -31.59 69.26 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.095 0.558 . . . . 3.2599999999999998 112.314 -173.192 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.58 -15.06 63.41 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.154 1.168 . . . . 5.6699999999999999 114.154 175.777 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.57 -61.95 1.59 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 118.22 -0.895 . . . . 4.0800000000000001 112.555 156.625 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 37' ' ' LEU . . . . . 0.417 HD23 ' C ' ' B' ' 37' ' ' LEU . 3.6 tt -45.18 -54.0 7.47 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.449 1.499 . . . . 2.0899999999999999 111.577 -174.115 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 11.8 mt -58.6 -68.14 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 119.075 0.852 . . . . 1.22 110.448 -173.742 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -12.57 42.94 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 113.546 0.943 . . . . 4.1799999999999997 113.546 -176.513 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.12 -53.77 6.1 Favored 'General case' 0 N--CA 1.444 -0.763 0 O-C-N 120.479 -1.388 . . . . 6.7000000000000002 111.3 165.84 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -75.8 -32.33 59.81 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 120.461 1.482 . . . . 3.73 112.104 -172.998 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -126.1 110.99 14.15 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.985 2.114 . . . . 2.4100000000000001 110.106 168.578 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 29.4 p -99.26 2.43 45.58 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 121.375 -0.828 . . . . 4.21 112.706 164.821 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 7.2 mp -77.01 155.3 32.67 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.081 0.953 . . . . 4.6200000000000001 112.263 -160.825 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.52 -73.8 1.13 Allowed Glycine 0 N--CA 1.469 0.875 0 C-N-CA 124.709 1.147 . . . . 5.4699999999999998 110.774 -175.073 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -154.71 7.37 0.29 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.164 1.386 . . . . 5.5700000000000003 113.458 165.289 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 5.7 tpt -50.07 117.65 2.46 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.287 1.435 . . . . 3.2799999999999998 114.075 -156.231 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 ttmp? -164.09 162.56 23.04 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.344 1.457 . . . . 3.9900000000000002 110.162 -161.45 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.77 3.51 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 116.653 2.094 . . . . 4.2400000000000002 116.653 170.5 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 2.6 p -73.75 -42.9 60.45 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 119.834 -1.791 . . . . 6.0 113.666 159.25 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 2.8 p -103.92 -16.28 15.4 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.299 1.839 . . . . 2.4399999999999999 113.572 -176.284 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 30.1 mt -71.81 -34.17 50.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 N-CA-C 114.621 1.341 . . . . 2.0 114.621 -176.588 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.09 -29.99 65.97 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 120.464 1.484 . . . . 2.8599999999999999 112.301 -174.204 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -71.24 -45.16 63.87 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.421 1.489 . . . . 2.4700000000000002 112.142 169.829 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 53.4 tp -56.87 -51.09 70.4 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 124.251 1.02 . . . . 2.2000000000000002 109.977 173.093 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 8.6 tpt -52.66 -48.74 66.26 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 127.095 2.158 . . . . 2.1899999999999999 111.861 175.868 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.39 -27.28 62.19 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.741 0.816 . . . . 3.8100000000000001 113.186 172.206 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 58' ' ' SER . . . . . 0.402 ' O ' ' HE3' ' B' ' 61' ' ' LYS . 9.3 t -87.8 -30.3 20.34 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.242 1.417 . . . . 2.1400000000000001 113.396 176.74 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 30.5 mt -67.94 -49.15 63.48 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 121.223 -0.923 . . . . 1.8700000000000001 110.605 171.555 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -81.51 81.05 7.74 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 122.895 1.331 . . . . 1.54 112.562 -173.523 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 61' ' ' LYS . . . . . 0.402 ' HE3' ' O ' ' B' ' 58' ' ' SER . 1.6 mptm? -61.36 -17.04 52.09 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 114.257 1.206 . . . . 3.1200000000000001 114.257 178.607 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -78.3 -33.27 49.46 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.097 0.862 . . . . 2.25 112.915 171.105 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 57.8 m 54.35 56.78 6.5 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.437 1.495 . . . . 2.3599999999999999 111.526 -159.662 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 9.3 p30 -101.21 -72.58 0.67 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.572 1.149 . . . . 2.3599999999999999 109.656 -172.042 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 167.62 -25.71 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.831 1 C-N-CA 133.386 4.674 . . . . 5.9800000000000004 113.854 -177.886 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 66' ' ' GLU . . . . . 0.463 ' HA ' ' HA ' ' B' ' 30' ' ' SER . 1.2 mt-10 -125.31 133.76 52.5 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 126.624 1.97 . . . . 2.5800000000000001 110.458 -171.091 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 34.1 mt -87.88 112.14 23.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 122.118 0.961 . . . . 1.3300000000000001 109.572 173.876 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.75 163.09 27.91 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.535 1.934 . . . . 2.5600000000000001 111.085 166.527 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -57.1 -37.76 72.4 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 120.866 -1.147 . . . . 2.3199999999999998 113.803 -176.871 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 5.0 mtmp? -77.9 -29.68 50.27 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 120.476 -1.39 . . . . 3.4100000000000001 112.343 177.257 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -60.86 -52.05 66.7 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-N 119.911 1.232 . . . . 1.8600000000000001 108.866 163.229 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -58.0 -29.36 65.22 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 119.61 -1.931 . . . . 2.1899999999999999 114.186 -179.436 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 32.7 p -58.27 -26.14 62.61 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.397 -1.439 . . . . 2.5800000000000001 113.802 171.851 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 47.3 t -64.74 -44.98 96.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.042 0.937 . . . . 1.8300000000000001 109.953 172.939 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -58.12 -54.88 41.94 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 119.103 -0.475 . . . . 1.6599999999999999 111.115 176.805 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 91.4 mt -52.99 -45.74 67.99 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.169 0.987 . . . . 2.04 111.791 -179.748 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 25.3 m -64.11 -51.1 65.58 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.107 0.563 . . . . 1.01 112.286 -179.206 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 67.9 mtm -62.69 -39.69 94.79 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 118.245 0.475 . . . . 2.0099999999999998 111.729 -179.367 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.38 -48.45 67.38 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.353 0.661 . . . . 2.6699999999999999 111.719 179.381 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 84.6 m -65.91 -28.47 68.96 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.079 0.77 . . . . 2.04 113.079 179.657 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 48.0 mtm -72.69 -31.46 65.04 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.034 1.124 . . . . 3.0099999999999998 114.034 169.205 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.67 -43.15 56.71 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.861 1.209 . . . . 0.96999999999999997 112.033 173.738 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.89 -15.64 23.02 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.531 1.308 . . . . 2.2599999999999998 114.531 172.877 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -66.12 -38.12 87.42 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.514 0.726 . . . . 2.54 112.099 172.228 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -90.09 -25.48 20.74 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.736 1.214 . . . . 3.5099999999999998 112.657 -179.12 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.97 -18.9 61.98 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 124.925 1.29 . . . . 3.6099999999999999 112.43 167.9 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -88.57 -16.49 32.44 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.387 1.875 . . . . 2.8399999999999999 112.801 168.903 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 87.7 mt -94.99 -32.15 13.29 Favored 'General case' 0 C--O 1.222 -0.395 0 CA-C-O 116.999 -1.477 . . . . 3.1600000000000001 112.792 -179.951 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -55.48 -25.31 36.19 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 120.297 1.408 . . . . 8.0899999999999999 114.022 168.158 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -81.38 -53.74 6.06 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 128.245 2.618 . . . . 3.3100000000000001 112.492 168.498 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -77.73 -16.9 58.12 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 116.701 2.112 . . . . 3.23 116.701 -170.444 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? . . . . . 0 N--CA 1.469 0.498 0 N-CA-C 119.818 3.266 . . . . 5.5499999999999998 119.818 -159.767 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.543 0.692 0 N-CA-C 106.15 -1.796 . . . . 3.9900000000000002 106.15 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 72.9 p -152.19 169.77 9.02 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 128.264 2.626 . . . . 1.8899999999999999 108.829 -168.921 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.89 -37.46 3.67 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 CA-C-N 120.73 1.296 . . . . 1.8300000000000001 111.372 167.612 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 26.4 mt -62.87 -49.68 73.9 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-O 117.729 -1.129 . . . . 3.23 112.792 -174.916 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -38.34 66.76 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.955 1.252 . . . . 4.4500000000000002 111.057 -178.839 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -73.86 -42.79 60.28 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 120.361 -1.462 . . . . 3.4399999999999999 113.431 171.475 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.566 ' HB1' ' HB2' ' B' ' 8' ' ' ALA . . . -75.13 -30.81 60.92 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 114.717 1.377 . . . . 2.3100000000000001 114.717 -174.782 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.3 mt -67.49 -35.57 79.41 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.908 1.683 . . . . 1.8899999999999999 110.066 166.958 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 56.9 m -67.96 -36.2 79.66 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 118.139 -0.934 . . . . 2.1699999999999999 111.038 170.893 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.9 m -56.61 -41.4 76.98 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 120.004 1.274 . . . . 1.78 111.3 167.38 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.5 tpt -63.34 -44.6 94.41 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.586 0.754 . . . . 4.4800000000000004 112.465 172.835 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 37.5 t -61.83 -33.65 58.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 O-C-N 120.478 -1.388 . . . . 2.23 112.229 173.958 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.9 m -71.24 -41.63 69.88 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.828 1.651 . . . . 1.3500000000000001 112.183 -177.804 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.0 p -69.0 -37.61 78.79 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 117.966 -1.016 . . . . 1.98 109.193 167.904 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -59.69 -57.16 14.12 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.462 0.574 . . . . 2.02 111.147 -173.538 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -59.57 -50.0 75.57 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-O 122.274 1.035 . . . . 2.8300000000000001 111.594 178.097 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -57.8 -34.14 69.31 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.923 -1.111 . . . . 3.5899999999999999 113.683 -178.695 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -97.0 -19.81 18.5 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.992 1.317 . . . . 2.1000000000000001 112.472 177.137 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.4 p -71.11 -29.51 65.37 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-N 121.624 2.011 . . . . 2.1400000000000001 111.952 171.081 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.24 -8.99 80.7 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 126.854 2.168 . . . . 1.8700000000000001 115.217 173.657 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.3 ttm-85 -66.18 -23.38 66.45 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 119.194 1.497 . . . . 4.5199999999999996 113.574 -177.948 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -166.72 158.78 13.32 Favored 'General case' 0 C--O 1.247 0.95 0 C-N-CA 124.404 1.082 . . . . 4.9800000000000004 112.468 -174.672 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.71 -134.25 52.42 Favored Glycine 0 C--N 1.339 0.743 0 C-N-CA 125.268 1.413 . . . . 2.5499999999999998 111.234 172.201 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.9 m -62.52 139.71 58.61 Favored 'General case' 0 C--O 1.246 0.918 0 O-C-N 121.824 -0.81 . . . . 3.77 110.697 165.364 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -89.51 -20.12 24.22 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 115.332 1.605 . . . . 6.21 115.332 -171.065 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.48 ' H ' HD23 ' A' ' 27' ' ' LEU . 2.5 pt? -81.27 -18.76 44.82 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.285 1.034 . . . . 5.2699999999999996 112.793 168.091 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.84 157.1 34.92 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 125.262 1.425 . . . . 1.6299999999999999 114.25 -169.553 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 88.3 mt -99.44 112.91 25.02 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.283 1.833 . . . . 1.6299999999999999 110.606 -177.085 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.35 168.55 16.52 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.983 1.313 . . . . 2.3799999999999999 112.526 170.611 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -51.46 -22.85 3.36 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 127.53 2.332 . . . . 4.0700000000000003 116.316 -175.442 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.68 -39.68 8.55 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 121.178 -0.951 . . . . 4.0199999999999996 112.96 173.972 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -48.29 -48.07 36.01 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.134 0.973 . . . . 1.6200000000000001 110.912 168.011 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.4 -48.38 67.53 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.91 1.284 . . . . 2.3599999999999999 112.444 178.306 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -51.96 -43.91 63.75 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.479 -1.388 . . . . 3.6899999999999999 112.643 174.407 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -68.18 -43.28 78.49 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.706 1.203 . . . . 3.2799999999999998 111.719 177.705 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.6 mt -53.43 -53.68 47.84 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.783 1.174 . . . . 2.7400000000000002 112.926 175.17 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.2 mt -55.15 -48.97 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.137 0.88 . . . . 0.85999999999999999 110.686 -178.481 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -64.94 -27.31 68.76 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 112.586 0.588 . . . . 3.8500000000000001 112.586 -176.738 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -87.62 -48.66 7.72 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.922 1.689 . . . . 2.7999999999999998 112.518 -179.068 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -73.34 -50.59 21.2 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.482 1.513 . . . . 4.4800000000000004 111.946 -175.26 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -95.59 61.73 2.31 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.498 1.519 . . . . 2.8500000000000001 109.313 -177.458 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.6 t -63.64 5.17 0.21 Allowed 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 126.05 1.74 . . . . 3.8300000000000001 115.552 -173.927 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.479 HD12 ' H ' ' A' ' 44' ' ' LEU . 5.0 mp -69.87 -24.23 63.39 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.163 1.785 . . . . 4.4500000000000002 111.968 166.926 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.17 -108.39 3.67 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 125.013 1.292 . . . . 4.7800000000000002 112.211 171.706 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 62.27 -75.65 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.843 2.057 . . . . 5.3700000000000001 112.17 -167.526 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.44 107.44 0.11 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 127.124 2.17 . . . . 2.0800000000000001 115.318 -159.095 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -67.48 151.31 47.59 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.12 0.968 . . . . 5.1500000000000004 109.811 168.752 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -60.69 -33.7 73.24 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 116.027 1.862 . . . . 3.73 116.027 -159.757 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.4 t -84.23 -16.72 42.24 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 114.145 1.165 . . . . 3.1499999999999999 114.145 171.941 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.4 t -76.2 -21.32 56.6 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.259 1.39 . . . . 2.5099999999999998 112.074 174.606 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 21.9 mm -55.92 -40.7 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 124.056 0.943 . . . . 1.54 110.994 163.546 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -69.67 -39.55 76.93 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 123.423 0.689 . . . . 3.3999999999999999 110.609 -172.88 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.98 -33.86 68.47 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.167 0.987 . . . . 2.7200000000000002 113.331 171.935 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.9 -56.55 20.59 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-N 118.831 0.741 . . . . 2.6000000000000001 109.828 171.017 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.6 ptm -71.95 -25.52 61.91 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.918 1.081 . . . . 1.8999999999999999 113.918 -176.804 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.5 ttmp? -64.6 -24.96 67.76 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.316 1.046 . . . . 4.2300000000000004 111.939 168.657 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.3 t -78.29 -25.35 46.61 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.035 1.124 . . . . 2.3999999999999999 114.035 168.3 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.5 mp -73.95 -53.85 9.19 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.174 0.99 . . . . 2.5899999999999999 113.324 178.597 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -75.45 81.92 2.51 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 122.355 1.074 . . . . 1.8200000000000001 112.295 -169.881 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.7 tmtp? -62.19 -7.46 4.18 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 115.118 1.525 . . . . 5.4699999999999998 115.118 -171.141 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.13 -26.69 13.86 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.838 1.655 . . . . 2.79 112.913 172.365 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.1 m 57.84 32.46 21.95 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.322 1.049 . . . . 3.04 112.902 -160.9 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 p30 -75.55 -6.42 50.21 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.779 0.832 . . . . 3.4900000000000002 111.876 166.433 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.35 -3.9 2.46 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 129.505 3.122 . . . . 4.0999999999999996 113.425 171.977 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -106.85 121.4 44.33 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 123.484 1.612 . . . . 2.8100000000000001 110.123 166.565 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 49.9 mt -81.29 103.6 8.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 123.013 1.387 . . . . 1.4199999999999999 108.721 178.517 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.79 151.01 30.56 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 112.844 -1.98 . . . . 4.0300000000000002 109.45 178.979 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.19 -38.14 70.56 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 120.611 -1.306 . . . . 2.6800000000000002 113.375 -177.474 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -59.18 -22.22 60.63 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.335 2.254 . . . . 4.3899999999999997 115.787 172.256 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -94.83 -47.45 6.45 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.248 1.419 . . . . 3.46 109.81 173.091 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -51.36 -26.14 7.2 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 127.432 2.293 . . . . 2.2799999999999998 115.845 -170.853 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 47.3 p -64.18 -18.7 64.73 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 120.155 -1.591 . . . . 1.9099999999999999 113.295 175.839 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.5 m -63.95 -24.22 35.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 119.54 1.064 . . . . 2.52 112.822 170.385 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -60.05 -57.23 13.74 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.633 1.173 . . . . 2.1200000000000001 111.423 173.538 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.6 mp -55.59 -41.07 72.86 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 125.827 1.651 . . . . 3.04 110.56 173.332 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 44.3 m -61.14 -50.9 71.31 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 117.172 -1.394 . . . . 0.71999999999999997 111.742 178.826 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 2.5 mpp? -52.42 -45.89 66.12 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 120.865 1.666 . . . . 2.1200000000000001 111.562 174.735 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 46.5 mt -69.69 -49.25 55.23 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.624 0.77 . . . . 1.27 111.444 -175.716 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 99.3 m -65.37 -30.21 71.01 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.614 0.968 . . . . 1.6799999999999999 113.614 176.654 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 69.3 mtp -70.17 -37.0 75.07 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 120.01 1.277 . . . . 1.73 111.203 171.874 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.64 -37.05 84.01 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.181 0.901 . . . . 0.85999999999999999 112.616 173.102 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.0 m-30 -68.25 -23.33 64.77 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.987 0.915 . . . . 2.3100000000000001 112.575 174.6 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -68.0 -48.5 65.58 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.438 0.695 . . . . 2.3300000000000001 111.52 174.571 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -62.49 -43.11 99.62 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.968 1.707 . . . . 2.6600000000000001 111.643 178.673 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.43 -45.52 65.99 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.303 1.441 . . . . 2.3900000000000001 111.964 174.174 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -66.79 -27.76 67.83 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.803 1.241 . . . . 2.8700000000000001 112.533 178.69 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 84.4 mt -78.01 -17.65 56.85 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.581 1.152 . . . . 1.9399999999999999 113.511 175.829 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -101.35 1.44 38.54 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 114.485 1.291 . . . . 2.8199999999999998 114.485 173.725 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 21.1 t70 . . . . . 0 CA--C 1.541 0.617 0 C-N-CA 125.06 1.344 . . . . 4.1200000000000001 111.729 171.169 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.4 p . . . . . 0 C--O 1.238 0.486 0 N-CA-C 109.351 -0.611 . . . . 2.04 109.351 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -71.65 -13.71 29.95 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.877 2.385 . . . . 1.8700000000000001 111.886 163.88 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 8.8 tt -76.34 -42.95 43.15 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 123.916 0.887 . . . . 2.9500000000000002 111.322 177.501 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -60.52 -30.29 69.64 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 118.617 0.644 . . . . 4.1500000000000004 111.28 177.032 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.48 -25.75 38.66 Favored 'General case' 0 CA--C 1.548 0.869 0 O-C-N 120.786 -1.196 . . . . 3.9199999999999999 114.166 169.334 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 8' ' ' ALA . . . . . 0.566 ' HB2' ' HB1' ' A' ' 8' ' ' ALA . . . -62.19 -42.58 99.42 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.012 -1.055 . . . . 1.3899999999999999 111.301 171.255 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 41.1 mt -69.71 -36.63 76.07 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.638 1.175 . . . . 1.55 111.441 -175.02 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.79 -47.01 67.21 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.821 0.848 . . . . 1.5600000000000001 112.002 168.268 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.3 t -65.44 -25.06 67.35 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 120.093 1.315 . . . . 2.6499999999999999 111.966 -178.571 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 85.9 mtp -59.2 -60.11 4.38 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.143 0.977 . . . . 2.8300000000000001 110.869 169.479 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 28.1 m -61.78 -22.95 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 120.378 -1.451 . . . . 2.1600000000000001 113.112 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 90.5 m -75.48 -40.15 57.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 126.269 1.828 . . . . 0.79000000000000004 113.185 178.7 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 10.7 p -75.33 -35.29 61.22 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.112 1.323 . . . . 1.72 109.923 169.25 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -54.28 -61.38 2.34 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.85 0.86 . . . . 2.0800000000000001 109.91 -179.273 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 42.4 m170 -71.15 -24.86 62.34 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 115.005 1.483 . . . . 2.6600000000000001 115.005 178.672 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -70.19 -33.92 72.32 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 122.026 2.194 . . . . 4.0999999999999996 113.657 174.199 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -92.0 -36.18 13.55 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.155 0.889 . . . . 2.0899999999999999 112.479 175.765 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t -64.83 -29.75 70.72 Favored 'General case' 0 C--O 1.247 0.963 0 N-CA-C 113.844 1.053 . . . . 1.98 113.844 171.355 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.29 -12.24 84.77 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 126.583 2.04 . . . . 1.6699999999999999 114.675 178.893 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -76.88 -44.6 31.35 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 118.783 1.292 . . . . 3.4399999999999999 112.361 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -123.65 144.57 49.55 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 118.768 0.713 . . . . 3.2000000000000002 111.888 -171.35 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.77 -129.69 30.66 Favored Glycine 0 C--N 1.341 0.845 0 C-N-CA 125.628 1.585 . . . . 2.2799999999999998 112.791 175.528 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 12.0 t -57.62 132.47 53.32 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.609 0.719 . . . . 3.6600000000000001 110.578 166.218 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -80.89 -12.75 59.36 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.575 1.15 . . . . 7.29 113.938 177.729 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 57.5 tp -84.17 -39.98 18.72 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.62 1.168 . . . . 2.7599999999999998 111.116 171.011 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 3.1 p -108.0 148.77 29.26 Favored 'General case' 0 C--O 1.253 1.256 0 C-N-CA 125.495 1.518 . . . . 1.5900000000000001 113.421 -173.208 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 2.4 pp -122.56 112.04 17.52 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 113.104 -1.862 . . . . 1.96 111.48 -174.94 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 79.9 p -97.12 -170.02 1.96 Allowed 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 122.144 0.973 . . . . 1.76 113.392 -178.989 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 25.6 ttt-85 -56.08 -8.12 0.43 Allowed 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 117.948 2.573 . . . . 3.5099999999999998 117.948 -172.349 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.89 -50.73 3.75 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 113.734 1.012 . . . . 4.2599999999999998 113.734 164.295 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -54.69 -34.06 61.77 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.771 1.228 . . . . 1.9199999999999999 112.029 178.015 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 54.6 tp -70.23 -49.4 50.43 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.28 1.032 . . . . 1.9399999999999999 112.335 174.548 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -78.83 -24.4 44.46 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.373 -1.454 . . . . 3.8599999999999999 114.65 -174.021 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -46.26 -71.68 0.07 Allowed 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 117.802 -1.094 . . . . 3.23 110.503 149.903 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.18 -57.75 6.18 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.612 1.165 . . . . 1.8300000000000001 113.215 -175.726 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 22.8 mt -53.98 -44.98 63.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 119.269 0.94 . . . . 0.97999999999999998 110.13 -176.558 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 22.9 mmmt -74.56 -5.61 43.82 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.559 1.318 . . . . 5.3399999999999999 114.559 -179.847 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 8.7 mmtp -102.78 -22.11 13.95 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 120.749 1.613 . . . . 3.9500000000000002 113.699 168.351 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -91.02 -87.9 0.19 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.315 1.046 . . . . 3.8700000000000001 108.491 170.875 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -77.37 37.77 0.22 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.099 1.76 . . . . 2.23 112.842 -175.936 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 39.8 t -51.05 -27.64 8.51 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.645 1.978 . . . . 4.0800000000000001 113.488 178.604 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.584 ' H ' HD12 ' B' ' 44' ' ' LEU . 3.3 mp -60.16 -37.06 79.01 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.369 2.268 . . . . 4.2800000000000002 113.641 178.92 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -81.83 40.53 2.65 Favored Glycine 0 N--CA 1.473 1.131 0 C-N-CA 124.798 1.19 . . . . 4.0599999999999996 113.983 -169.107 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 46' ' ' GLU . . . . . 0.427 ' HG3' ' H ' ' B' ' 47' ' ' MET 0.266 6.2 pt-20 46.08 -68.67 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 129.521 3.128 . . . . 4.96 114.928 -165.288 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' B' B ' 47' ' ' MET . . . . . 0.427 ' H ' ' HG3' ' B' ' 46' ' ' GLU . 6.9 mmt 59.16 60.82 2.26 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 124.672 2.177 . . . . 3.0299999999999998 113.235 173.074 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.3 mppt? -65.51 159.46 24.44 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 111.604 -2.544 . . . . 3.6699999999999999 111.489 168.256 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.56 -41.85 6.83 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 128.275 2.63 . . . . 5.8600000000000003 115.66 -170.202 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 6.0 t -91.35 -32.97 15.47 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.456 1.102 . . . . 3.6600000000000001 113.151 177.405 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 35.9 t -62.74 -33.83 75.94 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 120.204 -1.56 . . . . 1.8600000000000001 111.398 174.074 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 3.7 mm -59.97 -38.42 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 126.974 2.11 . . . . 1.5700000000000001 112.878 166.815 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.85 -31.02 24.02 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 124.791 1.236 . . . . 2.7000000000000002 111.472 -168.902 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -81.67 -30.97 32.46 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.201 1.401 . . . . 4.6699999999999999 111.645 170.468 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 16.0 tp -57.74 -45.61 85.61 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.525 -0.75 . . . . 2.0899999999999999 110.061 162.355 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 3.2 ttt -58.68 -41.91 87.3 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-O 118.069 -0.967 . . . . 1.6200000000000001 113.279 173.66 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 31.0 mttp -61.02 -29.48 69.74 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 120.358 1.435 . . . . 4.8499999999999996 112.134 176.455 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 2.2 p -79.21 -37.34 38.42 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.258 0.836 . . . . 2.8700000000000001 113.258 173.643 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 59' ' ' LEU . . . . . 0.461 HD11 ' HB2' ' B' ' 75' ' ' PHE . 0.4 OUTLIER -67.85 -53.15 29.01 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 125.828 1.651 . . . . 2.5 110.603 179.733 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -76.85 68.08 3.0 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 123.671 1.7 . . . . 1.6299999999999999 111.19 -179.317 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -53.0 -26.51 15.6 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.905 2.482 . . . . 3.75 114.03 178.827 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -73.5 -34.39 65.27 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 118.199 -0.905 . . . . 2.8199999999999998 112.873 171.744 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 65.8 m 53.54 65.49 1.5 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.609 1.164 . . . . 3.25 111.388 -157.841 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -110.34 -74.2 0.66 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.78 1.232 . . . . 2.5800000000000001 109.893 -175.979 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 173.58 -25.23 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 131.362 3.865 . . . . 6.4800000000000004 112.765 -178.096 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -132.28 142.6 49.44 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 127.131 2.172 . . . . 3.5099999999999998 111.443 -169.342 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 46.5 mm -83.23 110.29 17.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 125.15 1.38 . . . . 1.23 109.383 172.937 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -74.45 163.18 28.08 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.86 1.664 . . . . 3.0800000000000001 110.557 161.552 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.62 -36.31 78.31 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 120.16 -1.588 . . . . 2.8100000000000001 112.627 178.446 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -71.89 -15.78 62.12 Favored 'General case' 0 CA--C 1.556 1.194 0 O-C-N 120.631 -1.293 . . . . 6.3399999999999999 111.876 177.433 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -81.14 -58.8 2.9 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.293 1.437 . . . . 1.8700000000000001 108.898 164.172 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -45.93 -45.3 15.37 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.344 2.257 . . . . 1.98 114.032 -175.532 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 56.3 m -53.76 -27.52 29.22 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.291 0.849 . . . . 2.27 113.291 178.477 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 87.5 t -62.16 -36.53 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 119.995 1.271 . . . . 1.6000000000000001 111.211 178.959 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 75' ' ' PHE . . . . . 0.461 ' HB2' HD11 ' B' ' 59' ' ' LEU . 13.9 t80 -51.45 -62.08 1.84 Allowed 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.446 0.698 . . . . 1.75 111.062 174.135 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 77.9 mt -72.61 -22.72 60.92 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.993 0.917 . . . . 2.2000000000000002 112.328 -175.483 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.7 m -60.62 -56.16 24.69 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.631 1.173 . . . . 0.91000000000000003 110.197 169.378 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 58.1 mtm -55.58 -42.32 74.61 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 118.299 0.5 . . . . 1.5 112.099 -179.507 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 31.1 mt -71.18 -40.01 71.49 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.688 0.795 . . . . 1.4099999999999999 112.366 -177.145 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 14.7 t -64.42 -34.12 77.44 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.88 0.696 . . . . 2.2599999999999998 112.88 177.458 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 2.9 mtm -70.96 -36.59 72.63 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.596 -0.69 . . . . 3.6299999999999999 112.012 170.161 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.68 -34.66 78.36 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.76 1.164 . . . . 1.03 112.755 175.383 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -68.43 -35.6 77.84 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 119.182 0.901 . . . . 2.4500000000000002 112.343 171.922 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -64.93 -41.58 95.4 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.179 0.992 . . . . 1.8300000000000001 112.633 173.95 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -72.47 -29.78 63.96 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.043 0.937 . . . . 3.5600000000000001 111.347 179.054 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -58.75 -52.16 66.91 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.201 1.0 . . . . 2.4500000000000002 111.094 167.731 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -58.24 -32.62 68.51 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.161 1.385 . . . . 2.7200000000000002 112.13 -179.869 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 42.4 mt -72.34 -16.24 61.87 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.468 1.285 . . . . 1.8400000000000001 114.468 175.972 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 89' ' ' GLU . . . . . 0.536 ' CD ' ' HZ3' ' B' ' 92' ' ' LYS . 72.8 mm-40 -97.95 -18.23 18.76 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.743 1.217 . . . . 4.5 113.839 172.915 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -101.17 -40.79 7.01 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.21 1.804 . . . . 2.9300000000000002 113.268 -169.282 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -89.34 24.23 2.28 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 124.598 1.159 . . . . 2.8500000000000001 112.989 177.65 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 92' ' ' LYS . . . . . 0.536 ' HZ3' ' CD ' ' B' ' 89' ' ' GLU . 38.4 mttp . . . . . 0 C--O 1.246 0.916 0 C-N-CA 126.828 2.051 . . . . 4.7000000000000002 115.14 174.496 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 . . . . . 0 CA--C 1.535 0.388 0 N-CA-C 109.215 -0.661 . . . . 4.3899999999999997 109.215 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.4 p -136.05 153.24 76.71 Favored Pre-proline 0 N--CA 1.468 0.461 0 C-N-CA 124.814 1.246 . . . . 1.8200000000000001 108.145 169.912 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.18 -17.75 59.45 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.221 1.947 . . . . 1.3700000000000001 112.486 176.333 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 17.1 tp -85.74 -44.64 12.35 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 118.044 -0.979 . . . . 3.02 112.524 -179.09 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -58.2 -49.47 76.95 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.84 1.2 . . . . 4.0499999999999998 109.48 165.615 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -29.9 67.19 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.473 -0.767 . . . . 4.46 112.213 178.767 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.8 -51.2 58.5 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 117.449 -1.262 . . . . 1.05 112.112 172.369 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.7 mt -55.85 -48.3 75.76 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 120.208 1.367 . . . . 1.54 111.01 174.94 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 36.9 m -52.81 -49.93 64.67 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 125.175 1.39 . . . . 1.6399999999999999 110.405 173.292 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 86.4 m -61.38 -45.8 92.85 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 120.077 1.308 . . . . 1.7 112.494 177.858 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 79.0 mtp -54.24 -48.45 71.1 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.427 1.091 . . . . 3.3700000000000001 111.711 175.885 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 78.0 t -78.53 -33.81 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.484 0.714 . . . . 2.9500000000000002 112.059 -176.405 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.1 m -56.37 -55.84 28.53 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.458 1.103 . . . . 1.28 110.322 170.28 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.8 t -67.84 -33.35 74.6 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 117.376 -1.297 . . . . 2.4199999999999999 110.15 -172.822 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -55.17 -48.88 73.15 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.702 0.683 . . . . 1.8100000000000001 111.504 172.962 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 23.1 m170 -64.68 -34.95 79.52 Favored 'General case' 0 CA--C 1.549 0.925 0 O-C-N 120.863 -1.148 . . . . 3.6699999999999999 112.736 178.291 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.4 tmtm? -61.12 -25.22 66.83 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.692 1.197 . . . . 5.8200000000000003 113.503 173.468 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.408 ' CE2' HD23 ' A' ' 37' ' ' LEU . 69.3 m-85 -88.27 -30.51 19.6 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 120.677 -1.264 . . . . 3.1099999999999999 112.084 168.924 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.5 p -60.26 -19.5 55.03 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 117.425 2.38 . . . . 3.1299999999999999 117.425 -172.092 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.61 -7.67 53.33 Favored Glycine 0 CA--C 1.537 1.412 0 CA-C-O 118.394 -1.226 . . . . 1.75 115.721 -178.893 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 88.5 mtt-85 -77.54 53.07 1.03 Allowed 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 120.278 2.039 . . . . 5.3899999999999997 112.785 176.197 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 121.2 175.33 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 131.221 3.808 . . . . 4.1100000000000003 108.945 -176.031 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 9.68 113.18 0.0 OUTLIER Glycine 0 N--CA 1.481 1.66 0 C-N-CA 128.615 3.007 . . . . 2.6699999999999999 117.964 178.187 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.3 m 69.86 155.51 0.13 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.59 1.156 . . . . 2.6699999999999999 113.69 166.153 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -101.05 52.26 0.85 Allowed 'General case' 0 N--CA 1.483 1.194 0 O-C-N 120.541 -1.35 . . . . 5.5599999999999996 111.136 171.883 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 tt -161.03 -58.3 0.05 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.345 1.058 . . . . 3.2599999999999998 112.338 -172.515 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.9 p -84.64 156.07 21.7 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 127.453 2.301 . . . . 1.4399999999999999 113.284 -173.883 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 18.6 mt -92.07 94.77 9.41 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 114.704 -1.134 . . . . 1.6699999999999999 109.303 161.05 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.0 m -74.37 133.55 42.49 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 125.231 1.413 . . . . 3.7999999999999998 109.304 170.486 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -0.12 -70.34 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 127.687 2.395 . . . . 4.3899999999999997 117.107 -173.476 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.56 -36.68 83.43 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 119.481 -2.012 . . . . 4.0499999999999998 114.539 -175.583 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -57.74 -41.63 82.23 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.846 1.659 . . . . 2.77 110.563 175.518 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -66.05 -40.67 91.15 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.755 1.222 . . . . 2.3599999999999999 110.711 178.944 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.1 mtpt -65.3 -41.55 93.99 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 120.712 -1.242 . . . . 3.3100000000000001 113.154 175.327 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -56.23 -51.46 68.01 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-O 117.995 -1.002 . . . . 5.0800000000000001 112.543 170.075 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.408 HD23 ' CE2' ' A' ' 19' ' ' TYR . 1.7 tm? -52.61 -57.64 9.36 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.078 0.854 . . . . 2.9700000000000002 111.154 -178.506 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 46.0 mt -54.43 -46.35 70.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 118.367 0.531 . . . . 0.79000000000000004 110.784 -178.807 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -70.08 -9.6 55.96 Favored 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 113.767 1.025 . . . . 4.5999999999999996 113.767 -176.624 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.38 -13.34 9.79 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.527 1.931 . . . . 4.4100000000000001 113.15 -178.089 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -71.45 -51.91 21.32 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.801 1.641 . . . . 4.5599999999999996 108.776 158.062 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -115.81 124.18 50.08 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.471 2.309 . . . . 2.75 108.439 179.779 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 62.0 m -107.27 -8.86 16.24 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.767 1.025 . . . . 3.8399999999999999 113.767 -178.68 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -60.99 154.77 21.67 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 119.559 1.072 . . . . 3.96 113.409 172.172 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -72.85 11.88 4.2 Favored Glycine 0 CA--C 1.537 1.423 0 N-CA-C 116.281 1.273 . . . . 3.9399999999999999 116.281 -169.315 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -85.45 -27.03 25.98 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.964 2.105 . . . . 5.6900000000000004 112.08 178.366 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.69 86.92 7.34 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 123.2 1.476 . . . . 2.6299999999999999 112.151 -178.518 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 72.7 mttt -132.14 170.63 14.72 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 127.662 2.385 . . . . 4.9800000000000004 111.245 -177.552 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.96 -46.8 71.71 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.293 -0.88 . . . . 4.2000000000000002 113.039 -164.81 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.8 m -63.04 -25.49 68.4 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.366 1.617 . . . . 2.77 115.366 176.403 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.6 p -94.56 6.78 47.8 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.513 1.125 . . . . 2.8900000000000001 112.735 171.554 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 28.2 mt -125.32 -35.48 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.885 1.274 . . . . 1.3300000000000001 113.448 -173.546 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -82.55 -29.47 30.31 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.478 1.035 . . . . 3.9700000000000002 112.244 179.27 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -66.62 -45.09 80.23 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 118.513 0.597 . . . . 2.46 110.052 158.683 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.5 tp -59.75 -39.38 84.57 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 118.552 -0.737 . . . . 1.79 110.636 -177.806 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.1 tpt -51.75 -59.5 4.23 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 119.241 0.928 . . . . 2.1499999999999999 109.996 165.853 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.19 -19.16 19.04 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 125.808 1.643 . . . . 3.96 115.008 176.367 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.8 m -98.98 -29.42 12.93 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.723 2.009 . . . . 3.1600000000000001 113.515 -178.006 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 97.5 mt -83.27 -42.81 16.76 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.494 1.518 . . . . 1.8899999999999999 111.814 170.873 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -73.76 81.28 1.59 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.418 2.287 . . . . 2.0099999999999998 111.663 -175.694 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -51.7 -32.45 30.06 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 115.247 1.573 . . . . 3.0600000000000001 115.247 -173.014 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -81.88 -11.96 58.67 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.973 1.101 . . . . 1.9399999999999999 113.973 178.793 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.8 t 55.4 45.53 25.16 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.558 1.143 . . . . 2.4399999999999999 111.72 -169.387 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -102.33 -131.89 0.27 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.575 1.95 . . . . 2.96 107.796 178.876 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -142.47 1.06 1.34 Allowed 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 120.337 1.426 . . . . 3.7599999999999998 114.741 164.326 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -103.07 134.17 46.95 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 126.485 1.914 . . . . 2.3500000000000001 109.324 173.548 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.7 mm -96.47 114.06 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 126.581 1.952 . . . . 1.4299999999999999 109.914 171.965 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -88.77 157.2 18.57 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.879 1.271 . . . . 2.6899999999999999 108.759 163.401 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -49.85 -42.17 46.82 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.326 -1.484 . . . . 2.3100000000000001 114.44 -177.394 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.457 ' H ' ' HD2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -69.85 -11.43 60.85 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 114.524 1.305 . . . . 3.1800000000000002 114.524 176.791 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -84.84 -56.06 3.77 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 124.929 1.292 . . . . 1.8 108.004 162.157 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -50.02 -45.14 51.71 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.192 1.797 . . . . 2.3100000000000001 115.771 -176.209 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.9 m -65.03 -8.61 16.84 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 120.793 -1.192 . . . . 2.0099999999999998 113.468 -177.313 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 99.7 t -62.24 -37.02 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 119.585 1.084 . . . . 2.2200000000000002 110.939 167.32 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -65.66 -52.35 52.35 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.18 0.992 . . . . 2.1299999999999999 110.036 178.083 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -55.67 -44.51 77.33 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.627 1.171 . . . . 2.2799999999999998 110.783 176.844 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.3 m -58.53 -52.32 66.15 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.764 0.826 . . . . 0.87 111.855 173.831 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 73.3 mtm -61.92 -35.58 78.82 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.229 0.922 . . . . 1.45 112.404 -179.476 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.75 -50.5 42.74 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 123.857 0.863 . . . . 2.98 111.623 175.715 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 28.1 m -60.66 -33.79 73.33 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 118.42 -0.8 . . . . 1.3799999999999999 112.737 174.428 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 62.6 mtp -70.58 -37.36 73.94 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.008 0.822 . . . . 2.1800000000000002 111.795 172.554 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.51 -41.63 92.97 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 119.571 1.078 . . . . 0.85999999999999999 111.047 173.5 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -70.85 -32.7 69.8 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.702 1.137 . . . . 2.3900000000000001 113.614 175.406 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -58.41 -52.28 66.28 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.407 1.083 . . . . 3.0600000000000001 110.718 168.189 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -67.95 -41.59 82.25 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.558 1.143 . . . . 4.1600000000000001 112.643 -177.262 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.63 -48.93 79.73 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.909 1.684 . . . . 2.6400000000000001 110.576 173.055 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -58.59 -36.96 74.82 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 123.974 0.91 . . . . 3.4199999999999999 111.991 -179.89 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 54.5 mt -72.87 -15.89 61.59 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.37 1.068 . . . . 2.7200000000000002 113.264 177.365 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -106.41 -7.85 17.44 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.433 1.493 . . . . 3.7599999999999998 114.505 175.963 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 11.2 t70 . . . . . 0 N--CA 1.47 0.573 0 C-N-CA 125.412 1.485 . . . . 3.48 112.375 -175.114 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 44.3 p . . . . . 0 N--CA 1.468 0.461 0 CA-C-O 119.276 -0.392 . . . . 2.25 111.279 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -62.06 -21.21 72.0 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 121.887 1.725 . . . . 1.3899999999999999 111.696 171.122 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -85.96 -39.54 16.8 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-O 116.683 -1.627 . . . . 2.8199999999999998 113.837 178.101 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -57.69 -37.9 74.25 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 121.925 2.148 . . . . 5.1799999999999997 110.665 166.663 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -72.95 -26.71 61.47 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.087 -1.008 . . . . 4.7999999999999998 112.718 178.14 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.05 -44.53 38.67 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.218 0.607 . . . . 1.0600000000000001 112.004 171.454 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 58.2 mt -57.13 -45.61 83.35 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.987 1.315 . . . . 1.79 110.936 175.843 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 20.6 p -68.16 -43.57 77.94 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 116.875 -1.536 . . . . 2.2400000000000002 112.501 175.385 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 52.7 m -55.55 -43.18 75.61 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 120.567 1.531 . . . . 1.54 111.028 172.312 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -51.88 66.35 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.121 0.968 . . . . 4.0499999999999998 110.019 178.815 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 75.7 t -64.26 -31.78 54.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 O-C-N 121.158 -0.964 . . . . 1.8999999999999999 112.907 176.436 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 81.2 m -60.72 -57.89 10.76 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.543 1.137 . . . . 1.1399999999999999 109.841 176.135 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.44 -28.34 61.91 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 123.918 0.761 . . . . 3.1499999999999999 110.006 -173.598 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -55.85 -53.87 51.46 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-O 119.129 -0.462 . . . . 1.9199999999999999 110.571 166.573 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 49.0 m80 -70.28 -33.62 71.79 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 120.18 1.355 . . . . 2.6600000000000001 113.076 -178.609 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -64.26 -27.52 69.1 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.042 1.127 . . . . 4.9000000000000004 114.042 174.483 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -100.23 -34.55 9.97 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.993 1.317 . . . . 2.3199999999999998 112.995 177.8 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 7.4 t -82.03 -33.19 30.1 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 126.003 1.721 . . . . 2.0899999999999999 113.331 -178.69 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.54 -11.17 83.47 Favored Glycine 0 CA--C 1.525 0.68 0 O-C-N 120.949 -1.095 . . . . 1.6100000000000001 112.514 170.046 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -57.52 -41.14 80.28 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.671 1.236 . . . . 4.6100000000000003 112.402 -167.791 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -139.22 152.88 47.7 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 126.606 1.962 . . . . 4.9699999999999998 111.676 179.529 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 60.75 2.2 2.35 Favored Glycine 0 CA--C 1.535 1.324 0 O-C-N 121.112 -0.993 . . . . 2.1800000000000002 113.509 -165.302 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 6.0 t 59.47 -154.54 0.37 Allowed 'General case' 0 C--O 1.254 1.315 0 C-N-CA 126.022 1.729 . . . . 6.5199999999999996 111.477 -159.398 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 72.4 mttt 85.07 174.79 0.06 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 129.975 3.31 . . . . 10.65 113.738 156.16 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -76.71 19.33 0.28 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.68 0.792 . . . . 2.8799999999999999 112.721 158.0 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 69.7 p -121.06 132.83 55.12 Favored 'General case' 0 C--O 1.251 1.168 0 CA-C-O 122.978 1.371 . . . . 1.3100000000000001 113.588 -177.096 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -111.42 111.15 21.98 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 112.537 -2.12 . . . . 2.1600000000000001 110.913 177.13 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -88.29 170.02 11.34 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 121.517 0.675 . . . . 2.6699999999999999 111.789 166.364 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 -43.93 -29.59 0.59 Allowed 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 118.928 2.936 . . . . 3.2000000000000002 118.928 -162.803 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.92 -36.47 23.29 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.389 1.255 . . . . 5.2000000000000002 114.389 173.0 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -63.58 -49.58 72.81 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 106.845 -1.539 . . . . 2.1200000000000001 106.845 171.609 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 57.9 tp -56.13 -47.56 77.92 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.644 0.778 . . . . 2.5699999999999998 112.808 174.18 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -58.33 -44.4 88.65 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.394 0.997 . . . . 2.98 111.865 -176.245 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -79.79 -17.66 52.83 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.215 1.561 . . . . 4.1900000000000004 115.215 -179.65 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 2.3 tt -72.32 -54.99 7.9 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.983 1.265 . . . . 1.8799999999999999 110.695 165.795 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 33.4 mt -53.24 -44.57 53.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 CA-C-N 119.42 1.009 . . . . 1.03 110.688 -173.565 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -63.13 -13.93 42.58 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.044 1.127 . . . . 4.1399999999999997 114.044 -177.091 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -95.06 -18.67 20.81 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.471 1.908 . . . . 3.1499999999999999 112.607 176.159 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -96.02 -56.62 2.59 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.828 1.651 . . . . 5.8700000000000001 109.894 178.189 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -99.19 71.65 1.82 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.122 1.369 . . . . 2.7400000000000002 109.574 -179.237 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 14.2 p -73.33 -2.42 22.03 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.014 0.926 . . . . 4.6200000000000001 113.285 167.245 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.419 HD23 ' H ' ' B' ' 44' ' ' LEU . 2.2 pt? -138.39 162.57 34.08 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.854 2.461 . . . . 4.7800000000000002 110.371 -178.88 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.13 -129.83 10.03 Favored Glycine 0 N--CA 1.468 0.83 0 N-CA-C 108.884 -1.687 . . . . 5.3799999999999999 108.884 -165.43 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -148.62 64.73 1.06 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 122.761 1.267 . . . . 5.7000000000000002 111.805 168.139 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.15 66.78 3.01 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 123.871 1.795 . . . . 2.2200000000000002 112.019 176.303 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -63.31 143.92 57.39 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.106 -1.406 . . . . 4.25 109.614 165.199 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -57.78 -24.92 59.53 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.643 1.349 . . . . 4.4299999999999997 114.643 -174.342 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 8.6 t -78.45 -27.74 46.46 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 120.732 -1.23 . . . . 2.6899999999999999 113.71 172.332 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 3.6 m -65.87 -17.01 64.36 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.247 0.931 . . . . 2.6400000000000001 111.848 175.307 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 39.9 mm -64.53 -38.96 83.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 125.34 1.456 . . . . 1.6100000000000001 112.031 177.475 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.28 -30.07 65.83 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.509 1.123 . . . . 3.1600000000000001 112.311 -177.1 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -83.71 -40.67 18.58 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.776 0.83 . . . . 2.5899999999999999 112.27 172.793 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.35 -35.32 77.12 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.343 -0.848 . . . . 2.7200000000000002 110.819 173.483 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 2.5 ttt -52.79 -51.62 60.0 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 118.874 -0.584 . . . . 2.1200000000000001 110.93 167.574 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -71.81 -27.14 62.72 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.58 1.082 . . . . 5.79 113.008 -178.112 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 8.6 t -61.08 -31.82 71.49 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 113.868 1.062 . . . . 2.2000000000000002 113.868 168.64 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -114.6 -29.69 6.74 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 116.939 2.2 . . . . 2.6299999999999999 116.939 -176.119 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -76.29 85.14 3.08 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 124.725 1.21 . . . . 1.6399999999999999 107.809 168.419 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -47.43 -35.67 8.83 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.832 1.419 . . . . 4.7800000000000002 114.832 -164.943 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 44.1 p30 -96.58 -14.5 22.17 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.724 1.379 . . . . 2.6099999999999999 114.724 -179.917 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 70.9 m 53.98 62.97 2.35 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.932 1.293 . . . . 3.4900000000000002 111.644 -167.158 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 14.2 p30 -87.92 -79.49 0.29 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.044 1.338 . . . . 2.9300000000000002 108.787 177.306 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -178.92 -27.54 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 129.812 3.245 . . . . 5.5899999999999999 112.66 168.57 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -113.64 142.41 46.04 Favored 'General case' 0 C--O 1.242 0.667 0 C-N-CA 126.475 1.91 . . . . 2.7200000000000002 108.942 -174.366 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 6.3 mt -119.99 109.59 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 123.586 0.754 . . . . 1.5700000000000001 111.18 -176.451 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -84.06 157.61 21.73 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.008 2.123 . . . . 3.8100000000000001 110.987 172.731 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.93 -33.96 39.73 Favored 'General case' 0 CA--C 1.551 1.01 0 O-C-N 120.578 -1.326 . . . . 2.3999999999999999 114.11 179.92 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -75.67 -19.28 59.26 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 119.982 -1.699 . . . . 5.29 112.874 176.669 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -78.64 -63.65 1.36 Allowed 'General case' 0 CA--C 1.551 0.981 0 O-C-N 121.004 -1.06 . . . . 2.1800000000000002 108.624 160.727 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -58.03 -22.49 50.15 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.381 2.672 . . . . 2.27 117.093 -172.387 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 2.3 p -58.54 -21.35 52.17 Favored 'General case' 0 N--CA 1.481 1.075 0 O-C-N 119.117 -2.24 . . . . 2.8999999999999999 112.718 170.48 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.4 p -71.2 -33.33 50.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 O-C-N 121.55 -0.718 . . . . 2.4500000000000002 112.432 171.93 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -62.97 -51.72 65.78 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.197 0.908 . . . . 1.98 110.833 174.611 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 92.2 mt -53.51 -37.65 62.97 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.069 0.948 . . . . 1.79 111.687 174.678 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 55.1 m -74.26 -39.33 63.08 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.42 1.088 . . . . 1.6299999999999999 113.205 179.315 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.1 mtm -64.05 -44.97 90.87 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.491 1.041 . . . . 2.1600000000000001 110.95 172.837 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 71.6 mt -63.31 -46.09 88.32 Favored 'General case' 0 CA--C 1.528 0.098 0 CA-C-O 118.495 -0.764 . . . . 2.0099999999999998 112.176 178.191 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.9 p -59.71 -34.61 73.12 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.793 1.179 . . . . 3.98 112.655 178.834 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 20.9 mtp -72.34 -30.73 65.01 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.519 1.303 . . . . 2.48 114.519 173.002 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.27 -33.26 74.93 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 120.62 1.555 . . . . 1.28 111.536 171.543 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -73.07 -26.54 61.3 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.723 1.008 . . . . 2.8500000000000001 113.723 173.773 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -55.44 -53.8 51.81 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.93 1.241 . . . . 3.0600000000000001 110.213 166.008 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.17 -31.94 72.69 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.367 1.067 . . . . 3.6200000000000001 113.082 -175.861 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.0 -40.89 99.15 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.814 1.246 . . . . 2.5299999999999998 112.186 170.837 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -74.45 -30.3 61.83 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.331 1.452 . . . . 3.2200000000000002 112.134 176.563 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 34.9 mt -66.84 -30.1 70.2 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 117.289 -1.339 . . . . 2.6299999999999999 113.589 179.915 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -83.21 -6.31 59.43 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 114.363 1.246 . . . . 4.1699999999999999 114.363 174.834 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -92.92 -53.39 4.17 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.663 0.785 . . . . 4.5499999999999998 110.897 169.141 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -75.84 12.84 0.96 Allowed 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.798 1.407 . . . . 4.0599999999999996 114.798 -168.296 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.937 0 C-N-CA 128.978 2.911 . . . . 5.1900000000000004 113.334 179.71 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.3 mp0 . . . . . 0 CA--C 1.54 0.577 0 CA-C-O 120.04 -0.028 . . . . 4.4800000000000004 110.953 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -140.72 155.83 69.21 Favored Pre-proline 0 N--CA 1.474 0.753 0 C-N-CA 124.648 1.179 . . . . 2.0 109.352 176.781 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.18 -20.78 27.93 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.434 2.089 . . . . 1.3899999999999999 112.963 -179.066 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 tt -82.68 -41.15 19.71 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.271 1.028 . . . . 2.6099999999999999 110.438 174.482 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.431 ' CD ' ' HZ2' ' A' ' 7' ' ' LYS . 4.0 tm-20 -64.97 -38.69 91.8 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.632 0.73 . . . . 3.73 109.944 175.315 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.483 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -70.57 -34.14 71.87 Favored 'General case' 0 C--O 1.232 0.159 0 O-C-N 120.546 -1.346 . . . . 4.9900000000000002 113.32 176.569 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.82 -47.61 82.13 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.567 0.747 . . . . 1.1000000000000001 111.934 169.23 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.3 mt -64.7 -36.02 82.93 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.463 1.029 . . . . 1.8 112.857 173.406 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 57.8 m -61.06 -42.33 98.3 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.995 0.918 . . . . 1.4099999999999999 111.437 172.537 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.5 m -57.93 -34.15 69.57 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.084 1.353 . . . . 1.5800000000000001 111.689 -178.958 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 10.2 mmt -53.65 -65.94 0.48 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.087 1.355 . . . . 3.1699999999999999 111.068 174.355 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.3 m -63.1 -28.39 44.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 CA-C-N 118.792 0.724 . . . . 2.1299999999999999 112.546 -176.162 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.0 m -70.01 -48.24 58.88 Favored 'General case' 0 CA--C 1.502 -0.877 0 C-N-CA 125.618 1.567 . . . . 1.48 112.691 -178.826 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.24 -35.48 48.24 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 117.772 -1.109 . . . . 2.9900000000000002 108.859 177.524 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.4 t80 -53.24 -45.13 68.62 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.994 0.918 . . . . 2.2000000000000002 111.897 -177.168 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.3 m80 -69.38 -11.97 61.27 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.671 1.36 . . . . 2.6400000000000001 114.671 -175.839 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -30.11 66.17 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 120.661 -1.274 . . . . 4.0800000000000001 111.11 170.562 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -102.98 -46.59 4.61 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.922 1.289 . . . . 2.0499999999999998 112.234 -176.888 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.7 p -65.41 -24.3 67.17 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 124.629 1.172 . . . . 2.3100000000000001 113.764 -178.597 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.09 7.42 60.07 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 127.357 2.408 . . . . 1.3100000000000001 115.6 177.607 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -87.26 -102.35 0.07 Allowed 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.053 1.426 . . . . 4.6600000000000001 109.903 170.792 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -66.78 161.99 22.46 Favored 'General case' 0 C--O 1.246 0.889 0 C-N-CA 124.772 1.229 . . . . 4.9800000000000004 113.421 -176.482 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.42 -134.55 51.75 Favored Glycine 0 C--N 1.341 0.816 0 C-N-CA 125.266 1.412 . . . . 1.8999999999999999 111.925 163.759 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.0 t -69.23 151.38 46.37 Favored 'General case' 0 C--O 1.251 1.159 0 CA-C-O 123.26 1.505 . . . . 3.0499999999999998 112.262 163.359 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -73.26 -22.2 60.45 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.989 0.916 . . . . 5.6399999999999997 112.958 171.174 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 28.8 tp -83.55 -11.18 57.71 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.307 1.043 . . . . 3.8399999999999999 112.65 175.748 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.0 p -115.59 154.33 29.61 Favored 'General case' 0 C--O 1.246 0.873 0 C-N-CA 125.981 1.712 . . . . 1.22 112.118 -177.367 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.4 ' HA ' ' OE1' ' A' ' 33' ' ' GLU 0.316 0.3 OUTLIER -121.6 108.18 13.27 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.862 1.06 . . . . 1.8600000000000001 113.862 166.582 . . . . . . . . 4 4 . 1 . 030 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.0 t -71.77 174.16 7.23 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 124.661 1.184 . . . . 2.48 113.993 174.336 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.446 HH21 ' CG ' ' A' ' 53' ' ' ASP . 19.1 ttt-85 -66.33 8.95 0.18 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 115.75 1.759 . . . . 4.4299999999999997 115.75 -170.181 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.06 -37.92 2.89 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 119.979 -1.7 . . . . 5.2000000000000002 112.381 166.279 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.4 ' OE1' ' HA ' ' A' ' 29' ' ' LEU . 35.7 mt-10 -52.67 -54.55 31.95 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.434 1.016 . . . . 1.54 111.007 165.834 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 22.0 tp -74.66 -32.55 62.28 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.54 0.736 . . . . 2.5499999999999998 112.476 -176.423 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -51.92 -47.85 64.46 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.631 0.651 . . . . 3.5 111.119 171.519 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.513 ' HG3' ' HE2' ' A' ' 40' ' ' LYS . 13.1 tp10 -91.64 4.06 53.58 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.08 1.141 . . . . 4.8099999999999996 114.08 -175.222 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 tt -78.49 -61.93 1.85 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.452 1.101 . . . . 1.8600000000000001 108.849 154.661 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.8 mt -51.32 -44.61 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 125.095 1.358 . . . . 0.89000000000000001 110.65 -178.214 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.02 -20.01 64.91 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.838 1.051 . . . . 3.9700000000000002 113.838 -177.007 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.513 ' HE2' ' HG3' ' A' ' 36' ' ' GLU . 43.2 mttm -102.36 -38.71 7.49 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 124.883 1.273 . . . . 2.75 112.336 179.508 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -58.9 -77.56 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 128.958 2.903 . . . . 4.7300000000000004 109.464 171.29 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.5 mt -81.04 48.2 1.09 Allowed 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.569 -1.332 . . . . 2.6000000000000001 112.798 -179.265 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.37 14.04 0.08 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 125.19 1.396 . . . . 3.21 114.485 176.794 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.429 HD23 ' H ' ' A' ' 44' ' ' LEU . 1.7 pt? -122.69 -3.15 8.77 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.181 2.192 . . . . 3.8300000000000001 114.436 -178.045 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -114.75 -178.99 18.85 Favored Glycine 0 N--CA 1.473 1.154 0 C-N-CA 124.867 1.223 . . . . 3.6000000000000001 114.208 -177.694 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -71.67 34.12 0.06 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 127.906 2.482 . . . . 6.3600000000000003 113.897 -176.359 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -81.46 53.98 2.22 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.668 2.387 . . . . 1.8600000000000001 115.821 -153.478 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.6 tttt -81.85 166.64 19.78 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 128.282 2.633 . . . . 6.0599999999999996 111.259 -179.899 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -45.79 -53.39 9.65 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.31 1.044 . . . . 5.71 113.332 -174.111 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.7 m -70.88 -31.15 67.73 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 113.923 1.082 . . . . 2.3399999999999999 113.923 178.819 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.2 m -65.16 -20.46 66.46 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.908 0.883 . . . . 2.3799999999999999 112.225 171.531 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 59.1 mt -93.8 -30.67 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 126.288 1.835 . . . . 1.22 111.314 174.043 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.446 ' CG ' HH21 ' A' ' 31' ' ' ARG . 5.6 t0 -70.45 -43.54 69.66 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.505 1.122 . . . . 3.1099999999999999 112.316 -178.233 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -69.11 -31.92 70.96 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.141 -0.974 . . . . 3.4500000000000002 111.502 174.431 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.71 -54.66 42.58 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.395 1.078 . . . . 2.7599999999999998 109.482 172.03 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.5 mmm -52.33 -41.14 62.75 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 127.257 2.223 . . . . 2.6699999999999999 112.038 174.403 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -26.94 66.82 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.561 1.545 . . . . 4.3899999999999997 113.043 177.639 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.6 t -92.69 -20.53 20.72 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.346 -1.471 . . . . 2.6600000000000001 113.272 171.97 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.3 -42.37 93.14 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 127.759 2.424 . . . . 2.9700000000000002 111.682 172.159 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -87.2 154.86 20.39 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 115.148 1.536 . . . . 1.96 115.148 -177.051 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -125.76 10.99 7.79 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 126.074 1.75 . . . . 3.0800000000000001 113.805 177.408 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -137.37 -34.94 0.69 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 116.064 1.876 . . . . 2.02 116.064 -162.563 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 75.07 26.95 1.18 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.701 1.601 . . . . 3.0899999999999999 111.551 -161.825 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 39.1 p-10 -93.73 -16.88 23.78 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.482 1.513 . . . . 2.3300000000000001 112.64 -169.84 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 68.78 -0.09 2.49 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.659 2.383 . . . . 4.2699999999999996 115.59 -178.333 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -101.25 140.85 34.98 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 122.244 1.021 . . . . 2.75 110.035 160.546 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 48.6 mm -100.25 113.5 36.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 106.622 -1.622 . . . . 1.1699999999999999 106.622 164.988 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.66 161.05 28.85 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.903 1.281 . . . . 2.5699999999999998 111.465 172.701 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -58.38 -26.69 63.49 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 115.008 1.485 . . . . 2.3599999999999999 115.008 -176.272 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.2 mtmm -79.82 -32.54 40.68 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.755 -1.215 . . . . 4.1200000000000001 112.397 173.222 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -60.67 -46.97 88.32 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 109.319 -0.623 . . . . 1.8999999999999999 109.319 168.94 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -58.28 -32.41 68.39 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.189 1.796 . . . . 2.3999999999999999 113.856 173.281 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.3 m -61.21 -29.84 70.06 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 119.603 -1.936 . . . . 2.5499999999999998 113.178 168.127 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 43.1 t -73.85 -36.07 44.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 O-C-N 121.127 -0.983 . . . . 2.9300000000000002 110.881 175.926 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -61.94 -51.44 68.09 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 118.911 0.778 . . . . 1.9399999999999999 112.853 170.842 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.4 mt -59.3 -33.29 70.92 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.467 0.707 . . . . 2.0099999999999998 111.578 174.95 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 92.7 m -60.52 -47.48 85.98 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 118.231 -0.89 . . . . 1.1100000000000001 111.346 168.919 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 16.1 mtm -58.08 -44.51 87.62 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 120.118 1.326 . . . . 1.79 112.022 177.441 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.0 mt -71.21 -43.63 66.98 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.546 0.612 . . . . 1.6399999999999999 112.632 -179.189 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 9.9 t -66.09 -26.37 67.44 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.294 -0.878 . . . . 1.51 112.852 175.462 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 76.7 mtp -72.45 -40.11 67.28 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.306 -0.871 . . . . 1.74 112.472 166.03 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.17 -38.5 89.27 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.571 1.078 . . . . 1.3500000000000001 112.757 -178.963 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -65.11 -24.07 67.33 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.839 1.052 . . . . 2.2400000000000002 113.839 171.648 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -70.92 -44.11 66.86 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.3 0.954 . . . . 2.9300000000000002 112.864 179.009 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -60.22 -47.32 86.46 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.766 1.227 . . . . 3.1400000000000001 110.66 170.959 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -50.84 -40.84 56.92 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.907 1.283 . . . . 2.6299999999999999 112.672 176.919 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -70.61 -30.78 67.53 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.001 1.321 . . . . 2.0600000000000001 112.966 179.304 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 60.2 mt -78.55 -20.6 50.3 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.21 1.004 . . . . 1.6100000000000001 112.278 176.612 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -90.01 -6.67 55.34 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.553 1.316 . . . . 3.79 114.553 174.487 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 21.5 t70 . . . . . 0 N--CA 1.472 0.647 0 C-N-CA 126.359 1.863 . . . . 2.8100000000000001 112.946 178.63 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.473 0.691 0 CA-C-O 118.751 -0.642 . . . . 2.46 110.727 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -62.54 -18.84 65.63 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 122.961 2.441 . . . . 1.3 114.089 175.869 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.7 -54.65 6.36 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.93 1.241 . . . . 2.6000000000000001 111.169 179.49 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -62.88 -30.97 71.92 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.931 0.787 . . . . 4.7599999999999998 110.657 174.482 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -62.98 -45.78 90.81 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 119.927 -1.733 . . . . 7.8399999999999999 111.471 166.512 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.5 -50.62 73.1 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.426 1.09 . . . . 0.90000000000000002 111.1 177.566 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 70.5 mt -56.99 -47.04 81.74 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.493 1.117 . . . . 1.52 111.704 172.696 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 96.9 m -56.53 -44.38 80.76 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.488 0.715 . . . . 1.4199999999999999 111.362 175.222 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 91.8 m -63.69 -44.56 93.32 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.406 1.482 . . . . 1.4099999999999999 109.842 179.336 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 79.7 mtp -57.13 -51.36 69.62 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.561 0.744 . . . . 3.0699999999999998 110.617 174.376 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 53.2 t -63.39 -30.45 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 N-CA-C 113.367 0.877 . . . . 1.8400000000000001 113.367 176.422 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 82.4 m -62.79 -52.6 62.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.877 1.271 . . . . 0.89000000000000001 110.246 174.717 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -31.78 69.37 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 118.545 -0.741 . . . . 1.6499999999999999 111.311 169.636 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -69.06 -58.41 4.13 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 118.642 0.655 . . . . 2.1000000000000001 111.942 -175.398 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -73.53 -12.31 60.73 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 120.307 1.412 . . . . 2.3799999999999999 114.281 177.287 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -67.51 -66.92 0.5 Allowed 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.247 -0.908 . . . . 4.2800000000000002 111.626 157.702 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -70.93 -32.53 69.46 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.73 1.011 . . . . 2.1299999999999999 113.73 -172.517 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 8.2 p -65.1 -18.32 65.2 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 120.477 -1.389 . . . . 2.0699999999999998 112.225 169.301 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.64 9.25 77.45 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 126.048 1.785 . . . . 1.74 114.777 171.058 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -72.72 -24.22 60.96 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.597 1.698 . . . . 3.9199999999999999 112.304 174.262 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -161.4 152.67 18.67 Favored 'General case' 0 C--O 1.252 1.214 0 C-N-CA 125.415 1.486 . . . . 3.3399999999999999 111.91 179.494 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.84 -131.34 52.0 Favored Glycine 0 C--N 1.339 0.697 0 C-N-CA 126.013 1.768 . . . . 2.7400000000000002 111.061 168.018 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.5 m -57.65 125.49 23.16 Favored 'General case' 0 C--O 1.248 1.025 0 O-C-N 122.139 -0.624 . . . . 3.1800000000000002 110.246 166.34 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -74.83 66.86 1.56 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.997 2.119 . . . . 8.0899999999999999 109.667 158.226 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 63.8 tp -167.97 -53.88 0.02 OUTLIER 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 127.526 2.33 . . . . 2.7200000000000002 107.728 -176.54 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 60.7 p -94.84 158.1 15.64 Favored 'General case' 0 C--O 1.252 1.196 0 C-N-CA 125.752 1.621 . . . . 1.23 112.911 176.429 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -103.82 116.8 32.95 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 127.05 2.14 . . . . 2.6499999999999999 109.701 169.112 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 3.0 p -74.34 165.98 24.26 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.141 0.576 . . . . 2.3900000000000001 111.602 164.674 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 15.8 tpp180 -41.49 -33.01 0.38 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.517 1.927 . . . . 4.7000000000000002 113.778 167.98 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.61 -40.11 12.81 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 120.698 -1.251 . . . . 4.4900000000000002 113.753 -179.353 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -56.84 -44.08 81.75 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.45 0.643 . . . . 2.02 110.457 170.564 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 tp -66.75 -44.31 81.81 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.35 1.06 . . . . 2.0600000000000001 112.138 -179.498 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -57.38 -37.25 72.36 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.804 1.242 . . . . 2.9399999999999999 113.175 178.631 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -62.96 -65.76 0.64 Allowed 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 117.839 -1.077 . . . . 3.75 111.087 168.831 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 tp -48.06 -57.31 5.98 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 127.779 2.432 . . . . 2.2200000000000002 112.024 -175.107 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 34.9 mt -56.17 -56.87 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.065 0.848 . . . . 1.29 110.135 -177.395 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -24.02 66.13 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.632 0.773 . . . . 5.4299999999999997 112.446 -174.111 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.95 -31.84 12.89 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.092 1.757 . . . . 6.21 112.835 -173.586 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.6 mm-40 -97.04 -21.22 17.51 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 119.407 1.003 . . . . 5.25 112.712 176.924 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -113.31 118.27 34.15 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 119.712 1.142 . . . . 2.2000000000000002 108.488 171.755 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 15.7 p -139.55 10.73 2.49 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.756 1.222 . . . . 3.2400000000000002 113.623 -175.103 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -68.92 -42.9 76.18 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.615 1.566 . . . . 3.2000000000000002 111.088 -177.265 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -96.88 165.4 23.13 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 110.211 -1.156 . . . . 3.0800000000000001 110.211 156.475 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.91 96.88 0.45 Allowed 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.899 -1.149 . . . . 5.4800000000000004 107.899 165.891 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 8.0 tpt -72.27 75.93 0.99 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.396 1.879 . . . . 2.8500000000000001 112.263 -168.088 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.44 ' H ' ' HE2' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -83.49 163.73 20.29 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.731 1.613 . . . . 3.8100000000000001 114.45 -161.669 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -47.82 -59.95 2.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.775 1.63 . . . . 5.0 112.057 177.839 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 13.1 m -71.77 6.09 2.17 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 115.179 1.548 . . . . 2.6000000000000001 115.179 178.973 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 34.3 p -119.83 16.73 12.67 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.768 -1.208 . . . . 2.79 112.554 163.708 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 35.1 mt -110.42 -47.64 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.018 0.927 . . . . 1.55 111.976 171.691 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -71.89 -30.43 65.38 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.996 1.271 . . . . 3.0699999999999998 113.255 -173.386 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -65.52 -37.05 85.64 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.924 0.784 . . . . 2.4199999999999999 111.5 167.56 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 10.0 tt -60.93 -43.54 98.49 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 117.73 -1.129 . . . . 2.6200000000000001 110.097 176.092 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 6.3 ttt -59.34 -50.55 73.55 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 120.099 1.318 . . . . 1.8700000000000001 113.276 170.632 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.0 tmtt? -52.49 -33.32 44.25 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.71 1.204 . . . . 4.2699999999999996 112.195 173.272 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 63.3 m -86.58 -22.94 25.98 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.758 1.623 . . . . 2.5299999999999998 113.532 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 9.5 mt -70.16 -42.18 72.84 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 120.159 1.345 . . . . 1.9199999999999999 110.877 169.386 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.71 141.53 43.58 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.235 1.414 . . . . 2.6400000000000001 113.093 -179.929 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 33.9 mmtm -124.21 -1.06 8.23 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.69 1.196 . . . . 3.23 113.066 172.432 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 31.4 p-10 -113.47 -48.84 2.92 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.642 1.977 . . . . 2.4199999999999999 111.125 167.345 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 5.0 t 94.62 111.12 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 129.399 3.08 . . . . 2.3500000000000001 107.879 -167.29 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 p30 -155.69 -135.46 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 122.037 0.922 . . . . 3.0800000000000001 109.0 -173.475 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -140.58 5.63 2.02 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 114.544 1.313 . . . . 5.1299999999999999 114.544 175.856 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -132.32 136.89 47.19 Favored 'General case' 0 C--O 1.246 0.898 0 C-N-CA 127.393 2.277 . . . . 3.5099999999999998 111.998 -174.306 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 31.8 mm -108.71 122.27 63.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 126.08 1.752 . . . . 1.3 108.456 169.186 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -98.44 -174.48 2.83 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.594 1.957 . . . . 3.0699999999999998 110.994 169.239 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -25.11 65.31 Favored 'General case' 0 CA--C 1.551 0.985 0 O-C-N 120.456 -1.402 . . . . 2.8199999999999998 114.374 177.456 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -71.65 -46.68 58.26 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.436 -1.415 . . . . 5.9299999999999997 112.079 174.137 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -63.11 -48.73 77.31 Favored 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 118.829 0.741 . . . . 1.77 110.177 171.329 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -59.48 -23.43 62.74 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 120.029 -1.669 . . . . 1.96 114.33 -179.33 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 41.4 t -53.01 -35.18 59.12 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.612 -1.305 . . . . 2.3199999999999998 111.904 167.887 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 59.7 t -64.63 -40.54 89.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 CA-C-N 119.181 0.9 . . . . 1.6799999999999999 111.357 178.383 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -62.94 -50.98 68.67 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.881 0.873 . . . . 1.6399999999999999 111.26 176.867 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.9 -43.81 98.02 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.167 0.987 . . . . 1.55 110.961 178.546 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 95.0 m -60.93 -52.12 66.37 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.909 1.284 . . . . 0.93999999999999995 112.07 177.841 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 30.6 ttp -61.06 -41.16 96.09 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.097 0.959 . . . . 2.2599999999999998 111.93 -175.22 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 98.0 mt -72.45 -45.3 60.2 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 123.796 0.838 . . . . 1.75 112.219 175.784 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.4 t -67.19 -28.46 68.11 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.111 0.869 . . . . 1.54 112.998 -177.99 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -50.01 71.48 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.013 0.824 . . . . 3.6899999999999999 111.338 166.63 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.9 -30.56 70.24 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.742 0.701 . . . . 0.87 112.865 -178.71 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -74.64 -24.73 58.88 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.768 1.025 . . . . 2.2999999999999998 113.768 172.282 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -78.59 -42.26 29.54 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.069 0.948 . . . . 2.7000000000000002 111.537 172.725 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -60.8 -35.89 77.62 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.664 0.786 . . . . 3.8100000000000001 110.703 171.589 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -57.24 -46.33 83.09 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.185 0.994 . . . . 2.79 112.203 171.527 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -65.5 -34.95 79.47 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.503 1.121 . . . . 2.3100000000000001 112.217 -179.057 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 98.0 mt -69.58 -30.98 68.87 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.776 0.83 . . . . 1.6699999999999999 112.816 175.749 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -89.31 -6.44 56.71 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 114.498 1.295 . . . . 4.5199999999999996 114.498 178.656 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -93.54 -50.01 5.62 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.395 1.478 . . . . 3.0800000000000001 112.142 170.852 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.73 44.26 0.72 Allowed 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 123.09 1.424 . . . . 2.79 112.963 -178.303 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm . . . . . 0 C--O 1.25 1.116 0 C-N-CA 129.7 3.2 . . . . 4.3600000000000003 115.234 171.399 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 . . . . . 0 CA--C 1.539 0.532 0 N-CA-C 107.844 -1.169 . . . . 4.1399999999999997 107.844 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.4 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 46.3 p -120.21 174.75 2.69 Favored Pre-proline 0 N--CA 1.469 0.522 0 C-N-CA 124.052 0.941 . . . . 1.72 113.372 -153.703 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.4 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 90.8 Cg_endo -75.11 -29.52 7.97 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 121.659 1.572 . . . . 1.8600000000000001 111.485 159.222 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.0 tp -77.17 -53.77 7.34 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.318 0.963 . . . . 3.1499999999999999 113.064 -170.816 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -71.03 -26.82 63.27 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.876 1.217 . . . . 5.6200000000000001 111.068 -177.874 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -60.58 -40.99 93.75 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.122 -0.986 . . . . 4.7300000000000004 111.67 164.38 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.97 -31.11 61.38 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.048 0.939 . . . . 0.97999999999999998 112.148 176.421 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.5 mt -66.36 -42.57 87.85 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.012 1.278 . . . . 1.51 111.587 168.018 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 91.5 m -60.4 -43.35 96.74 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 121.341 -0.849 . . . . 1.5900000000000001 110.692 172.872 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 51.2 m -60.91 -38.4 85.62 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.205 1.002 . . . . 1.7 111.158 172.065 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 43.1 ttm -62.85 -49.82 73.36 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.56 -1.21 . . . . 3.1099999999999999 111.952 175.764 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.3 m -66.36 -22.4 30.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 CA-C-N 120.804 1.638 . . . . 2.4300000000000002 113.317 174.938 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 60.2 m -67.75 -54.74 16.83 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 117.608 -1.187 . . . . 0.80000000000000004 109.72 173.069 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -52.99 -36.55 60.51 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-N 119.2 0.909 . . . . 2.4399999999999999 111.221 168.753 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -64.42 -44.79 90.12 Favored 'General case' 0 C--O 1.219 -0.503 0 O-C-N 123.849 0.718 . . . . 1.75 111.3 -175.173 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -75.22 -37.28 61.17 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.999 1.272 . . . . 1.9399999999999999 112.895 173.375 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -15.99 17.72 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.121 1.768 . . . . 5.9100000000000001 113.683 175.607 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.483 ' CD2' HD13 ' A' ' 37' ' ' LEU . 90.4 m-85 -121.66 -20.18 6.58 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 116.718 2.118 . . . . 2.25 116.718 162.966 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.7 t -71.44 -23.66 61.88 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 122.462 2.392 . . . . 1.8100000000000001 112.478 172.743 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.8 0.77 89.4 Favored Glycine 0 CA--C 1.535 1.31 0 CA-C-O 118.192 -1.338 . . . . 1.8999999999999999 114.062 166.103 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.4 tpt85 -62.84 -22.86 66.98 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 119.898 1.849 . . . . 5.8099999999999996 112.76 177.525 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -164.03 148.61 10.19 Favored 'General case' 0 C--O 1.252 1.218 0 C-N-CA 127.483 2.313 . . . . 5.0099999999999998 110.447 168.182 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 43.35 -126.55 5.33 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 126.573 2.035 . . . . 2.9100000000000001 114.772 163.185 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.5 m -44.68 137.65 3.79 Favored 'General case' 0 C--O 1.245 0.853 0 C-N-CA 126.686 1.994 . . . . 2.8300000000000001 114.149 178.557 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -110.5 -11.59 14.46 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 127.018 2.127 . . . . 4.2800000000000002 115.586 -163.011 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 28.2 tp -95.89 0.02 51.5 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.095 0.958 . . . . 3.75 111.066 170.259 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.3 p -142.68 156.38 45.03 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 126.14 1.776 . . . . 0.98999999999999999 113.99 -162.174 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.9 mt -111.34 104.58 13.05 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.703 1.201 . . . . 1.52 109.145 171.129 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.1 t -66.25 152.4 44.99 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.4 -0.813 . . . . 1.97 110.683 168.044 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.7 ttp180 -42.51 -29.86 0.31 Allowed 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.926 2.09 . . . . 5.54 115.693 -175.377 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -83.38 -33.17 25.85 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 116.592 2.071 . . . . 7.4400000000000004 116.592 171.479 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -60.81 -43.31 98.37 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.011 0.925 . . . . 1.98 109.948 165.874 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.9 tp -66.94 -45.14 78.72 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.669 0.788 . . . . 2.1800000000000002 112.656 -174.703 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -50.3 -47.29 55.66 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.383 0.992 . . . . 3.4900000000000002 111.44 174.757 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -70.89 -46.0 63.36 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 118.441 -0.79 . . . . 3.0499999999999998 111.615 -174.017 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.483 HD13 ' CD2' ' A' ' 19' ' ' TYR . 29.4 tp -55.47 -52.84 62.3 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.859 1.264 . . . . 2.3199999999999998 112.352 179.824 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 51.3 mt -54.05 -57.57 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 107.866 -1.161 . . . . 1.04 107.866 -178.866 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.16 -16.7 60.5 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.883 1.068 . . . . 4.0099999999999998 113.883 -171.27 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.2 mmtp -81.99 -47.93 12.07 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.984 1.314 . . . . 3.3199999999999998 112.208 177.553 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.511 ' HA ' HG21 ' B' ' 3' ' ' THR . 11.0 mm-40 -101.98 15.23 29.69 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.604 1.162 . . . . 6.04 111.696 -172.23 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.412 HD12 HD22 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -164.83 122.11 1.59 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.217 2.207 . . . . 2.6800000000000002 111.643 173.698 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 48.8 t -71.39 -53.69 13.25 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 114.045 1.128 . . . . 4.7300000000000004 114.045 -179.188 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.412 HD22 HD12 ' A' ' 42' ' ' LEU . 3.9 mm? 61.99 -56.52 0.13 Allowed 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 128.778 2.831 . . . . 5.7199999999999998 113.973 -170.993 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 161.42 26.45 0.02 OUTLIER Glycine 0 CA--C 1.536 1.369 1 C-N-CA 130.818 4.056 . . . . 2.77 110.427 -174.355 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 65.09 132.79 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 128.706 2.802 . . . . 9.4299999999999997 111.458 -157.328 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 41.8 mmm -88.24 129.29 35.4 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.892 0.853 . . . . 2.52 110.335 174.797 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -112.85 159.19 19.28 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.241 1.017 . . . . 4.0899999999999999 110.463 178.417 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -45.2 -46.29 12.17 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 114.673 1.36 . . . . 5.1900000000000004 114.673 -169.928 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -61.46 -7.29 2.96 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 115.588 1.699 . . . . 4.2699999999999996 115.588 179.884 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.3 m -115.44 -12.11 11.75 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.584 1.084 . . . . 2.1200000000000001 113.139 171.935 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 74.7 mt -84.39 -44.72 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 O-C-N 120.692 -1.255 . . . . 2.5600000000000001 112.287 -171.347 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -74.94 -12.68 60.41 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.237 0.458 . . . . 4.2599999999999998 112.237 176.742 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.446 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 1.0 OUTLIER -91.0 -28.75 17.79 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.43 1.092 . . . . 2.6200000000000001 113.383 169.375 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.0 -47.27 81.24 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.573 -0.704 . . . . 2.2200000000000002 109.654 156.925 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 6.4 tpt -56.35 -49.05 75.49 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.659 0.784 . . . . 1.8100000000000001 110.712 176.224 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.446 ' HE2' ' HA ' ' A' ' 54' ' ' ASP . 14.8 mtmm -60.05 -39.12 84.86 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.587 1.085 . . . . 4.3200000000000003 112.916 174.37 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 73.0 m -67.32 -25.04 65.82 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.091 0.774 . . . . 1.8600000000000001 113.091 175.575 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.566 HD12 ' HA ' ' A' ' 72' ' ' TYR . 2.4 mm? -86.67 -40.85 14.71 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.055 1.342 . . . . 2.6400000000000001 113.631 172.069 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -88.73 64.3 7.25 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 114.606 1.336 . . . . 1.9099999999999999 114.606 -156.378 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -47.6 -44.85 26.91 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.568 1.547 . . . . 3.1400000000000001 114.28 -176.258 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . 0.281 0.4 OUTLIER -84.03 2.93 36.8 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 114.008 1.114 . . . . 2.7400000000000002 114.008 -175.159 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 69.2 m 60.14 79.68 0.23 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 127.659 2.384 . . . . 4.21 113.253 168.998 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -158.3 -114.8 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.652 -0.655 . . . . 2.7799999999999998 110.153 -155.105 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -155.4 -10.58 0.12 Allowed 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 116.424 2.009 . . . . 4.8200000000000003 116.424 176.816 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -127.35 146.14 50.56 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.227 1.811 . . . . 2.4300000000000002 109.412 -173.467 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.415 HD12 ' HB3' ' A' ' 59' ' ' LEU . 9.4 mm -106.54 98.44 6.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 125.801 1.641 . . . . 1.22 110.205 176.136 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -67.76 158.08 33.23 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.557 1.143 . . . . 3.2799999999999998 111.973 168.543 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -52.64 -31.38 36.52 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.216 1.561 . . . . 2.6400000000000001 115.216 -176.533 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.469 ' HE3' ' H ' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -76.2 -35.4 59.11 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 120.669 -1.269 . . . . 4.0499999999999998 112.581 175.309 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -62.55 -47.86 82.03 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.118 0.567 . . . . 1.72 109.532 166.433 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.566 ' HA ' HD12 ' A' ' 59' ' ' LEU . 73.8 t80 -60.8 -39.67 89.77 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 127.451 2.3 . . . . 2.3700000000000001 115.219 -170.758 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 38.9 m -53.62 -25.56 18.17 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.629 1.171 . . . . 1.98 114.117 -171.29 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.7 m -69.59 -25.6 29.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 O-C-N 121.017 -1.052 . . . . 2.6000000000000001 113.548 178.351 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.53 ' HB2' HD11 ' A' ' 59' ' ' LEU . 20.4 t80 -62.88 -56.97 12.61 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.519 1.054 . . . . 2.0699999999999998 110.866 -177.82 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.6 mt -65.41 -29.06 69.71 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 118.583 -0.723 . . . . 2.4100000000000001 112.009 176.115 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 66.6 m -60.72 -52.22 66.05 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.792 0.837 . . . . 1.0900000000000001 110.94 170.85 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 77.5 mtm -60.12 -41.69 93.16 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.557 0.743 . . . . 1.6299999999999999 111.65 177.088 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 77.2 mt -67.48 -41.59 84.35 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 118.582 -0.723 . . . . 1.26 112.589 179.4 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 3.7 t -69.66 -28.13 65.62 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.735 1.152 . . . . 2.1499999999999999 113.053 175.329 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 27.2 mtp -65.52 -42.53 91.9 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.295 -0.878 . . . . 2.3300000000000001 112.515 165.896 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.04 -33.94 76.88 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 120.009 1.277 . . . . 0.81999999999999995 113.031 175.962 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -64.58 -24.16 67.5 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.221 -0.925 . . . . 2.5699999999999998 112.8 171.459 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -75.51 -35.76 60.7 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.279 -0.888 . . . . 2.7400000000000002 113.0 178.379 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -62.37 -44.66 95.95 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.604 1.162 . . . . 3.9900000000000002 110.839 171.558 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.64 -50.75 62.52 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.048 1.339 . . . . 2.5 111.728 171.673 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -62.78 -33.57 75.46 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.161 0.984 . . . . 2.2799999999999998 111.935 178.711 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 42.6 mt -69.63 -18.61 63.61 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 117.507 -1.235 . . . . 1.5 113.308 178.297 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -91.24 -17.2 26.4 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 114.917 1.451 . . . . 2.7400000000000002 114.917 171.622 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.2 t70 . . . . . 0 N--CA 1.478 0.941 0 C-N-CA 124.663 1.185 . . . . 3.6400000000000001 112.835 -176.13 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' B' B ' 3' ' ' THR . . . . . 0.511 HG21 ' HA ' ' A' ' 41' ' ' GLU . 58.7 p . . . . . 0 N--CA 1.471 0.612 0 N-CA-C 112.24 0.459 . . . . 1.8200000000000001 112.24 . . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -62.56 -16.33 51.69 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 122.323 2.015 . . . . 1.52 113.039 165.69 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -80.72 -32.04 35.89 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 117.516 -1.231 . . . . 2.3100000000000001 111.911 173.274 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -50.41 -46.07 56.07 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.194 0.906 . . . . 6.1200000000000001 109.118 159.675 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 7' ' ' LYS . . . . . 0.484 ' HA ' ' CE ' ' B' ' 7' ' ' LYS . 0.2 OUTLIER -77.67 -25.34 49.48 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 114.707 1.373 . . . . 4.0800000000000001 114.707 -177.544 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.38 -46.28 56.02 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.859 0.754 . . . . 1.01 110.959 171.157 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 79.7 mt -68.86 -37.62 79.22 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.248 1.019 . . . . 1.8 111.834 175.568 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 97.2 m -54.22 -56.54 17.27 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 117.831 -1.08 . . . . 2.6800000000000002 108.657 167.098 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 43.9 m -53.18 -49.73 66.06 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.319 0.963 . . . . 1.72 110.527 -179.13 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 37.2 ttm -62.42 -46.17 89.78 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.666 0.786 . . . . 3.0 112.556 -178.146 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 1.8 p -70.25 -26.46 29.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.871 1.214 . . . . 2.6899999999999999 112.691 175.685 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 65.6 m -70.82 -46.03 63.49 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.373 1.469 . . . . 1.1399999999999999 111.736 -177.898 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -64.79 -43.16 94.12 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.86 0.864 . . . . 1.6000000000000001 109.459 169.189 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 29.7 t80 -66.55 -49.75 65.43 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 120.081 -0.648 . . . . 2.0299999999999998 111.417 -168.671 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.94 -3.6 10.4 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 120.689 -1.257 . . . . 2.2799999999999998 114.337 178.086 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.63 -57.9 2.08 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.026 -1.046 . . . . 4.6200000000000001 110.806 171.291 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -61.97 -34.1 75.52 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.303 -0.873 . . . . 1.8 112.717 177.056 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 67.5 m -70.02 -11.99 61.28 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.58 -1.325 . . . . 2.0099999999999998 114.121 171.645 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -94.11 -4.04 63.25 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 125.187 1.375 . . . . 1.3300000000000001 114.451 166.349 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 36.5 tpt85 -64.5 -23.48 67.29 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.138 1.469 . . . . 4.0599999999999996 112.502 176.941 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -151.59 175.52 12.25 Favored 'General case' 0 C--O 1.246 0.879 0 C-N-CA 127.225 2.21 . . . . 4.5700000000000003 108.658 172.08 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -41.31 153.8 0.1 OUTLIER Glycine 0 N--CA 1.474 1.176 0 C-N-CA 126.688 2.089 . . . . 3.46 115.122 -174.022 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 16.3 m 63.26 122.78 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.205 1.402 . . . . 3.5499999999999998 112.613 -179.358 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 23.2 mtpt -81.25 -25.39 36.65 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 114.819 1.414 . . . . 7.54 114.819 -175.063 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.437 ' H ' HD23 ' B' ' 27' ' ' LEU . 1.6 pt? -94.02 6.47 48.42 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.195 0.998 . . . . 3.5099999999999998 113.513 -173.882 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 19.0 p -144.63 154.39 42.76 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 127.159 2.184 . . . . 1.96 111.849 -166.929 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 77.1 mt -107.0 108.54 20.1 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.224 1.41 . . . . 1.79 109.722 167.686 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.42 160.9 4.86 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 120.156 -1.59 . . . . 1.8300000000000001 111.228 161.484 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -43.98 -35.21 1.96 Allowed 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.441 1.097 . . . . 3.8100000000000001 113.921 176.488 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.97 -40.5 39.09 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.245 1.018 . . . . 5.5 113.331 178.623 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -59.17 -42.48 90.91 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.084 0.954 . . . . 2.2400000000000002 109.76 173.282 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tp -66.33 -47.02 74.84 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.265 -0.874 . . . . 2.0099999999999998 111.839 176.032 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -54.73 -54.21 44.88 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 120.354 1.434 . . . . 3.0800000000000001 112.045 176.994 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -41.81 -62.61 0.87 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.262 1.425 . . . . 3.48 112.601 170.66 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 tp -48.93 -62.96 1.24 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.114 1.766 . . . . 2.1000000000000001 110.433 -177.871 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 22.3 mt -62.01 -38.01 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 109.546 -0.539 . . . . 1.8300000000000001 109.546 -171.942 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 51.2 mttm -58.12 -33.24 68.92 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.907 0.706 . . . . 4.9500000000000002 112.907 179.955 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -82.97 -47.69 11.48 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 122.979 0.512 . . . . 4.9299999999999997 111.927 177.835 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -75.63 -55.71 5.4 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 124.335 1.022 . . . . 5.5300000000000002 111.014 -172.598 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -83.01 49.13 1.47 Allowed 'General case' 0 CA--C 1.546 0.814 0 O-C-N 119.679 -1.888 . . . . 2.7000000000000002 110.928 -177.899 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 15.4 t -75.92 16.62 0.39 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.617 1.967 . . . . 4.5999999999999996 114.573 -176.521 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.48 18.05 0.18 Allowed 'General case' 0 N--CA 1.478 0.955 0 O-C-N 120.084 -1.635 . . . . 3.71 115.093 -177.029 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.95 -40.93 1.45 Allowed Glycine 0 CA--C 1.534 1.245 0 C-N-CA 126.172 1.844 . . . . 4.1699999999999999 114.72 -179.526 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -64.27 -22.61 67.01 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.177 1.391 . . . . 5.2699999999999996 113.985 -175.82 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 7.6 tpt -74.85 76.83 2.12 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.759 1.624 . . . . 2.1600000000000001 112.509 -175.866 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 20.2 mttm -62.74 120.73 11.81 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 120.786 -1.196 . . . . 3.9900000000000002 111.029 -170.548 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.67 -34.9 69.87 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.923 1.453 . . . . 3.7999999999999998 114.923 -156.934 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 3.0 m -87.93 -14.68 38.65 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.299 -0.876 . . . . 4.8799999999999999 112.388 -178.442 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 17.9 t -70.48 -10.26 58.71 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.479 -1.388 . . . . 2.5800000000000001 111.979 166.426 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 5.4 mm -65.35 -35.34 75.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 124.191 0.996 . . . . 1.3500000000000001 111.532 172.138 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.78 -39.4 69.97 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.148 0.885 . . . . 3.5 111.821 -176.633 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.29 -30.9 66.82 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.543 0.737 . . . . 4.2999999999999998 112.985 170.895 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 7.8 tt -65.13 -45.83 83.47 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.617 -0.706 . . . . 2.3300000000000001 110.664 166.917 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -56.56 -48.77 76.62 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.576 1.55 . . . . 2.0099999999999998 111.257 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 35.8 mtpt -54.75 -32.79 60.35 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.549 1.54 . . . . 4.4199999999999999 113.782 171.592 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 50.7 m -82.51 -30.21 29.97 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.291 1.037 . . . . 2.52 113.065 178.618 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 19.1 mt -73.66 -36.07 65.31 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.893 0.877 . . . . 2.02 111.988 173.856 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -74.82 74.88 2.12 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 123.178 1.466 . . . . 1.8799999999999999 110.24 -177.892 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.2 tmtm? -61.33 -16.22 43.74 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 114.137 -1.392 . . . . 4.9199999999999999 113.863 -158.424 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 48.1 p-10 -105.89 -14.44 15.21 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 115.777 1.769 . . . . 3.4199999999999999 115.777 172.594 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 40.1 t 56.54 90.88 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.308 1.443 . . . . 4.3600000000000003 113.064 -162.341 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 11.3 p30 -123.91 -79.93 0.62 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.153 1.381 . . . . 3.21 109.864 176.48 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -168.74 -34.77 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 129.77 3.228 . . . . 8.2100000000000009 112.024 177.428 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -129.12 147.22 50.95 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 126.178 1.791 . . . . 2.5699999999999998 110.443 -167.349 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 67' ' ' ILE . . . . . 0.43 HG22 ' HB2' ' B' ' 72' ' ' TYR . 75.2 mt -97.06 102.36 13.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 121.941 0.877 . . . . 1.3500000000000001 109.105 178.576 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -66.68 152.95 44.39 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.163 1.785 . . . . 3.1400000000000001 108.961 171.752 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -47.65 -41.85 23.14 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.062 1.345 . . . . 2.3799999999999999 113.57 -178.11 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.55 -8.37 59.12 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 115.612 1.708 . . . . 3.4700000000000002 115.612 177.031 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -83.28 -52.29 6.69 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 107.505 -1.295 . . . . 2.1099999999999999 107.505 160.528 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 72' ' ' TYR . . . . . 0.43 ' HB2' HG22 ' B' ' 67' ' ' ILE . 40.5 t80 -52.98 -34.0 53.94 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.584 1.954 . . . . 2.73 114.867 -174.765 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 79.6 p -63.07 -17.64 62.5 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 117.401 -1.285 . . . . 1.95 113.992 174.695 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 92.6 t -56.71 -38.91 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-N 120.837 1.653 . . . . 1.6100000000000001 111.213 168.361 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -60.41 -54.23 48.06 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 118.634 0.652 . . . . 2.04 111.394 172.517 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 69.4 mt -62.8 -37.68 87.69 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 123.784 0.834 . . . . 1.6499999999999999 110.768 -174.63 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 19.1 m -69.37 -43.35 73.75 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.634 1.574 . . . . 1.7 112.532 175.446 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 5.8 mmm -56.47 -46.11 80.57 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 120.191 1.359 . . . . 2.73 111.801 173.101 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 97.3 mt -67.25 -50.72 59.5 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.43 0.692 . . . . 1.6699999999999999 111.365 175.949 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 2.0 t -66.45 -25.58 66.8 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.101 -0.999 . . . . 2.0099999999999998 113.131 -177.151 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 62.7 mtm -73.04 -37.34 66.92 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.156 -0.965 . . . . 3.1099999999999999 112.683 168.36 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.97 -33.87 76.3 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.164 0.893 . . . . 1.0600000000000001 112.049 170.929 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -70.68 -32.85 70.25 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 113.378 0.881 . . . . 2.0600000000000001 113.378 168.381 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -69.74 -42.99 73.21 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.28 0.945 . . . . 3.1899999999999999 112.087 179.845 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -58.04 -46.46 85.3 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.729 1.212 . . . . 3.0299999999999998 112.075 170.818 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.26 -50.67 64.34 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.879 1.272 . . . . 3.8399999999999999 111.424 175.615 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -66.67 -27.71 67.88 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.566 1.546 . . . . 2.4199999999999999 111.336 -177.695 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 34.1 mt -81.16 -9.53 59.78 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 125.414 1.485 . . . . 3.1800000000000002 114.488 177.757 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -87.76 -18.0 30.39 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 120.047 1.294 . . . . 5.5599999999999996 114.168 164.155 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -80.92 -52.92 6.92 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.108 0.963 . . . . 5.0499999999999998 110.821 164.406 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -98.46 28.13 4.34 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.297 1.839 . . . . 5.7999999999999998 113.11 -171.906 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.071 0 C-N-CA 128.272 2.629 . . . . 9.2899999999999991 114.445 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.1 mtt . . . . . 0 N--CA 1.476 0.871 0 N-CA-C 107.361 -1.348 . . . . 7.79 107.361 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -154.5 132.99 12.0 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 106.39 -1.707 . . . . 3.9700000000000002 106.39 -165.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.7 p -71.05 168.07 24.04 Favored Pre-proline 0 N--CA 1.478 0.94 0 C-N-CA 123.379 0.671 . . . . 1.76 112.805 -171.087 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -61.28 -20.82 69.73 Favored 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 122.484 2.123 . . . . 1.78 113.211 165.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.01 -41.59 42.11 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.637 1.175 . . . . 2.4100000000000001 111.327 173.132 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -61.08 -36.05 78.59 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.642 -1.286 . . . . 3.8599999999999999 110.741 169.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.9 mttp -69.97 -32.61 70.91 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.723 -1.236 . . . . 3.54 112.749 172.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.05 -53.07 55.71 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.261 1.025 . . . . 0.89000000000000001 111.091 170.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.4 mt -55.31 -43.18 74.64 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.35 1.46 . . . . 1.4399999999999999 111.729 173.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 95.7 m -59.14 -40.95 87.08 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 117.611 -1.185 . . . . 1.6100000000000001 111.678 173.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 29.0 m -66.13 -39.45 89.89 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.397 1.079 . . . . 1.25 110.756 176.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 61.1 mtp -64.19 -40.42 96.06 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.89 1.276 . . . . 3.1299999999999999 111.691 174.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.35 -33.19 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 123.493 0.717 . . . . 1.8999999999999999 112.291 167.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 94.0 m -71.15 -58.21 3.77 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 117.677 -1.154 . . . . 1.02 110.464 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.3 p -65.09 -31.49 72.73 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 118.164 -0.922 . . . . 2.0600000000000001 110.271 178.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -67.32 -64.56 0.83 Allowed 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 119.288 -0.965 . . . . 1.9399999999999999 110.508 176.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.47 -39.62 84.3 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 120.12 1.327 . . . . 2.2799999999999998 112.462 -176.243 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -60.1 -51.45 69.55 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.766 -1.209 . . . . 3.8799999999999999 112.345 176.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -78.24 -24.34 47.01 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.002 -1.061 . . . . 2.0499999999999998 112.185 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.6 t -68.67 -19.04 64.38 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 126.466 1.906 . . . . 1.8999999999999999 112.715 173.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.84 2.47 87.18 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 126.057 1.789 . . . . 1.3 115.393 167.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.34 -26.01 61.76 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 120.415 2.108 . . . . 4.25 113.192 176.201 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -167.21 177.94 5.89 Favored 'General case' 0 C--O 1.245 0.848 0 C-N-CA 125.776 1.63 . . . . 4.1299999999999999 111.129 -172.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.77 -141.5 44.73 Favored Glycine 0 N--CA 1.468 0.831 0 C-N-CA 124.216 0.912 . . . . 1.8799999999999999 111.951 170.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.1 t -73.97 157.33 36.38 Favored 'General case' 0 CA--C 1.551 1.013 0 O-C-N 121.558 -0.966 . . . . 3.21 111.979 159.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -71.48 -12.81 61.58 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 127.009 2.124 . . . . 4.9299999999999997 112.952 173.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.8 mt -101.57 -11.5 19.2 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.126 1.37 . . . . 3.5899999999999999 112.96 176.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.9 p -111.04 144.22 40.5 Favored 'General case' 0 C--O 1.248 1.002 0 C-N-CA 125.089 1.355 . . . . 0.97999999999999998 112.86 176.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.8 mt -95.08 104.94 16.82 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.324 1.05 . . . . 1.6399999999999999 109.396 161.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.6 p -57.33 162.09 2.97 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 120.684 -1.26 . . . . 2.48 111.223 168.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -50.55 -25.42 4.07 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 120.133 -1.604 . . . . 3.1499999999999999 114.267 174.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.87 -45.42 18.68 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.105 0.962 . . . . 4.5800000000000001 113.212 171.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -62.48 -41.64 98.93 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.888 0.875 . . . . 1.4299999999999999 110.947 175.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.2 tp -66.14 -46.65 76.74 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.176 0.591 . . . . 1.8799999999999999 110.09 176.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 15.4 ttmt -61.81 -46.14 90.79 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.054 0.843 . . . . 3.6200000000000001 111.803 178.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -45.05 -59.87 2.38 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 117.406 -1.283 . . . . 3.6299999999999999 111.84 165.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.0 -54.14 49.54 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.974 1.261 . . . . 1.73 112.407 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.7 mt -56.25 -42.66 74.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 119.592 1.087 . . . . 1.04 109.509 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 26.1 mmmt -64.87 -14.41 59.48 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 113.524 0.935 . . . . 3.6099999999999999 113.524 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 32.2 mmtm -102.22 -38.28 7.74 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.988 1.267 . . . . 3.6699999999999999 113.726 169.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -82.99 -31.62 27.41 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.534 1.534 . . . . 3.6800000000000002 112.472 -166.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -117.34 94.71 4.66 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.574 1.149 . . . . 2.6499999999999999 109.19 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.4 t -79.11 -6.25 56.02 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 115.048 1.499 . . . . 3.3700000000000001 115.048 -166.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.31 33.77 0.08 Allowed 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 117.65 2.463 . . . . 3.8199999999999998 117.65 -161.604 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.78 -46.88 2.69 Favored Glycine 0 N--CA 1.477 1.383 0 C-N-CA 125.469 1.509 . . . . 3.04 115.407 166.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.427 ' CD ' ' HZ3' ' A' ' 48' ' ' LYS . 38.0 mm-40 -86.07 7.23 25.5 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.357 1.243 . . . . 5.2400000000000002 114.357 -176.046 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.7 66.2 0.73 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 124.677 2.179 . . . . 2.8700000000000001 111.001 163.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.427 ' HZ3' ' CD ' ' A' ' 46' ' ' GLU . 60.7 mttp -101.4 165.55 11.2 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 128.363 2.665 . . . . 4.3499999999999996 110.839 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -62.8 -45.47 92.48 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 115.193 1.553 . . . . 3.7400000000000002 115.193 -160.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.3 t -73.83 -28.67 61.73 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 117.91 -1.043 . . . . 2.8700000000000001 113.3 172.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.77 -38.69 79.04 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.548 1.522 . . . . 2.2999999999999998 110.61 170.256 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 65.3 mt -81.85 -39.22 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 124.875 1.27 . . . . 1.3400000000000001 112.73 -176.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -76.71 -26.87 55.17 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 118.99 0.814 . . . . 3.3500000000000001 112.787 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -78.6 -38.69 39.39 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.116 0.871 . . . . 2.25 112.208 168.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 39.3 tp -55.03 -54.06 47.91 Favored 'General case' 0 C--N 1.344 0.362 0 O-C-N 121.462 -0.774 . . . . 1.72 109.964 168.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 8.9 tpt -48.61 -49.45 36.96 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.706 2.002 . . . . 1.8300000000000001 111.913 176.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.58 -25.6 60.24 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.037 1.335 . . . . 3.77 113.66 176.031 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.7 t -96.3 -25.87 15.6 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.941 1.297 . . . . 1.9099999999999999 113.788 177.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.1 mt -73.37 -41.93 62.8 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.154 0.981 . . . . 2.0299999999999998 111.565 173.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -69.32 149.74 48.11 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.495 0.718 . . . . 1.6899999999999999 112.053 176.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.19 -10.14 19.86 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 120.954 -1.091 . . . . 3.1499999999999999 113.791 -176.309 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -148.52 -10.84 0.35 Allowed 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.962 1.467 . . . . 2.6099999999999999 114.962 -165.223 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.0 t 79.66 18.95 0.7 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.625 2.37 . . . . 3.1800000000000002 113.315 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.3 p30 -65.05 -24.3 67.43 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.331 1.452 . . . . 2.2400000000000002 110.928 -178.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 63.84 22.23 12.95 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 130.701 3.6 . . . . 4.3899999999999997 114.211 -172.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -115.78 121.35 42.18 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 128.907 2.883 . . . . 2.6099999999999999 107.304 164.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 14.1 mm -93.03 105.02 16.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 124.998 1.319 . . . . 1.03 109.037 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.23 158.13 36.41 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.894 2.078 . . . . 2.52 111.379 167.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -54.82 -34.0 62.27 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.982 -1.074 . . . . 1.8999999999999999 113.704 -175.246 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm -78.88 -27.31 43.99 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 120.781 -1.199 . . . . 2.96 112.347 177.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -64.82 -53.02 53.42 Favored 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 108.307 -0.997 . . . . 1.77 108.307 163.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -55.57 -31.38 62.14 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 119.866 -1.771 . . . . 2.0600000000000001 114.349 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.53 -24.04 63.34 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 119.543 -1.973 . . . . 1.6299999999999999 114.28 172.046 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 49.0 t -63.81 -41.33 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 CA-C-N 119.067 0.849 . . . . 1.8600000000000001 110.153 172.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -61.26 -51.83 67.29 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.036 0.934 . . . . 1.9199999999999999 111.116 176.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.8 mt -59.3 -38.11 79.42 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.894 1.278 . . . . 2.3199999999999998 112.204 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 83.2 m -59.87 -55.79 29.75 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.803 0.841 . . . . 0.95999999999999996 110.545 175.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 75.0 mtm -61.44 -40.27 93.85 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 111.951 0.352 . . . . 1.3700000000000001 111.951 -176.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 89.0 mt -69.15 -37.0 78.02 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.281 0.845 . . . . 1.6100000000000001 113.281 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 5.7 t -73.94 -31.53 63.09 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.134 0.879 . . . . 1.78 112.979 176.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 49.1 mtp -67.65 -42.76 81.72 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.319 0.509 . . . . 1.8300000000000001 111.652 167.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.07 -41.1 91.18 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.071 -1.018 . . . . 1.03 112.621 -175.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -68.4 -26.94 65.8 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 113.12 0.785 . . . . 2.3700000000000001 113.12 174.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -67.88 -43.5 79.23 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 120.231 1.378 . . . . 1.6899999999999999 112.734 169.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -71.26 -28.8 64.41 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.731 0.813 . . . . 4.1100000000000003 110.973 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.46 -51.01 70.48 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.855 1.262 . . . . 1.8600000000000001 111.652 164.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 35.3 t80 -60.14 -33.43 72.15 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.104 1.362 . . . . 2.3500000000000001 112.316 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 41.1 mt -68.02 -20.28 64.98 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.859 1.264 . . . . 1.54 113.87 173.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.507 ' CD ' ' HZ2' ' A' ' 92' ' ' LYS . 25.1 mm-40 -101.11 -9.95 20.9 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.632 1.173 . . . . 2.6400000000000001 114.09 176.393 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -109.75 -47.41 3.36 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.163 1.385 . . . . 2.7200000000000002 113.079 -173.068 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -82.6 10.05 8.19 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.912 0.885 . . . . 3.02 113.217 -179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.507 ' HZ2' ' CD ' ' A' ' 89' ' ' GLU . 15.0 pttm . . . . . 0 C--O 1.249 1.072 0 CA-C-O 115.482 -2.199 . . . . 3.4500000000000002 116.274 -174.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.822 0 N-CA-C 107.624 -1.25 . . . . 6.1900000000000004 107.624 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -144.44 140.36 28.92 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 125.84 1.656 . . . . 4.7699999999999996 106.818 -169.293 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 59.1 p -74.6 166.69 42.98 Favored Pre-proline 0 N--CA 1.473 0.71 0 C-N-CA 124.971 1.308 . . . . 1.97 113.519 -167.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.69 -21.51 69.72 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.579 2.186 . . . . 1.45 112.967 167.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.57 -44.11 36.03 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 119.397 0.999 . . . . 2.5299999999999998 110.842 173.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -58.93 -35.07 72.47 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.398 -0.814 . . . . 3.6299999999999999 111.026 170.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -74.94 -27.95 60.4 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 119.869 -1.769 . . . . 3.9199999999999999 113.72 173.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.8 -50.66 61.93 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.373 1.069 . . . . 0.91000000000000003 110.8 169.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 48.0 mt -56.83 -39.73 74.75 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.282 1.433 . . . . 1.53 111.898 169.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 88.0 m -62.39 -43.27 99.22 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 117.918 -1.039 . . . . 1.6599999999999999 111.033 173.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 62.0 m -57.74 -47.85 81.29 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.583 1.083 . . . . 1.3200000000000001 109.896 173.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 61.9 mtp -59.2 -43.41 92.22 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.086 1.354 . . . . 2.9199999999999999 112.826 175.094 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 32.2 t -64.76 -32.59 58.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 O-C-N 121.009 -1.057 . . . . 1.8200000000000001 112.045 173.239 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 89.3 m -74.49 -45.23 47.37 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.336 1.455 . . . . 0.87 112.16 -178.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 22.4 p -70.64 -37.86 73.8 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.293 0.637 . . . . 1.53 109.536 173.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -62.66 -66.59 0.52 Allowed 'General case' 0 C--O 1.219 -0.53 0 CA-C-O 117.383 -1.294 . . . . 1.95 109.864 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -59.06 -29.5 67.36 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 121.544 1.975 . . . . 2.4500000000000002 112.653 -173.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -62.17 -56.52 17.9 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.976 -1.078 . . . . 3.6099999999999999 113.455 173.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -81.24 -34.15 32.32 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.422 -0.799 . . . . 2.3500000000000001 112.979 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.5 t -64.76 -20.61 66.45 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 127.535 2.334 . . . . 2.1699999999999999 112.032 174.24 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.32 -5.44 79.56 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 127.307 2.384 . . . . 1.8600000000000001 116.133 170.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.52 -4.53 50.89 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-N 119.709 1.754 . . . . 3.2599999999999998 114.596 -163.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -165.35 161.6 19.11 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.393 1.477 . . . . 3.6699999999999999 111.843 174.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.13 -131.42 52.04 Favored Glycine 0 N--CA 1.472 1.082 0 O-C-N 120.985 -1.072 . . . . 2.2400000000000002 111.027 173.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 18.9 m -80.88 159.02 25.13 Favored 'General case' 0 CA--C 1.546 0.793 0 O-C-N 121.699 -0.883 . . . . 3.77 111.184 166.206 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -93.35 -3.3 53.64 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 116.557 2.058 . . . . 6.21 116.557 -167.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 22.9 tp -112.28 16.21 20.1 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.503 1.521 . . . . 3.29 110.625 178.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 23.3 p -148.78 133.1 17.48 Favored 'General case' 0 C--O 1.242 0.702 0 C-N-CA 127.029 2.132 . . . . 1.21 109.545 -161.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 5.7 mt -98.57 96.23 7.82 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.058 1.343 . . . . 1.8899999999999999 112.539 179.115 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 14.9 t -43.25 152.92 0.11 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.867 2.067 . . . . 2.1400000000000001 112.764 160.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.7 ttp85 -43.13 -27.96 0.25 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.779 1.632 . . . . 3.2999999999999998 113.323 171.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.6 -45.21 11.26 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.577 1.325 . . . . 4.4100000000000001 114.577 172.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -58.73 -38.22 77.87 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.686 1.194 . . . . 1.8999999999999999 111.47 174.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 29.4 tp -72.15 -44.57 62.89 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.862 1.265 . . . . 1.8899999999999999 110.603 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.3 ttmm -67.58 -36.28 80.6 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 120.707 -1.246 . . . . 3.0800000000000001 112.396 -179.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -52.2 -68.01 0.2 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.578 1.551 . . . . 3.4100000000000001 111.619 157.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 tt -52.23 -49.41 64.03 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.67 1.188 . . . . 1.9099999999999999 112.875 -174.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 48.4 mt -58.62 -51.33 73.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 108.461 -0.94 . . . . 1.1399999999999999 108.461 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -72.14 -9.11 57.98 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 112.841 0.682 . . . . 3.7599999999999998 112.841 -175.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -91.28 -37.22 13.42 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.707 1.603 . . . . 3.5099999999999998 113.664 168.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -88.89 -27.24 21.13 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.219 1.408 . . . . 3.9399999999999999 113.885 -175.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -117.46 108.26 15.32 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.588 1.155 . . . . 2.2000000000000002 110.631 -174.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 8.0 t -79.23 3.92 16.49 Favored 'General case' 0 CA--C 1.555 1.15 0 N-CA-C 115.064 1.505 . . . . 3.5499999999999998 115.064 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -61.88 -42.83 99.53 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.83 2.052 . . . . 2.71 115.439 -161.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.23 -23.79 34.13 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 124.672 1.13 . . . . 3.1499999999999999 114.49 -178.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -86.97 9.44 19.45 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 118.743 1.272 . . . . 5.1299999999999999 113.711 167.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.76 57.91 2.66 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 123.896 1.807 . . . . 2.8300000000000001 111.096 165.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -89.56 161.47 16.17 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.733 2.413 . . . . 3.8500000000000001 112.334 -177.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -53.2 -53.17 54.61 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 115.902 1.816 . . . . 3.27 115.902 -166.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 5.2 m -73.01 -28.26 62.26 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 119.767 1.167 . . . . 2.6800000000000002 114.002 178.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 1.2 t -61.72 -42.05 98.44 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.312 0.645 . . . . 2.54 109.779 169.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 47.7 mt -73.82 -35.06 42.06 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.191 0 C-N-CA 124.353 1.061 . . . . 1.45 112.61 176.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.66 -35.67 72.99 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.197 0.908 . . . . 2.8100000000000001 111.408 178.005 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -69.47 -46.47 66.58 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 119.199 0.909 . . . . 2.5099999999999998 111.425 167.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 51.7 tp -55.88 -49.36 73.58 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.151 0.98 . . . . 2.04 110.628 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.22 -57.8 9.24 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.662 1.185 . . . . 2.1299999999999999 110.12 172.14 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -25.76 44.87 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.836 1.254 . . . . 3.4500000000000002 113.83 176.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 13.8 m -88.67 -27.42 21.28 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.639 1.976 . . . . 2.75 113.028 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 66.6 mt -78.72 -39.25 36.9 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 125.705 1.602 . . . . 2.02 111.096 174.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -76.27 73.1 3.07 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.872 2.069 . . . . 1.6899999999999999 112.808 -171.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.36 -30.71 0.88 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 125.927 1.691 . . . . 3.2400000000000002 114.614 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -112.95 -4.28 13.94 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.779 2.431 . . . . 1.9099999999999999 114.083 -168.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 8.5 t 65.31 14.94 9.75 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 115.322 1.601 . . . . 2.4500000000000002 115.322 173.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -79.74 -15.83 56.76 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.335 1.454 . . . . 2.3900000000000001 111.651 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 68.0 14.44 9.35 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 128.841 2.857 . . . . 5.0 114.371 174.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -101.21 153.36 19.68 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-O 124.169 1.938 . . . . 2.7599999999999998 110.61 141.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 29.9 mm -99.62 101.41 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 127.477 2.311 . . . . 1.23 108.296 171.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.82 162.52 3.14 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.404 1.482 . . . . 2.5099999999999998 112.143 162.753 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.61 -36.76 67.3 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.05 -1.031 . . . . 2.21 113.083 -177.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -80.2 -17.66 51.73 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 120.939 -1.101 . . . . 3.6099999999999999 112.26 178.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -73.92 -44.94 53.46 Favored 'General case' 0 CA--C 1.552 1.046 0 O-C-N 121.156 -0.965 . . . . 1.8 109.233 163.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -62.88 -30.98 71.93 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.871 1.669 . . . . 2.0699999999999998 112.969 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 85.9 p -63.68 -24.39 67.76 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 119.973 -1.705 . . . . 1.96 113.433 172.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 24.4 t -67.26 -36.13 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 CA-C-N 119.561 1.073 . . . . 1.55 110.984 174.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -63.22 -53.13 57.97 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.836 0.854 . . . . 1.72 110.916 173.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 83.7 mt -57.74 -36.54 72.22 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.217 1.007 . . . . 1.5700000000000001 111.945 177.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 93.1 m -62.4 -54.06 45.83 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.894 1.278 . . . . 0.81000000000000005 111.538 175.239 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.2 mtm -58.41 -39.42 79.68 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 118.164 0.438 . . . . 1.45 111.662 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 94.3 mt -69.92 -45.25 67.95 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.669 -0.682 . . . . 1.6799999999999999 112.297 177.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 87.1 m -64.24 -32.46 74.06 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.672 1.124 . . . . 1.8700000000000001 113.205 176.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 52.6 mtp -71.24 -38.86 71.94 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.977 0.808 . . . . 2.1200000000000001 112.522 168.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.9 -36.78 75.68 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.084 1.311 . . . . 0.95999999999999996 112.955 -177.283 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -75.35 -26.15 58.34 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.787 -0.571 . . . . 2.6099999999999999 111.824 176.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -66.08 -42.99 88.63 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.793 0.837 . . . . 1.9199999999999999 112.267 166.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -71.17 -26.99 63.21 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.142 0.577 . . . . 3.7200000000000002 111.408 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -54.76 35.57 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.511 1.524 . . . . 2.21 112.266 162.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -59.48 -27.73 66.39 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.592 1.957 . . . . 2.1099999999999999 112.556 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 16.8 mt -72.38 -11.48 60.71 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 126.163 1.785 . . . . 1.8300000000000001 114.446 176.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -96.38 -3.93 42.8 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 113.625 0.972 . . . . 3.8999999999999999 113.625 170.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -117.43 -65.1 1.22 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.391 1.476 . . . . 3.1899999999999999 110.919 -178.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -87.37 40.47 0.93 Allowed 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 126.932 2.093 . . . . 4.7300000000000004 112.45 173.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp . . . . . 0 C--O 1.251 1.141 0 C-N-CA 129.558 3.143 . . . . 8.0199999999999996 116.493 -169.069 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.6 mtt . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 108.351 -0.981 . . . . 5.7599999999999998 108.351 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -96.58 -26.49 15.22 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 124.223 0.952 . . . . 5.0499999999999998 112.372 -149.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.475 ' HB ' ' H ' ' A' ' 5' ' ' LEU . 40.7 p -158.7 161.59 28.09 Favored Pre-proline 0 CA--C 1.534 0.338 0 C-N-CA 127.527 2.331 . . . . 2.3799999999999999 109.968 -176.418 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -70.74 -8.71 24.23 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.708 2.272 . . . . 1.8600000000000001 112.188 157.462 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.475 ' H ' ' HB ' ' A' ' 3' ' ' THR . 0.3 OUTLIER -73.32 -47.4 42.94 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.751 2.02 . . . . 2.6099999999999999 110.247 179.963 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.32 -40.61 71.37 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.066 0.848 . . . . 3.3399999999999999 111.199 167.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.9 mtpt -67.87 -28.15 67.29 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 119.829 -1.794 . . . . 5.6699999999999999 114.113 173.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.83 -50.6 19.67 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.471 1.108 . . . . 1.03 110.653 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.0 mt -56.04 -50.6 70.48 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.862 1.265 . . . . 1.78 110.497 175.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 32.5 p -65.89 -39.65 90.85 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 116.845 -1.55 . . . . 2.2400000000000002 112.398 178.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 50.0 m -57.55 -45.75 84.75 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 120.603 1.547 . . . . 1.5 109.949 172.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 12.8 ttp -66.85 -45.11 79.21 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.444 1.098 . . . . 2.9500000000000002 112.126 -175.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -60.13 -41.62 87.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 124.799 1.24 . . . . 2.2599999999999998 112.023 171.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 90.4 m -61.43 -52.05 66.17 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.218 1.007 . . . . 1.03 111.333 177.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.46 -36.93 67.1 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 119.148 -0.453 . . . . 2.1200000000000001 111.302 170.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -64.02 -37.51 87.7 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 120.81 -0.356 . . . . 2.0499999999999998 111.708 -177.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.3 m-70 -62.29 -50.26 72.37 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.098 0.863 . . . . 4.5300000000000002 111.718 170.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.424 ' HE2' ' CE1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -60.75 -38.65 85.93 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.423 0.689 . . . . 6.75 112.842 -176.719 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.424 ' CE1' ' HE2' ' A' ' 18' ' ' LYS . 49.2 m-85 -76.58 -43.87 36.94 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.79 0.836 . . . . 3.21 111.303 172.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.0 t -64.43 -38.73 92.06 Favored 'General case' 0 C--O 1.241 0.635 0 O-C-N 119.936 -1.727 . . . . 2.2000000000000002 113.244 -176.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.36 3.59 86.49 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 126.178 1.847 . . . . 1.6899999999999999 115.325 -175.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.09 -43.23 61.03 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.464 1.505 . . . . 5.2599999999999998 113.958 175.264 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 178.29 -138.3 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 129.28 3.032 . . . . 3.77 107.116 -173.037 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -11.6 99.06 0.01 OUTLIER Glycine 0 N--CA 1.475 1.263 0 C-N-CA 127.939 2.685 . . . . 3.7599999999999998 114.284 -174.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.2 t 57.4 163.4 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 116.357 1.984 . . . . 2.7200000000000002 116.357 175.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -137.68 134.71 35.72 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.429 1.891 . . . . 4.9900000000000002 110.532 -171.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 92.9 mt 92.34 -9.08 0.2 Allowed 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 130.135 3.374 . . . . 3.5800000000000001 111.042 -158.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.1 p -132.49 152.16 51.64 Favored 'General case' 0 C--O 1.249 1.035 0 C-N-CA 127.68 2.392 . . . . 1.6699999999999999 114.021 -176.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 10.8 mt -104.62 103.63 13.32 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.163 1.385 . . . . 1.9399999999999999 109.638 172.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.4 t -72.88 150.92 42.22 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 120.395 -1.441 . . . . 2.27 111.017 168.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -40.61 -45.31 2.3 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 116.444 2.016 . . . . 3.2799999999999998 116.444 -165.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.45 -31.45 69.77 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.178 -1.576 . . . . 4.2000000000000002 114.022 177.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -68.52 -47.07 67.9 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.441 1.897 . . . . 2.0299999999999998 109.812 173.169 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.1 tp -59.8 -37.85 80.28 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.148 0.579 . . . . 1.98 111.117 175.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.1 ttmt -68.33 -42.63 79.03 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 121.654 -0.654 . . . . 3.2599999999999998 111.845 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -51.24 -44.0 61.61 Favored 'General case' 0 CA--C 1.55 0.956 0 CA-C-N 118.405 0.548 . . . . 5.4100000000000001 112.244 164.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.2 tt -63.23 -64.1 1.0 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.013 0.925 . . . . 2.1200000000000001 111.324 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.3 mt -56.94 -50.08 77.01 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 N-CA-C 108.851 -0.796 . . . . 0.77000000000000002 108.851 -175.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.3 tttt -66.22 -13.17 59.89 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 119.708 1.14 . . . . 4.0 113.941 -176.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -95.88 -32.89 12.43 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 117.914 -1.041 . . . . 3.0699999999999998 113.809 168.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -80.82 -46.82 14.75 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.963 1.705 . . . . 4.2999999999999998 111.554 -178.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 26.6 mt -147.44 80.8 1.51 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.157 1.783 . . . . 3.0299999999999998 110.409 -177.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 43.9 t -91.84 -51.01 5.43 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 120.398 -1.439 . . . . 5.54 111.969 169.063 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.6 mp 52.53 -143.6 0.69 Allowed 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.94 1.296 . . . . 4.5999999999999996 108.17 -165.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -95.64 10.8 68.72 Favored Glycine 0 CA--C 1.533 1.199 0 O-C-N 121.263 -0.898 . . . . 3.8999999999999999 112.312 157.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -107.32 -55.52 2.33 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 118.166 0.983 . . . . 5.5800000000000001 112.812 -157.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 42.7 tpp -76.59 88.01 3.29 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.337 1.455 . . . . 2.73 110.733 -171.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.8 mttp -87.11 166.97 14.6 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.569 1.548 . . . . 3.96 112.737 -175.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -47.61 -53.17 15.49 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 115.593 1.701 . . . . 4.3700000000000001 115.593 -169.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.3 m -73.98 -26.58 60.54 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.139 0.792 . . . . 3.52 113.139 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.8 m -71.27 -29.79 65.5 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 118.819 0.736 . . . . 2.54 110.829 174.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.4 mt -68.55 -47.78 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.214 1.005 . . . . 1.51 110.676 169.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -71.03 -30.92 67.26 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 112.787 0.662 . . . . 4.0499999999999998 112.787 -176.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -73.9 -37.75 64.57 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.355 -0.841 . . . . 3.1200000000000001 112.229 170.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 64.8 tp -60.84 -40.32 92.37 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-O 117.738 -1.125 . . . . 2.02 111.109 169.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -57.31 -51.51 69.08 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 120.278 1.399 . . . . 1.8100000000000001 110.213 176.431 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 tttm -50.66 -30.39 13.44 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.228 1.411 . . . . 3.3100000000000001 113.673 168.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.35 -32.36 22.49 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.515 1.126 . . . . 2.0699999999999998 112.205 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.7 mt -67.27 -41.54 85.35 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.091 0.956 . . . . 2.3399999999999999 110.622 173.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -94.47 80.02 3.88 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.93 2.092 . . . . 1.6399999999999999 113.297 -167.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -58.77 -21.6 56.16 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 115.044 1.498 . . . . 3.6699999999999999 115.044 -166.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -106.69 -5.73 18.38 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.201 1.4 . . . . 2.3100000000000001 114.374 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.5 t 58.61 31.16 20.79 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.915 1.286 . . . . 2.6499999999999999 114.215 -175.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.6 p30 -69.68 -14.64 62.91 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.578 1.151 . . . . 2.6000000000000001 111.791 175.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 68.02 8.5 6.54 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 129.861 3.264 . . . . 4.5300000000000002 114.39 -178.316 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -112.56 120.13 40.52 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 127.092 2.157 . . . . 3.1299999999999999 107.554 172.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 15.4 mm -90.23 101.28 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 123.466 0.707 . . . . 1.1000000000000001 109.256 174.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -48.35 155.42 0.51 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.24 1.016 . . . . 3.5899999999999999 111.955 161.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.459 ' CZ ' ' HB3' ' B' ' 80' ' ' CYS . 0.1 OUTLIER -51.43 -41.85 61.11 Favored 'General case' 0 CA--C 1.548 0.865 0 O-C-N 120.634 -1.291 . . . . 3.1499999999999999 110.982 158.122 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.8 pttm -66.86 -21.08 66.02 Favored 'General case' 0 CA--C 1.552 1.023 0 O-C-N 120.035 -1.666 . . . . 3.8300000000000001 114.781 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -85.39 -48.78 8.69 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.147 1.379 . . . . 2.2799999999999998 110.834 170.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -55.89 -33.8 64.96 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 126.029 1.732 . . . . 2.0299999999999998 112.43 174.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.3 t -58.94 -29.1 66.87 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.542 -1.349 . . . . 2.27 113.333 170.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 19.2 t -69.34 -36.86 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 O-C-N 120.563 -1.335 . . . . 2.1000000000000001 110.407 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.405 ' CZ ' HD11 ' A' ' 79' ' ' LEU . 52.5 t80 -63.32 -51.72 64.87 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.525 1.13 . . . . 2.5299999999999998 111.722 169.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 65.9 mt -58.01 -33.77 69.31 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 118.512 0.596 . . . . 1.7 112.388 176.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 50.0 m -62.41 -54.73 35.95 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.642 1.177 . . . . 0.78000000000000003 110.344 171.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 45.6 mtp -53.27 -45.99 69.08 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.401 1.08 . . . . 1.6499999999999999 112.028 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.405 HD11 ' CZ ' ' A' ' 75' ' ' PHE . 88.8 mt -66.83 -48.83 67.68 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 123.898 0.879 . . . . 1.29 112.211 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 9.0 t -66.76 -34.4 77.74 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.695 -0.628 . . . . 1.6499999999999999 112.406 -178.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 89.9 mtp -64.61 -39.1 93.11 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.289 0.636 . . . . 1.55 112.258 168.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.32 -34.68 78.52 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.669 1.122 . . . . 0.70999999999999996 112.743 177.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -63.42 -23.18 67.29 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 113.357 0.873 . . . . 2.54 113.357 170.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.65 -40.45 88.69 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 119.923 1.238 . . . . 2.25 112.472 170.081 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -71.58 -39.24 70.71 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.681 0.792 . . . . 3.1400000000000001 110.825 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.2 -43.35 67.12 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.25 1.42 . . . . 1.98 112.287 170.402 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -67.76 -27.46 66.79 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.234 1.414 . . . . 2.5800000000000001 112.971 177.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.3 mt -74.31 -15.49 60.96 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 113.454 0.909 . . . . 2.0800000000000001 113.454 172.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.517 ' CD ' ' HZ2' ' A' ' 92' ' ' LYS . 13.0 mm-40 -95.07 -4.84 45.64 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.873 1.269 . . . . 4.5300000000000002 114.394 173.034 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -97.95 -51.18 4.14 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.131 1.372 . . . . 3.77 111.805 175.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -77.58 9.6 3.24 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.036 1.334 . . . . 2.7400000000000002 114.597 -174.155 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.517 ' HZ2' ' CD ' ' A' ' 89' ' ' GLU . 15.2 pttm . . . . . 0 C--O 1.25 1.122 0 CA-C-O 115.443 -2.218 . . . . 4.5 116.54 -174.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 108.369 -0.974 . . . . 5.5099999999999998 108.369 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.74 154.83 37.92 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 126.748 2.019 . . . . 6.04 110.521 172.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 74.2 p -67.53 164.2 40.72 Favored Pre-proline 0 N--CA 1.466 0.37 0 C-N-CA 126.602 1.961 . . . . 2.02 111.601 177.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.46 -21.95 69.9 Favored 'Trans proline' 0 CA--C 1.537 0.65 0 C-N-CA 121.987 1.791 . . . . 1.3999999999999999 113.235 170.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -83.89 -42.35 16.46 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.757 1.162 . . . . 3.3599999999999999 112.417 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -59.81 -43.18 94.63 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 118.918 0.781 . . . . 4.1799999999999997 110.214 168.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -62.76 -39.29 93.71 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 120.855 -1.153 . . . . 4.0999999999999996 112.471 171.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.97 -52.68 62.06 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.44 1.018 . . . . 0.93000000000000005 111.23 176.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 37.6 mt -57.38 -39.04 75.22 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.785 1.234 . . . . 1.55 112.231 176.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 94.8 m -61.75 -51.98 66.1 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.451 0.7 . . . . 1.6299999999999999 110.793 171.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 86.5 m -55.54 -36.22 66.53 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.396 1.478 . . . . 1.48 112.28 -179.023 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 75.1 mmm -55.63 -51.98 65.37 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 122.926 0.49 . . . . 3.2799999999999998 111.943 170.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.17 -26.07 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.158 0.89 . . . . 2.52 112.842 -178.004 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 25.4 m -56.67 -56.49 20.75 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.078 1.351 . . . . 0.77000000000000002 110.844 169.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.98 -35.94 77.29 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 118.08 -0.962 . . . . 2.7200000000000002 109.482 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -59.73 -49.25 78.45 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 118.448 -0.787 . . . . 2.2000000000000002 111.972 177.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 15.8 m80 -56.82 -48.69 77.44 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 120.012 1.278 . . . . 2.0600000000000001 111.544 173.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -26.62 65.93 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 124.144 0.978 . . . . 5.8099999999999996 113.082 178.216 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -87.96 -30.24 20.18 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.6 -1.313 . . . . 3.2599999999999998 113.281 168.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 42.2 p -87.24 -36.99 17.63 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 120.914 1.688 . . . . 1.77 114.678 -162.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.45 3.15 85.85 Favored Glycine 0 CA--C 1.533 1.166 0 O-C-N 119.714 -1.866 . . . . 1.55 112.922 169.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -43.23 91.68 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 119.042 1.421 . . . . 4.7000000000000002 111.81 -172.473 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -138.27 157.78 45.59 Favored 'General case' 0 C--O 1.249 1.073 0 C-N-CA 127.237 2.215 . . . . 4.5599999999999996 111.153 173.025 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.88 7.1 10.92 Favored Glycine 0 CA--C 1.534 1.233 0 CA-C-N 114.703 -1.135 . . . . 2.2999999999999998 113.25 -167.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 53.9 m 48.1 -145.51 0.32 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.044 1.737 . . . . 6.96 111.464 -161.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 32.3 mtpt 71.53 -163.94 0.13 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 127.324 2.25 . . . . 11.51 111.938 169.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 5.4 mp -106.68 14.07 27.34 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.655 1.582 . . . . 4.5599999999999996 111.63 168.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 74.7 p -108.72 149.44 29.0 Favored 'General case' 0 C--O 1.248 1.023 0 C-N-CA 126.223 1.809 . . . . 1.28 113.402 -174.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -115.13 90.62 3.38 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.712 2.405 . . . . 1.98 109.45 -157.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.2 m -81.53 160.58 23.86 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.324 1.45 . . . . 2.0800000000000001 113.304 -173.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -40.44 -41.26 1.37 Allowed 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 116.41 2.004 . . . . 3.5600000000000001 116.41 -175.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? -78.63 -43.04 27.22 Favored 'General case' 0 CA--C 1.546 0.827 0 O-C-N 119.971 -1.706 . . . . 6.4199999999999999 112.034 175.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -53.7 -44.16 69.56 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.364 0.983 . . . . 1.72 109.6 172.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.43 -49.33 77.27 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.889 2.076 . . . . 2.2200000000000002 112.029 176.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -52.39 -47.1 66.42 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 121.093 -1.005 . . . . 2.8999999999999999 111.795 169.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -68.67 -24.21 64.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.108 1.763 . . . . 3.4199999999999999 114.381 177.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.5 tt -71.58 -59.32 2.82 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.001 1.32 . . . . 2.1000000000000001 108.912 172.437 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 78.8 mt -53.76 -58.71 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.386 0.674 . . . . 1.24 110.419 -176.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -9.15 8.56 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 114.07 1.137 . . . . 5.2199999999999998 114.07 -172.595 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 40' ' ' LYS . . . . . 0.434 ' HA ' ' HE2' ' B' ' 40' ' ' LYS . 0.0 OUTLIER -114.29 -40.79 3.59 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 125.942 1.697 . . . . 6.25 110.836 -177.496 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 41' ' ' GLU . . . . . 0.448 ' HA ' HG21 ' A' ' 3' ' ' THR . 80.9 mt-10 -68.04 -49.9 58.58 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.187 1.358 . . . . 3.9199999999999999 110.839 176.373 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -115.21 178.24 4.36 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.979 2.512 . . . . 2.8300000000000001 111.93 -171.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.1 m -138.55 -43.35 0.49 Allowed 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 114.774 1.398 . . . . 4.3700000000000001 114.774 165.116 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 7.4 mp 50.92 -112.73 0.65 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.626 1.571 . . . . 5.9000000000000004 111.759 -176.255 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -157.99 -58.12 0.01 OUTLIER Glycine 0 N--CA 1.471 1.023 0 CA-C-N 119.067 0.848 . . . . 4.1100000000000003 113.934 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.71 -23.43 66.11 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 117.45 0.625 . . . . 6.7300000000000004 112.018 174.279 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 2.0 ttm -58.5 104.88 0.24 Allowed 'General case' 0 C--N 1.338 0.105 0 C-N-CA 124.988 1.315 . . . . 2.6600000000000001 113.538 -157.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -163.62 176.7 9.4 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 128.122 2.569 . . . . 4.54 109.532 -171.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 33.7 tp10 -39.35 -58.9 1.14 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.912 1.685 . . . . 4.8399999999999999 113.639 -171.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 3.7 m -74.18 -4.88 38.55 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 116.439 2.014 . . . . 2.6299999999999999 116.439 -176.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 97.6 p -102.21 -28.72 12.13 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 120.979 1.718 . . . . 2.2200000000000002 112.5 161.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 54.0 mt -69.5 -39.77 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.645 1.578 . . . . 1.8300000000000001 112.826 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -72.33 -37.4 68.9 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.637 0.653 . . . . 2.9300000000000002 112.546 -177.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -67.92 -45.39 74.5 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.42 -0.8 . . . . 2.96 111.315 169.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.426 HD23 ' C ' ' B' ' 55' ' ' LEU . 4.7 tt -51.86 -51.37 57.17 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 117.588 -1.196 . . . . 2.1400000000000001 110.211 176.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.6 ppp? -64.72 -44.83 88.95 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.128 0.876 . . . . 2.02 112.021 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.54 -32.29 68.75 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.607 1.163 . . . . 3.8199999999999998 111.832 174.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 58.9 m -80.49 -16.92 53.14 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.969 1.307 . . . . 2.2999999999999998 113.663 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 17.7 mt -73.78 -40.32 63.53 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 119.124 0.874 . . . . 2.1299999999999999 110.442 165.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -76.32 149.27 37.07 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.696 1.199 . . . . 2.1499999999999999 114.2 -176.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.77 -2.73 9.28 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.756 1.222 . . . . 2.9500000000000002 112.997 171.283 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -103.86 -27.47 12.18 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.547 1.314 . . . . 2.0099999999999998 114.547 -168.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 16.4 t 69.5 30.62 4.0 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.246 1.819 . . . . 3.1699999999999999 111.9 -158.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 42.5 p30 -91.21 -24.92 19.75 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.376 1.071 . . . . 2.4100000000000001 112.629 -172.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 63.38 16.8 9.81 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 129.24 3.016 . . . . 5.9900000000000002 113.697 -171.007 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -116.8 122.23 43.84 Favored 'General case' 0 C--O 1.24 0.565 0 C-N-CA 129.173 2.989 . . . . 2.6800000000000002 108.826 176.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 25.1 mm -101.37 87.87 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 125.779 1.632 . . . . 1.3200000000000001 109.169 -177.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -62.55 165.98 5.74 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.986 0.914 . . . . 4.1500000000000004 111.442 171.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.71 -34.15 37.54 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 120.563 -1.336 . . . . 2.1200000000000001 113.262 -177.443 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -73.66 -17.5 61.14 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.486 1.514 . . . . 4.9900000000000002 114.825 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -93.03 -44.17 8.54 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.38 1.872 . . . . 1.8600000000000001 108.896 169.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -54.07 -36.97 63.7 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.409 1.484 . . . . 2.1000000000000001 113.152 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 90.8 p -68.7 -19.95 64.39 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 119.993 -1.692 . . . . 1.6399999999999999 114.243 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 46.9 t -61.61 -41.78 91.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 120.658 1.572 . . . . 1.47 109.724 172.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -61.4 -52.41 64.69 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.567 1.147 . . . . 1.71 110.397 175.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 76.7 mt -58.22 -33.3 69.17 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.379 0.672 . . . . 1.3 112.066 177.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 28.0 m -67.33 -51.91 46.69 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.401 1.08 . . . . 0.82999999999999996 110.974 175.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 70.7 mtp -55.13 -44.37 74.99 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.539 1.136 . . . . 1.96 111.312 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.91 -51.19 65.64 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.617 1.167 . . . . 2.9300000000000002 111.639 178.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 80' ' ' CYS . . . . . 0.459 ' HB3' ' CZ ' ' A' ' 69' ' ' PHE . 86.2 m -70.48 -33.58 71.41 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 114.065 1.135 . . . . 1.78 114.065 -175.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 94.0 mtp -68.06 -41.34 82.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 118.934 0.788 . . . . 2.0 111.256 171.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.98 -35.82 77.17 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 118.659 -0.686 . . . . 0.88 112.78 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -76.84 -29.79 56.04 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.729 1.149 . . . . 3.02 112.366 177.217 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -56.37 -47.67 78.4 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.213 0.915 . . . . 1.77 111.551 165.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -69.75 -35.38 74.92 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.183 0.993 . . . . 3.6200000000000001 112.01 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -60.67 -48.78 80.26 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.438 1.495 . . . . 2.9300000000000002 111.722 173.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -63.86 -34.95 79.09 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.049 0.94 . . . . 4.0700000000000003 111.214 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 83.4 mt -70.77 -11.72 61.12 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.658 0.985 . . . . 2.2599999999999998 113.658 175.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -99.06 -6.12 29.05 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.601 1.561 . . . . 3.6699999999999999 113.747 169.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -110.65 -42.74 3.98 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.061 1.745 . . . . 3.6800000000000002 112.552 -171.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -81.96 24.26 0.64 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.125 1.37 . . . . 3.8799999999999999 113.027 173.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 77.1 tttt . . . . . 0 C--O 1.254 1.306 0 C-N-CA 129.584 3.154 . . . . 5.25 115.78 -163.73 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.501 -0.922 0 N-CA-C 108.267 -1.012 . . . . 5.5 108.267 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -136.32 140.51 43.39 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 126.289 2.243 . . . . 4.2000000000000002 105.835 -164.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.421 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 12.8 p -73.48 168.52 24.6 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 124.367 1.067 . . . . 2.3199999999999998 112.03 -175.278 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.421 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 37.5 Cg_endo -63.58 -29.23 70.11 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.756 1.637 . . . . 1.8300000000000001 112.946 176.652 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 42.7 tp -70.33 -39.66 74.6 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 118.555 0.616 . . . . 3.0800000000000001 111.111 174.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.424 ' HA ' ' HG ' ' A' ' 9' ' ' LEU . 50.0 mt-10 -65.43 -39.09 91.67 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.108 0.563 . . . . 3.8799999999999999 111.923 173.075 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.1 -43.25 95.71 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.211 -0.931 . . . . 3.6000000000000001 111.723 172.152 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.95 -51.95 67.5 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.403 1.081 . . . . 0.89000000000000001 112.738 175.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.424 ' HG ' ' HA ' ' A' ' 6' ' ' GLU . 4.5 pp -64.82 -28.47 69.59 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.387 0.994 . . . . 3.2999999999999998 113.195 175.153 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 90.7 m -58.73 -49.94 75.75 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 118.286 -0.864 . . . . 1.55 109.853 167.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.4 m -57.43 -37.27 72.51 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 119.537 1.062 . . . . 1.3500000000000001 111.717 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 80.6 mmm -59.78 -58.27 9.29 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.778 0.831 . . . . 3.1099999999999999 111.541 174.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.2 m -66.94 -29.18 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 O-C-N 121.242 -0.911 . . . . 2.1299999999999999 112.233 -176.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 52.4 m -61.55 -55.38 31.54 Favored 'General case' 0 CA--C 1.506 -0.742 0 C-N-CA 125.591 1.556 . . . . 1.0800000000000001 111.313 176.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -75.87 -35.34 59.91 Favored 'General case' 0 CA--C 1.522 -0.116 0 O-C-N 125.28 1.613 . . . . 2.9300000000000002 109.417 -176.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -57.24 -44.04 83.48 Favored 'General case' 0 C--O 1.226 -0.177 0 CA-C-O 118.504 -0.76 . . . . 2.3100000000000001 111.156 177.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -70.26 -35.71 73.95 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.127 1.33 . . . . 2.27 112.594 175.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -70.65 -12.22 61.42 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.712 1.004 . . . . 6.2599999999999998 113.712 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -107.58 -47.99 3.51 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.903 2.081 . . . . 1.98 112.94 171.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.5 t -62.0 -29.74 70.47 Favored 'General case' 0 C--O 1.249 1.04 0 C-N-CA 126.554 1.941 . . . . 2.04 113.553 176.338 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.56 -4.84 87.86 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 127.763 2.601 . . . . 1.3899999999999999 114.009 173.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -78.53 60.22 2.61 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.812 1.806 . . . . 6.6299999999999999 110.365 171.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 51.86 -151.07 0.28 Allowed 'General case' 0 C--O 1.252 1.196 0 C-N-CA 126.154 1.782 . . . . 8.3699999999999992 112.803 -175.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.91 -151.59 8.53 Favored Glycine 0 CA--C 1.529 0.966 0 N-CA-C 109.659 -1.376 . . . . 2.0299999999999998 109.659 -145.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.5 m -69.3 161.19 29.8 Favored 'General case' 0 C--O 1.25 1.125 0 CA-C-O 123.338 1.542 . . . . 3.6299999999999999 111.032 155.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.1 mtmt -139.01 108.55 6.18 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.201 1.4 . . . . 7.8499999999999996 108.228 -160.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 43.4 mt 114.6 -17.74 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.482 1 C-N-CA 132.592 4.357 . . . . 3.23 110.459 -154.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.3 p -121.62 161.97 21.49 Favored 'General case' 0 C--O 1.246 0.91 0 C-N-CA 127.177 2.191 . . . . 1.1100000000000001 112.0 173.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 39.8 mt -104.95 117.45 34.04 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.73 1.212 . . . . 1.78 110.1 170.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 13.0 t -80.61 160.29 25.13 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 118.28 0.491 . . . . 2.2799999999999998 111.0 160.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.72 -46.77 2.7 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 127.149 2.18 . . . . 3.8799999999999999 114.045 -169.621 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -76.01 -27.36 57.35 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 120.706 -1.246 . . . . 6.4500000000000002 112.718 -175.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -65.37 -57.27 8.78 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.733 1.213 . . . . 1.49 108.573 173.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.3 tp -56.39 -45.02 80.78 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.136 0.975 . . . . 2.2599999999999998 112.152 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -31.76 71.69 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.5 -0.75 . . . . 4.6399999999999997 112.846 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -82.33 -28.95 31.32 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.943 0.897 . . . . 4.0599999999999996 112.837 174.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.3 tt -73.34 -52.05 15.25 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.552 1.141 . . . . 2.2999999999999998 110.947 178.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.5 mt -50.88 -60.27 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-N 119.853 1.206 . . . . 1.3200000000000001 111.114 -175.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.273 0.0 OUTLIER -78.1 9.33 3.8 Favored 'General case' 0 CA--C 1.56 1.328 0 N-CA-C 114.197 1.184 . . . . 4.9800000000000004 114.197 -175.778 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.0 mmtm -106.53 -31.04 8.69 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 127.441 2.296 . . . . 2.5800000000000001 112.556 166.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -71.18 -56.74 5.45 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 126.371 1.868 . . . . 4.6200000000000001 108.463 173.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -102.69 125.36 49.4 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 127.863 2.465 . . . . 2.6000000000000001 108.248 172.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 30.4 m -107.07 26.14 10.5 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.455 1.102 . . . . 3.9300000000000002 112.693 176.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -147.44 172.72 13.5 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.716 1.206 . . . . 4.1699999999999999 113.352 -175.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.78 -178.96 53.5 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 124.787 1.184 . . . . 4.2199999999999998 112.919 -175.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -82.83 51.87 2.01 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.92 1.288 . . . . 6.5199999999999996 110.025 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.2 tpt -83.85 56.65 3.76 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 123.249 1.5 . . . . 1.8700000000000001 112.876 -168.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -102.68 175.16 5.59 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.11 1.764 . . . . 4.4699999999999998 112.171 -173.065 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -58.26 -39.52 79.42 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.14 -0.975 . . . . 3.6200000000000001 113.412 -170.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -71.54 6.23 1.97 Allowed 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 114.571 1.323 . . . . 3.7400000000000002 114.571 175.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 29.7 t -121.75 -48.07 2.17 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.278 1.831 . . . . 2.8100000000000001 109.889 170.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 37.1 mt -54.1 -39.21 40.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.778 1.231 . . . . 1.3 113.304 174.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.69 -54.07 37.37 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.778 0.717 . . . . 4.0099999999999998 111.695 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.96 -30.21 65.05 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.149 0.426 . . . . 2.9300000000000002 112.149 -176.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.8 tt -57.89 -51.61 68.89 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 116.895 -1.526 . . . . 1.98 110.135 165.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.9 ttt -52.22 -48.94 64.85 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 120.98 1.718 . . . . 1.6799999999999999 112.176 174.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.0 mtpt -62.63 -27.23 69.07 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.515 0.726 . . . . 4.7699999999999996 112.676 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.5 m -89.0 -25.73 21.85 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.48 1.512 . . . . 2.48 113.91 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.415 HD22 ' HB2' ' A' ' 75' ' ' PHE . 14.5 mt -63.56 -42.02 98.39 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.685 1.13 . . . . 2.0600000000000001 110.676 171.391 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -87.13 142.34 27.99 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 124.588 1.155 . . . . 1.8 113.509 -169.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.98 9.6 42.07 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.55 1.54 . . . . 3.1099999999999999 112.779 178.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -143.48 -25.65 0.58 Allowed 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 115.969 1.841 . . . . 2.2400000000000002 115.969 -164.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.6 m 56.45 34.31 24.04 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.432 1.493 . . . . 2.3999999999999999 112.88 -161.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -79.43 1.17 26.45 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.116 1.767 . . . . 2.1699999999999999 111.558 178.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 58.53 -13.43 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 129.475 3.11 . . . . 4.2599999999999998 116.569 -163.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -101.45 123.65 45.86 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-O 124.071 1.891 . . . . 2.7200000000000002 112.239 -176.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.6 mm -92.49 93.81 4.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 113.747 -1.57 . . . . 1.25 109.013 171.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -53.15 147.22 10.16 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 127.283 2.233 . . . . 2.5 110.542 164.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -47.44 -37.19 11.11 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.58 1.152 . . . . 2.3999999999999999 113.079 178.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -69.56 -31.08 69.05 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.714 2.405 . . . . 2.9700000000000002 113.862 176.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -77.49 -47.66 19.06 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.595 1.158 . . . . 2.0899999999999999 109.06 170.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -55.05 -28.16 50.12 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.297 1.439 . . . . 1.8799999999999999 112.277 173.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 52.1 m -62.03 -26.93 68.53 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 119.882 -1.761 . . . . 2.2400000000000002 113.683 171.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 m -78.68 -28.94 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 CA-C-N 121.004 1.729 . . . . 2.7999999999999998 112.831 175.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.492 ' CE1' HD11 ' A' ' 79' ' ' LEU . 18.0 t80 -59.97 -55.14 37.76 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.357 1.063 . . . . 1.8200000000000001 110.678 169.065 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.1 mt -56.06 -38.84 71.16 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.754 0.822 . . . . 1.8999999999999999 112.438 175.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 75.8 m -60.74 -55.53 32.12 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.495 1.118 . . . . 0.81000000000000005 111.562 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 16.3 ptp -61.07 -38.08 84.95 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.986 0.812 . . . . 1.77 112.333 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.492 HD11 ' CE1' ' A' ' 75' ' ' PHE . 85.5 mt -64.74 -41.44 95.94 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.829 0.851 . . . . 1.73 113.047 175.402 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 40.4 t -71.7 -32.16 67.51 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.656 0.613 . . . . 1.3600000000000001 112.656 178.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 77.2 mtp -65.83 -43.27 89.07 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.284 0.475 . . . . 1.6299999999999999 112.284 167.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.22 -38.07 89.73 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.659 0.663 . . . . 1.0 111.95 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -61.35 -20.56 63.13 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.18 1.178 . . . . 2.4100000000000001 114.18 174.556 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.407 HD21 ' CE1' ' B' ' 17' ' ' HIS . 0.2 OUTLIER -71.25 -40.88 70.73 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 120.77 1.623 . . . . 2.9199999999999999 112.332 171.109 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -69.51 -45.12 69.64 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.872 1.269 . . . . 3.46 109.833 -177.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.68 -46.43 67.25 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.539 1.936 . . . . 3.1899999999999999 111.224 171.499 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -68.58 -27.28 65.92 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.252 1.021 . . . . 3.48 113.645 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 58.5 mt -72.0 -8.26 53.48 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 120.759 -1.213 . . . . 2.6699999999999999 113.51 175.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -98.56 0.23 44.54 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 114.73 1.382 . . . . 5.21 114.73 167.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -92.31 -59.61 2.04 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.148 1.379 . . . . 3.8599999999999999 111.466 165.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -86.25 1.73 49.79 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 117.221 2.304 . . . . 3.1600000000000001 117.221 -158.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.036 0 C-N-CA 128.453 2.701 . . . . 5.1200000000000001 117.308 -170.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 11.0 mtt . . . . . 0 CA--C 1.501 -0.914 0 N-CA-C 107.206 -1.405 . . . . 5.4100000000000001 107.206 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -138.21 152.7 48.88 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 106.57 -1.641 . . . . 5.7800000000000002 106.57 -171.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.41 150.12 45.6 Favored Pre-proline 0 N--CA 1.479 0.991 0 CA-C-O 119.301 -0.381 . . . . 2.0 110.536 -178.668 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -63.17 -14.86 44.44 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.273 1.982 . . . . 1.9099999999999999 112.446 173.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.01 -48.1 15.03 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.316 1.447 . . . . 2.71 111.155 171.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -52.1 -42.21 63.06 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.494 1.043 . . . . 3.9199999999999999 110.753 167.017 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' LYS . . . . . 0.444 ' HA ' ' CE ' ' B' ' 7' ' ' LYS . 0.0 OUTLIER -71.77 -25.87 62.21 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 114.781 1.4 . . . . 5.1399999999999997 114.781 178.965 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.31 -51.57 59.75 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 117.685 -1.15 . . . . 1.1000000000000001 111.439 165.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.2 mp -59.41 -40.64 87.33 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 121.05 1.75 . . . . 2.6699999999999999 111.898 173.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 40.3 m -53.78 -51.63 62.81 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.455 1.102 . . . . 1.54 110.001 173.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 90.8 m -53.48 -37.43 62.69 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.516 1.126 . . . . 1.4199999999999999 112.638 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 11.5 mtp -61.49 -47.04 87.44 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.105 0.562 . . . . 3.8599999999999999 111.671 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 4.0 p -76.02 -32.4 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-O 118.438 -0.791 . . . . 2.23 113.008 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 89.1 m -54.86 -56.72 16.43 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.171 1.35 . . . . 1.1599999999999999 110.547 175.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.43 -37.21 77.3 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.543 -0.753 . . . . 2.6800000000000002 109.705 -175.172 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -60.68 -52.93 63.05 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.626 0.77 . . . . 2.3500000000000001 112.673 175.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' HIS . . . . . 0.407 ' CE1' HD21 ' A' ' 84' ' ' ASN . 9.3 t60 -66.23 -38.0 86.86 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.75 0.82 . . . . 2.25 111.312 -178.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.563 ' HZ3' ' HB3' ' B' ' 18' ' ' LYS . 3.7 ttpm? -56.19 -58.94 5.8 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.86 1.264 . . . . 5.2300000000000004 112.069 170.582 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -67.36 -25.91 66.21 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 121.259 -0.901 . . . . 1.8400000000000001 112.699 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 61.1 m -63.33 -10.08 14.78 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.839 1.051 . . . . 1.6299999999999999 113.839 171.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -88.11 -7.4 73.68 Favored Glycine 0 CA--C 1.536 1.399 0 CA-C-O 118.347 -1.252 . . . . 1.4299999999999999 115.216 170.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 7.0 mmt180 -70.26 -3.59 17.86 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 120.406 2.103 . . . . 3.75 114.489 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -175.0 174.0 2.56 Favored 'General case' 0 C--O 1.247 0.94 0 C-N-CA 129.328 3.051 . . . . 3.6400000000000001 108.39 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -40.28 153.69 0.06 OUTLIER Glycine 0 N--CA 1.468 0.822 0 C-N-CA 126.469 1.985 . . . . 3.02 114.459 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 35.6 m 63.76 124.53 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.245 1.418 . . . . 3.5600000000000001 111.753 -176.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 24.1 tttt -102.08 -4.19 26.34 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 114.05 1.13 . . . . 7.4800000000000004 114.05 -178.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.506 ' H ' HD23 ' B' ' 27' ' ' LEU . 1.9 pt? -103.49 0.12 30.62 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.105 1.762 . . . . 3.6200000000000001 112.94 169.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 9.6 p -132.16 153.84 50.13 Favored 'General case' 0 C--O 1.249 1.052 0 C-N-CA 125.609 1.563 . . . . 1.3700000000000001 109.155 173.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.406 HD12 ' HB ' ' B' ' 67' ' ' ILE . 0.2 OUTLIER -110.42 124.56 51.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.375 -1.284 . . . . 1.76 109.537 158.527 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 9.7 p -59.25 165.63 2.57 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.015 0.526 . . . . 2.1600000000000001 111.225 167.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 23.4 ttt180 -52.5 -29.74 26.63 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 120.562 -1.336 . . . . 5.5899999999999999 114.117 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 tmtt? -79.34 -36.36 39.56 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.716 -1.24 . . . . 5.3200000000000003 112.863 177.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -63.85 -53.79 45.14 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.589 0.709 . . . . 1.9099999999999999 109.512 169.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 20.2 tp -51.74 -41.21 61.39 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 128.058 2.543 . . . . 2.2000000000000002 112.427 176.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 15.8 mttt -56.37 -46.85 79.84 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 121.079 -1.013 . . . . 3.25 112.476 -178.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -60.91 -53.22 59.91 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 117.761 -1.114 . . . . 3.8300000000000001 111.718 173.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -51.98 -53.47 41.1 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.429 1.013 . . . . 2.5 111.48 177.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 96.4 mt -60.35 -55.49 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-N 119.575 1.08 . . . . 1.22 109.12 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 25.6 ttpt -69.15 -15.19 63.35 Favored 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 113.281 0.845 . . . . 4.4500000000000002 113.281 -169.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 18.3 mmtp -85.77 -63.11 1.38 Allowed 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 127.49 2.316 . . . . 4.0700000000000003 112.402 170.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -75.41 -9.03 58.21 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.856 0.862 . . . . 4.8700000000000001 112.584 -171.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 89.6 mt -125.83 42.3 3.33 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.416 1.486 . . . . 3.2400000000000002 110.727 165.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 19.5 p -68.13 11.59 0.15 Allowed 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 115.444 1.646 . . . . 3.04 115.444 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -103.49 -6.3 21.94 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.005 1.722 . . . . 3.0299999999999998 113.843 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -131.87 -171.43 12.82 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 124.395 0.998 . . . . 3.0499999999999998 115.07 -170.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -74.65 53.78 0.58 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.213 1.805 . . . . 5.29 112.583 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.91 19.16 9.32 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.327 1.851 . . . . 3.3999999999999999 113.219 -179.218 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.0 ptmt -52.44 152.42 3.53 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.898 1.679 . . . . 3.9700000000000002 112.886 165.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -39.29 -54.77 1.8 Allowed 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 116.41 2.004 . . . . 3.79 116.41 -163.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 8.7 m -67.53 -23.19 65.42 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 114.458 1.281 . . . . 3.3700000000000001 114.458 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 8.2 t -65.79 -26.16 67.57 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 120.757 -1.214 . . . . 2.4500000000000002 111.125 169.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 74.7 mt -88.21 -8.75 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.988 1.315 . . . . 1.97 111.449 175.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -72.94 -44.93 60.59 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.051 -1.031 . . . . 3.4300000000000002 109.03 160.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.575 ' HA ' ' HE3' ' B' ' 57' ' ' LYS . 9.9 t0 -71.17 -47.34 58.21 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.508 0.594 . . . . 3.3700000000000001 112.355 176.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -59.17 -39.74 83.45 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 118.169 -0.919 . . . . 2.8399999999999999 111.05 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 27.6 tpp -53.79 -65.11 0.62 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.866 0.866 . . . . 2.48 109.26 169.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 57' ' ' LYS . . . . . 0.575 ' HE3' ' HA ' ' B' ' 54' ' ' ASP . 12.1 ttpp -48.16 -34.78 10.47 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.845 1.658 . . . . 4.5800000000000001 114.034 177.077 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 52.4 m -87.14 -30.57 20.96 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.312 1.045 . . . . 2.77 113.595 -174.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.1 pp -90.99 -36.27 14.18 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.211 -0.931 . . . . 2.6000000000000001 112.087 174.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.426 ' O ' ' HE3' ' B' ' 61' ' ' LYS . 30.5 t70 -76.06 153.66 36.22 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.412 1.485 . . . . 2.7400000000000002 112.404 171.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 61' ' ' LYS . . . . . 0.426 ' HE3' ' O ' ' B' ' 60' ' ' ASP . 6.4 mmtp -130.36 15.35 5.56 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.401 1.26 . . . . 3.5299999999999998 114.401 -171.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -161.4 -3.42 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 117.028 2.233 . . . . 2.5499999999999998 117.028 -165.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 74.0 m 60.65 41.81 14.7 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.077 2.151 . . . . 2.6200000000000001 112.877 179.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 59.0 p30 -95.39 -17.98 21.11 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.495 1.518 . . . . 2.5699999999999998 112.76 -174.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 62.76 -12.31 0.08 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 129.85 3.26 . . . . 5.5700000000000003 115.806 -172.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -79.46 131.35 36.04 Favored 'General case' 0 C--O 1.249 1.07 0 CA-C-N 120.906 1.685 . . . . 3.8500000000000001 111.224 161.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' ILE . . . . . 0.406 ' HB ' HD12 ' B' ' 29' ' ' LEU . 33.6 mm -107.09 94.18 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 115.131 -0.94 . . . . 1.24 109.579 174.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -60.11 154.9 18.33 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.355 1.862 . . . . 2.96 112.262 168.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -46.55 -38.0 8.81 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.99 1.716 . . . . 2.6400000000000001 113.418 178.479 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -78.81 -38.22 38.79 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 120.648 -1.282 . . . . 3.2599999999999998 112.568 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -56.18 -52.56 63.93 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 119.237 0.926 . . . . 2.3399999999999999 108.749 168.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -52.09 -41.86 62.76 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.932 1.293 . . . . 2.5 113.454 174.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.7 -24.61 65.41 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.681 -1.262 . . . . 2.6000000000000001 113.514 176.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 79.7 t -73.67 -35.52 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 119.148 0.885 . . . . 1.76 110.666 172.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -59.98 -51.2 70.68 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.728 0.695 . . . . 1.8200000000000001 111.191 167.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 93.4 mt -58.87 -36.18 74.2 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 118.865 -0.588 . . . . 1.3600000000000001 112.329 176.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 95.1 m -59.88 -47.4 85.91 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.313 1.045 . . . . 0.75 111.109 173.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 57.4 mtm -58.17 -42.74 86.68 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.467 1.03 . . . . 1.5700000000000001 112.437 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 70.6 mt -65.6 -48.41 72.4 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.191 0.596 . . . . 1.6299999999999999 112.182 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 69.0 m -59.55 -43.14 93.63 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.284 0.634 . . . . 1.9299999999999999 111.839 176.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 23.8 mtp -64.97 -34.94 79.62 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.253 0.933 . . . . 2.0899999999999999 112.577 175.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.9 -45.51 77.74 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.808 0.731 . . . . 0.70999999999999996 112.154 176.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -67.65 -25.26 65.63 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.305 0.854 . . . . 2.4500000000000002 113.305 175.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -66.0 -47.25 75.12 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 119.066 0.848 . . . . 2.3799999999999999 111.058 176.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -67.2 -37.77 84.22 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.591 1.156 . . . . 2.71 112.23 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.16 -48.98 77.38 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.811 1.244 . . . . 2.1000000000000001 111.036 174.263 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -57.01 -33.03 66.75 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.07 0.948 . . . . 2.4199999999999999 113.008 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.86 -42.61 97.52 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.394 0.997 . . . . 3.5699999999999998 112.08 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -72.76 -32.25 65.51 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 114.777 1.399 . . . . 3.71 114.777 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 -75.22 -29.43 60.27 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.347 1.859 . . . . 4.3399999999999999 114.062 -177.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -105.83 10.1 32.67 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.362 1.065 . . . . 3.54 112.926 -172.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 3.3 ttpm? . . . . . 0 C--O 1.249 1.079 0 C-N-CA 129.584 3.154 . . . . 5.2000000000000002 116.69 -177.227 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.585 ' HA ' ' OE1' ' A' ' 6' ' ' GLU 0.262 24.4 mtt . . . . . 0 N--CA 1.473 0.708 0 CA-C-O 118.567 -0.73 . . . . 9.5800000000000001 111.23 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -155.81 -110.08 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 126.281 1.833 . . . . 6.2199999999999998 107.497 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 35.3 p -70.94 166.88 33.37 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 126.441 1.896 . . . . 1.5800000000000001 111.835 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -59.61 -25.02 77.58 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 121.961 1.774 . . . . 1.3700000000000001 113.567 169.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tt -85.42 -38.07 19.09 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.521 1.055 . . . . 2.3999999999999999 112.272 178.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.585 ' OE1' ' HA ' ' A' ' 1' ' ' MET . 11.2 tm-20 -54.34 -46.48 72.93 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.619 1.1 . . . . 4.7400000000000002 109.639 161.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.3 mtpt -64.91 -23.19 67.15 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 121.477 -0.765 . . . . 5.0999999999999996 111.991 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.06 -46.55 56.46 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.575 1.15 . . . . 0.91000000000000003 110.997 173.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -70.0 -39.61 75.78 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.793 1.237 . . . . 2.8900000000000001 112.942 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.3 m -58.88 -43.5 90.92 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.431 1.492 . . . . 1.95 110.793 168.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 53.5 m -60.32 -47.57 85.45 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.614 1.097 . . . . 1.3899999999999999 109.531 169.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.1 ttm -57.6 -49.61 75.85 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 117.316 -1.325 . . . . 2.9500000000000002 111.915 -175.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.9 p -69.68 -25.41 28.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 CA-C-N 119.992 1.269 . . . . 2.2799999999999998 112.978 174.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.8 m -66.58 -53.35 35.49 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 117.537 -1.221 . . . . 0.88 110.104 174.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -53.48 -42.78 67.61 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.822 0.737 . . . . 2.4900000000000002 109.113 167.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -63.31 -44.03 96.13 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 119.588 -0.845 . . . . 2.5 111.326 -170.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.3 m80 -73.19 -34.8 66.18 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 115.03 1.493 . . . . 1.98 115.03 171.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -67.86 -24.74 65.28 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.632 1.106 . . . . 4.9500000000000002 113.301 175.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -102.95 -42.66 5.75 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.769 1.628 . . . . 2.2999999999999998 113.048 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.0 m -67.58 -15.28 63.57 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 120.173 1.351 . . . . 2.7000000000000002 113.122 172.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.93 14.94 60.54 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 125.69 1.614 . . . . 1.8899999999999999 114.68 168.189 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.5 mmp_? -94.28 -3.16 51.08 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 119.627 1.714 . . . . 5.71 113.465 176.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 177.23 176.1 0.38 Allowed 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 129.39 3.076 . . . . 4.5599999999999996 110.558 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.65 -147.55 36.31 Favored Glycine 0 N--CA 1.47 0.944 0 C-N-CA 126.0 1.762 . . . . 2.0600000000000001 113.595 167.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.9 t -66.68 155.95 36.59 Favored 'General case' 0 C--O 1.25 1.085 0 O-C-N 120.718 -1.46 . . . . 3.6099999999999999 110.751 163.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.7 pttp -65.8 -24.11 66.84 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.745 1.218 . . . . 6.7000000000000002 112.165 169.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.3 tp -70.61 -52.54 20.74 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.192 1.397 . . . . 3.7200000000000002 109.339 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 65.4 p -96.12 155.97 16.53 Favored 'General case' 0 C--O 1.253 1.269 0 C-N-CA 124.719 1.208 . . . . 0.96999999999999997 112.948 -165.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -89.91 116.25 27.84 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 112.122 -2.308 . . . . 2.73 108.827 153.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.4 p -75.47 170.44 16.11 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.163 0.585 . . . . 2.1800000000000002 110.751 158.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.37 -45.31 3.03 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 125.51 1.524 . . . . 3.7599999999999998 113.195 178.024 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? -70.07 -45.01 67.94 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 119.943 -1.723 . . . . 6.2300000000000004 113.102 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -61.07 -41.46 96.65 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.951 0.9 . . . . 1.5900000000000001 110.693 -176.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.52 -40.86 98.16 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.303 1.841 . . . . 2.4500000000000002 112.077 -179.548 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.6 ttmt -64.74 -43.08 94.5 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.028 -1.045 . . . . 3.6099999999999999 112.277 171.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -64.24 -36.25 83.46 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.848 0.859 . . . . 4.1600000000000001 111.738 176.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.1 tp -65.88 -69.59 0.29 Allowed 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 128.058 2.543 . . . . 2.5699999999999998 111.608 177.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.3 mt -56.81 -51.35 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 CA-C-N 119.641 1.109 . . . . 1.03 110.32 -174.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -72.55 -4.35 30.09 Favored 'General case' 0 CA--C 1.555 1.156 0 O-C-N 121.279 -0.888 . . . . 4.0300000000000002 112.11 -173.458 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -96.56 -45.31 6.78 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-O 117.155 -1.402 . . . . 3.9300000000000002 112.715 159.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -51.81 -44.61 63.57 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 119.897 1.226 . . . . 4.2800000000000002 111.76 175.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.2 mt -139.19 66.5 1.41 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.632 2.773 . . . . 2.5499999999999998 108.798 -169.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.6 t -70.91 21.52 0.04 OUTLIER 'General case' 0 CA--C 1.559 1.304 0 O-C-N 120.534 -1.354 . . . . 4.29 114.556 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -83.51 162.2 20.99 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 120.186 -1.571 . . . . 4.0700000000000003 113.169 -174.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.38 -0.68 24.31 Favored Glycine 0 N--CA 1.477 1.381 0 N-CA-C 116.451 1.34 . . . . 3.3599999999999999 116.451 -171.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -75.4 -32.09 60.63 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 118.599 1.199 . . . . 7.1699999999999999 110.971 166.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.53 151.41 27.76 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.597 1.159 . . . . 3.0800000000000001 111.083 174.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.88 176.83 0.52 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 130.413 3.485 . . . . 4.5300000000000002 108.639 178.321 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -55.58 -51.4 67.26 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 120.942 1.701 . . . . 6.2199999999999998 110.344 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.0 m -67.34 60.26 0.06 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.799 2.04 . . . . 3.73 113.302 168.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.6 t 172.63 -54.53 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 129.311 3.045 . . . . 2.3399999999999999 108.877 -176.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 13.9 mm -61.72 -39.57 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.376 1.47 . . . . 1.54 111.802 174.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -69.9 -26.63 64.26 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.276 0.843 . . . . 3.3300000000000001 113.276 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -85.63 -32.25 22.13 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.286 0.948 . . . . 2.1800000000000002 112.266 173.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.54 -43.67 76.04 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.4 0.68 . . . . 2.9100000000000001 109.941 163.502 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.7 tpt -54.33 -29.71 48.88 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 119.526 1.057 . . . . 1.52 113.374 173.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.0 mttm -83.49 -31.71 26.35 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.617 1.167 . . . . 5.29 112.703 174.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 46.3 t -81.69 -32.94 31.49 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 126.217 1.807 . . . . 2.4199999999999999 113.699 -177.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -68.59 -39.04 81.1 Favored 'General case' 0 C--N 1.334 -0.065 0 C-N-CA 126.223 1.809 . . . . 2.2200000000000002 111.178 173.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -84.67 144.41 28.58 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.24 1.416 . . . . 2.2400000000000002 111.225 -176.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.7 ttmt -116.25 -27.75 6.75 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.256 1.206 . . . . 4.3499999999999996 114.256 -163.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -96.84 -67.42 0.85 Allowed 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.224 1.81 . . . . 3.0499999999999998 113.243 165.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 53.1 m 137.56 38.78 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.489 1 C-N-CA 133.071 4.548 . . . . 2.6699999999999999 110.71 -172.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.9 p30 -91.36 -15.8 28.44 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.205 -1.56 . . . . 2.3199999999999998 112.784 -177.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 61.4 5.49 1.18 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 128.324 2.65 . . . . 5.4800000000000004 115.287 -168.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -102.12 129.39 48.46 Favored 'General case' 0 C--O 1.24 0.599 0 C-N-CA 125.188 1.395 . . . . 3.6800000000000002 110.929 164.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 10.7 mm -99.69 105.91 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 124.467 1.107 . . . . 1.1000000000000001 110.908 175.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -79.94 154.1 28.51 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.721 2.409 . . . . 3.2000000000000002 109.366 166.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.02 -39.18 62.98 Favored 'General case' 0 CA--C 1.547 0.833 0 O-C-N 120.172 -1.58 . . . . 2.5899999999999999 113.867 -178.393 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.3 pttm -71.51 -12.96 61.65 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.393 1.257 . . . . 3.1099999999999999 114.393 175.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 73.2 mt-10 -79.67 -63.37 1.43 Allowed 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 108.299 -1.0 . . . . 1.72 108.299 158.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -49.97 -33.44 17.79 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 126.915 2.086 . . . . 2.3799999999999999 115.618 -171.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.2 t -58.14 -22.56 51.66 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.721 -1.237 . . . . 3.0 112.597 176.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 5.5 p -58.23 -46.22 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 CA-C-N 119.108 0.867 . . . . 2.2599999999999998 111.137 173.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -70.27 -48.23 57.71 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 125.783 1.633 . . . . 2.71 111.93 178.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.5 mt -53.85 -37.61 63.82 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 122.924 0.49 . . . . 1.8100000000000001 111.384 175.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 42.8 m -68.21 -51.31 46.99 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.733 1.213 . . . . 1.3 111.751 173.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 40.1 mtm -54.88 -42.58 72.26 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.803 1.183 . . . . 1.8 112.668 177.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.97 -47.53 82.77 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.403 0.681 . . . . 1.25 111.653 174.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 88.4 m -62.72 -35.7 80.59 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.511 0.93 . . . . 1.3999999999999999 113.511 175.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 58.9 mtp -62.25 -43.65 98.33 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 118.797 0.726 . . . . 2.4300000000000002 111.267 174.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.29 -41.26 85.72 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 122.844 0.458 . . . . 0.89000000000000001 111.522 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -72.3 -29.23 63.66 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.634 -0.666 . . . . 2.8599999999999999 111.868 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -65.15 -44.22 89.28 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.292 0.951 . . . . 1.8999999999999999 111.753 171.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -61.01 -45.31 95.31 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.258 1.023 . . . . 2.6800000000000002 111.515 174.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -53.29 -48.24 68.52 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.56 1.544 . . . . 2.4399999999999999 111.991 176.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -61.8 -34.47 75.97 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.78 1.232 . . . . 2.4399999999999999 112.275 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 79.9 mt -72.33 -16.86 61.88 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.62 0.97 . . . . 1.6000000000000001 113.62 178.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -95.16 -11.66 27.77 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.336 1.236 . . . . 3.1099999999999999 114.336 172.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -109.59 -39.07 5.26 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.818 1.647 . . . . 2.8399999999999999 113.034 -168.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -88.32 24.16 1.98 Allowed 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 124.76 1.224 . . . . 3.1099999999999999 112.586 174.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 79.7 tttt . . . . . 0 C--O 1.249 1.074 0 C-N-CA 130.252 3.421 . . . . 3.7999999999999998 116.131 -164.083 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.475 0.823 0 N-CA-C 107.948 -1.13 . . . . 5.7300000000000004 107.948 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 19.6 mp0 -115.65 -108.96 0.36 Allowed 'General case' 0 CA--C 1.537 0.473 0 O-C-N 125.319 1.637 . . . . 4.6299999999999999 107.715 -158.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.7 p -132.68 151.56 78.35 Favored Pre-proline 0 N--CA 1.47 0.545 0 C-N-CA 123.861 0.864 . . . . 1.8799999999999999 111.238 174.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -67.91 -16.69 45.98 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 122.211 1.941 . . . . 1.3899999999999999 111.742 173.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.26 -46.65 27.02 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-O 118.143 -0.932 . . . . 2.48 110.576 173.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -57.6 -48.13 80.26 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.708 1.14 . . . . 4.6600000000000001 109.612 172.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -62.5 -29.62 70.68 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.351 -0.843 . . . . 4.21 112.978 178.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.04 -43.31 79.02 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.491 1.117 . . . . 0.81999999999999995 111.822 171.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 32.8 mt -66.3 -40.83 90.26 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 119.346 0.975 . . . . 1.75 111.3 173.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 90.3 m -59.95 -42.51 94.21 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.993 1.317 . . . . 1.3100000000000001 111.686 172.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 92.2 m -59.47 -43.77 93.18 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.139 0.976 . . . . 1.3400000000000001 110.654 171.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -59.99 -51.82 68.04 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.605 0.762 . . . . 3.52 111.286 177.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 48.5 t -56.94 -31.6 36.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 125.078 1.351 . . . . 1.79 113.15 175.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 33.3 m -65.47 -55.26 18.92 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.406 1.082 . . . . 0.77000000000000002 110.491 175.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.8 -39.58 71.51 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.347 0.659 . . . . 1.6699999999999999 110.9 170.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -59.91 -53.84 53.11 Favored 'General case' 0 C--O 1.225 -0.196 0 O-C-N 123.778 0.674 . . . . 2.1200000000000001 109.285 -174.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -56.39 -49.25 75.01 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.598 -0.689 . . . . 2.4100000000000001 112.522 172.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.39 -26.44 67.84 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 114.13 1.159 . . . . 6.1399999999999997 114.13 -176.18 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -107.04 -32.42 7.86 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 120.438 -1.414 . . . . 2.2400000000000002 113.162 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 42.3 t -72.34 -38.22 68.67 Favored 'General case' 0 C--O 1.247 0.935 0 C-N-CA 125.191 1.396 . . . . 1.6699999999999999 113.167 176.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.69 2.86 81.63 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 125.58 1.562 . . . . 1.74 114.299 176.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -43.96 25.98 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.498 1.149 . . . . 3.1899999999999999 111.782 -171.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -159.97 -163.0 1.06 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.865 1.666 . . . . 3.9500000000000002 110.787 177.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 58.48 -135.94 51.48 Favored Glycine 0 N--CA 1.468 0.768 0 N-CA-C 109.301 -1.52 . . . . 2.3900000000000001 109.301 -171.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 5.3 t -82.84 162.08 21.74 Favored 'General case' 0 C--O 1.248 0.985 0 CA-C-O 124.4 2.048 . . . . 3.1600000000000001 112.105 152.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -91.65 143.31 26.69 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.543 1.537 . . . . 6.7000000000000002 108.674 171.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.3 tp 82.31 -15.04 0.72 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 128.174 2.59 . . . . 2.9500000000000002 112.868 -164.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 54.8 p -112.38 144.62 41.52 Favored 'General case' 0 C--O 1.246 0.874 0 C-N-CA 125.859 1.664 . . . . 1.0900000000000001 114.542 169.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 52.5 mt -94.11 101.41 13.43 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.069 2.148 . . . . 2.04 109.514 167.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.2 t -71.59 162.0 30.13 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 120.69 -1.257 . . . . 1.99 111.452 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 tmm_? -53.93 -14.28 0.97 Allowed 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 116.345 1.98 . . . . 5.0499999999999998 116.345 -174.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.01 -45.74 8.16 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.318 -1.488 . . . . 5.8700000000000001 113.302 164.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -52.36 -45.62 65.82 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.488 1.115 . . . . 1.6399999999999999 109.893 175.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -61.15 -56.62 18.74 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.5 1.52 . . . . 2.5299999999999998 111.924 -178.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -69.93 -27.45 64.78 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 119.933 -1.73 . . . . 3.5 112.935 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -70.78 -26.02 63.15 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.992 0.738 . . . . 3.3399999999999999 112.992 169.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 34.5 tp -72.66 -58.16 3.57 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-O 117.339 -1.315 . . . . 2.0299999999999998 110.813 172.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 38.2 mt -53.03 -49.24 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 CA-C-N 119.864 1.211 . . . . 1.1399999999999999 110.423 -178.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 22.6 mtpp -64.45 -12.15 40.64 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.262 1.208 . . . . 4.5099999999999998 114.262 -175.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -109.12 -27.15 9.76 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.524 1.53 . . . . 3.5899999999999999 113.256 172.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -72.22 -38.84 68.88 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 127.878 2.471 . . . . 4.96 113.22 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 43.1 mt -147.56 79.78 1.49 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.505 1.522 . . . . 3.6099999999999999 109.215 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 15.7 p -90.19 -16.48 29.38 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.397 1.258 . . . . 2.7799999999999998 114.397 -172.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -57.93 -2.24 0.15 Allowed 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 119.228 3.047 . . . . 3.71 119.228 -170.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 163.65 161.98 13.78 Favored Glycine 0 N--CA 1.472 1.056 0 CA-C-N 120.562 1.528 . . . . 3.9199999999999999 114.45 174.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 73.97 -45.69 0.6 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 127.504 2.321 . . . . 5.96 113.534 172.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 33.4 tpp -78.12 71.68 4.6 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 124.19 1.948 . . . . 2.1600000000000001 115.41 -148.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -84.84 168.77 14.79 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.555 2.342 . . . . 4.8799999999999999 111.879 170.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -52.96 -48.42 67.39 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.688 0.795 . . . . 3.54 112.085 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 53.3 p -68.14 -4.2 12.97 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.495 1.665 . . . . 4.3399999999999999 115.495 178.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 16.4 m -97.73 -26.71 14.64 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.641 1.11 . . . . 2.5699999999999998 112.229 165.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 81.2 mt -82.09 -49.0 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 125.27 1.428 . . . . 1.95 111.713 -177.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -75.82 -15.4 60.24 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.042 0.386 . . . . 4.04 112.042 -165.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -75.33 -41.95 55.55 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.436 0.695 . . . . 4.0300000000000002 112.021 160.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.34 -43.89 79.51 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.041 0.936 . . . . 3.1000000000000001 110.621 172.406 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 9.7 tpt -56.87 -47.87 79.43 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.951 2.1 . . . . 1.97 111.495 172.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.6 tmtt? -66.23 -24.91 66.69 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.409 1.084 . . . . 5.1799999999999997 113.487 173.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.7 t -84.06 -41.2 17.43 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 120.695 -1.253 . . . . 2.6000000000000001 112.086 -178.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 14.1 mt -57.01 -59.55 4.9 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 127.395 2.278 . . . . 2.71 111.155 164.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -85.64 56.29 3.89 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 123.139 1.447 . . . . 1.7 110.856 -171.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -58.05 -19.62 33.03 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.535 1.534 . . . . 6.5599999999999996 114.026 -169.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -95.55 -10.7 28.91 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 116.441 2.015 . . . . 1.75 116.441 174.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 23.0 t 62.2 32.69 17.17 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.2 1.4 . . . . 2.5499999999999998 114.4 -178.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 46.2 p30 -73.56 -18.5 61.07 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 121.106 -0.996 . . . . 2.2000000000000002 111.388 172.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 78.63 6.64 2.35 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 131.572 3.949 . . . . 4.3099999999999996 115.918 179.229 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -131.21 140.43 49.88 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.865 1.666 . . . . 2.3500000000000001 111.278 175.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 28.7 mt -110.15 118.96 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 O-C-N 121.152 -0.967 . . . . 1.23 111.988 -173.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -93.6 164.3 13.22 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 127.136 2.174 . . . . 3.1800000000000002 111.032 165.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -49.06 -32.52 9.72 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.016 1.726 . . . . 2.25 115.142 -176.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.92 -45.95 69.53 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.121 -0.987 . . . . 3.4399999999999999 111.164 179.34 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -58.25 -48.95 78.81 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.66 1.184 . . . . 1.76 109.326 171.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -56.54 -24.51 47.33 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 114.785 1.402 . . . . 2.1099999999999999 114.785 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 29.3 t -55.86 -27.83 53.53 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 120.422 -1.424 . . . . 2.6200000000000001 114.003 170.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 89.5 t -64.45 -50.53 75.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-N 119.244 0.929 . . . . 1.54 109.981 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -61.28 -45.58 93.9 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.107 0.963 . . . . 1.79 111.853 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 87.9 mt -56.26 -41.93 76.57 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 122.966 0.506 . . . . 2.0499999999999998 112.014 174.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 39.0 m -62.05 -46.72 87.89 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.91 0.884 . . . . 1.3700000000000001 111.34 174.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 88.5 mtp -61.17 -42.55 98.77 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.002 0.819 . . . . 2.3199999999999998 112.324 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 79.4 mt -61.36 -54.1 48.04 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.511 0.724 . . . . 1.8300000000000001 111.171 174.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 52.5 m -56.19 -40.95 74.76 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 114.048 1.129 . . . . 1.76 114.048 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 50.4 mtp -74.3 -31.06 62.34 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 118.666 -0.683 . . . . 2.5099999999999998 111.927 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.13 -36.46 72.1 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.73 0.696 . . . . 0.85999999999999999 111.411 172.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -65.23 -26.85 68.3 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 121.389 -0.82 . . . . 2.5299999999999998 112.784 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -61.53 -44.02 97.81 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 120.264 1.393 . . . . 2.5800000000000001 112.013 171.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -74.21 -35.16 63.9 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.92 0.888 . . . . 3.48 111.982 178.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -56.29 -45.9 79.99 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.829 1.251 . . . . 2.4100000000000001 111.094 170.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -63.38 -15.72 58.36 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.476 1.51 . . . . 2.1299999999999999 112.677 175.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 56.9 mt -98.92 -5.11 31.35 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.824 1.65 . . . . 2.6400000000000001 114.216 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -84.38 -32.72 24.04 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.655 1.182 . . . . 4.6200000000000001 112.809 161.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -75.35 -47.35 28.06 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.954 1.302 . . . . 3.0099999999999998 112.936 -174.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -83.44 28.65 0.54 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 125.255 1.422 . . . . 3.48 113.627 -176.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 44.1 mttp . . . . . 0 C--O 1.251 1.184 0 CA-C-O 115.01 -2.424 . . . . 5.5800000000000001 115.145 173.321 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mmt . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 108.821 -0.807 . . . . 5.8899999999999997 108.821 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -150.99 141.02 22.07 Favored 'General case' 0 C--O 1.241 0.606 0 C-N-CA 126.615 1.966 . . . . 4.96 106.658 -160.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 75.9 p -55.9 161.33 3.58 Favored Pre-proline 0 N--CA 1.475 0.807 0 C-N-CA 126.657 1.983 . . . . 1.8300000000000001 112.166 175.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.44 -14.84 47.0 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 122.07 1.847 . . . . 1.9199999999999999 113.258 173.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -80.32 -48.37 13.09 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.893 1.224 . . . . 3.2599999999999998 111.375 173.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -55.55 -37.17 67.63 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 121.854 0.835 . . . . 4.2800000000000002 110.432 168.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.84 -37.51 87.86 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.719 -1.238 . . . . 3.3399999999999999 113.149 170.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.6 -44.05 91.82 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.228 1.011 . . . . 1.6399999999999999 112.026 174.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.0 mt -63.83 -45.31 90.14 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.692 0.797 . . . . 2.1099999999999999 110.711 175.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 49.2 m -52.61 -53.47 46.31 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.22 1.408 . . . . 2.0299999999999998 111.514 170.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.3 t -69.99 -31.52 69.24 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 118.051 -0.976 . . . . 2.8900000000000001 112.123 -177.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 37.8 mtt -60.59 -44.77 95.88 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.193 0.997 . . . . 3.0899999999999999 112.092 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 33.6 m -75.27 -25.7 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 119.571 1.078 . . . . 2.6499999999999999 112.812 175.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.3 m -69.29 -50.2 48.94 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.385 1.474 . . . . 1.23 111.555 177.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.4 p -60.53 -41.94 95.45 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.155 -0.684 . . . . 2.4100000000000001 109.155 172.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -65.0 -49.46 70.14 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 118.563 -0.732 . . . . 2.9700000000000002 111.236 -173.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.6 m80 -59.61 -43.96 93.59 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 120.301 1.409 . . . . 2.5099999999999998 113.276 172.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -63.45 -44.49 94.37 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.228 1.011 . . . . 3.7999999999999998 112.712 -175.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -76.55 -43.59 38.45 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.978 0.911 . . . . 2.1400000000000001 112.343 172.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.7 t -62.94 -26.0 68.61 Favored 'General case' 0 C--O 1.242 0.669 0 N-CA-C 115.347 1.61 . . . . 2.2200000000000002 115.347 -163.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.37 2.85 75.6 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 125.053 1.311 . . . . 2.2599999999999998 114.913 173.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.61 63.95 7.82 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.18 1.49 . . . . 6.7199999999999998 108.167 169.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 78.71 -171.37 0.06 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.927 1.691 . . . . 4.1200000000000001 112.984 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.84 -149.66 29.32 Favored Glycine 0 C--N 1.341 0.833 0 N-CA-C 109.363 -1.495 . . . . 2.5899999999999999 109.363 -159.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 63.7 m -76.98 166.83 22.79 Favored 'General case' 0 C--O 1.248 1.005 0 O-C-N 121.286 -1.126 . . . . 2.6499999999999999 112.017 151.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.8 ptmt -85.94 4.87 35.69 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 126.364 1.866 . . . . 4.9100000000000001 113.923 169.447 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 40.8 tp -96.93 -5.14 38.67 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.463 1.905 . . . . 3.4900000000000002 110.73 167.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.2 p -146.45 149.73 34.25 Favored 'General case' 0 C--O 1.253 1.263 0 N-CA-C 114.799 1.407 . . . . 0.97999999999999998 114.799 -161.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.2 mt -107.99 102.35 11.53 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 113.512 -1.676 . . . . 1.5600000000000001 110.137 173.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.3 t -75.85 173.24 11.42 Favored 'General case' 0 CA--C 1.552 1.031 0 O-C-N 120.884 -1.135 . . . . 2.79 112.764 173.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -55.52 -9.82 0.55 Allowed 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 127.615 2.366 . . . . 3.3900000000000001 117.272 -171.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.471 ' HG2' ' H ' ' A' ' 33' ' ' GLU . 7.0 ptmt -93.39 -50.39 5.47 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.741 1.385 . . . . 4.0300000000000002 114.741 164.022 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.471 ' H ' ' HG2' ' A' ' 32' ' ' LYS . 22.2 mt-10 -54.2 -41.12 68.26 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.663 1.985 . . . . 2.4199999999999999 108.933 176.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.455 ' CD1' HD11 ' A' ' 38' ' ' ILE . 0.9 OUTLIER -67.79 -47.94 67.72 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 114.333 -1.303 . . . . 2.3500000000000001 110.78 -175.635 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.632 ' HG2' HG21 ' A' ' 52' ' ' ILE . 68.3 mttt -55.24 -49.53 71.77 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.165 -0.959 . . . . 4.4000000000000004 112.108 171.415 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -66.78 -10.29 45.92 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.263 1.425 . . . . 3.4199999999999999 114.437 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.7 tt -94.27 -54.27 3.62 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.887 1.221 . . . . 1.9199999999999999 111.402 165.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.545 HD13 HD23 ' A' ' 55' ' ' LEU . 36.6 mt -53.52 -50.83 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 CA-C-N 119.978 1.263 . . . . 0.96999999999999997 110.999 -175.53 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.5 mtpt -71.99 -2.57 18.67 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.599 0.963 . . . . 3.9399999999999999 113.599 -177.173 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -101.97 -15.74 16.71 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.45 1.9 . . . . 3.1200000000000001 113.63 167.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -94.45 -55.07 3.29 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.423 1.489 . . . . 4.4199999999999999 112.544 178.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -68.69 91.04 0.42 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.806 2.042 . . . . 2.1899999999999999 110.332 -177.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.4 t -62.58 -17.04 59.26 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.876 1.27 . . . . 5.7599999999999998 112.5 173.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 28.0 mt -59.13 -25.74 64.12 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 127.908 2.483 . . . . 3.8500000000000001 113.765 171.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.67 -34.72 0.85 Allowed Glycine 0 CA--C 1.538 1.479 0 C-N-CA 125.233 1.397 . . . . 3.3700000000000001 116.456 170.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -67.17 -4.62 10.77 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.19 1.796 . . . . 5.25 114.762 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.5 tpt -69.89 78.71 0.47 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 123.514 1.626 . . . . 2.4500000000000002 109.795 167.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.6 ttmp? -94.53 147.65 23.06 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 127.894 2.478 . . . . 4.8499999999999996 111.658 -160.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -47.64 -44.39 26.92 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.984 2.113 . . . . 4.6100000000000003 115.463 -160.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.4 m -71.91 -35.46 69.7 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.002 1.274 . . . . 2.4700000000000002 113.36 176.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.7 m -74.36 -9.38 58.54 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.871 1.269 . . . . 2.3100000000000001 112.608 173.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.632 HG21 ' HG2' ' A' ' 35' ' ' LYS . 7.2 mm -79.75 -29.51 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-O 118.447 -0.787 . . . . 2.3700000000000001 110.908 166.681 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.36 -33.73 75.83 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.848 1.204 . . . . 2.5099999999999998 110.726 173.039 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -70.54 -43.42 69.57 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.174 0.897 . . . . 3.3100000000000001 112.507 168.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.545 HD23 HD13 ' A' ' 38' ' ' ILE . 37.1 tp -62.67 -46.42 88.29 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.387 -0.816 . . . . 1.95 111.559 178.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.09 -53.92 36.63 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 124.199 1.0 . . . . 2.7000000000000002 110.768 166.38 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 tmpt? -56.59 -28.81 61.16 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 120.243 1.383 . . . . 4.6100000000000003 113.25 177.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.2 m -83.76 -37.29 22.82 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.119 1.767 . . . . 1.8300000000000001 112.642 -177.424 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 11.0 mp -65.0 -49.87 68.54 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.538 0.735 . . . . 2.6000000000000001 110.661 163.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -88.97 59.69 5.13 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 127.406 2.283 . . . . 1.5700000000000001 112.139 -170.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.9 mtmp? -40.57 -32.69 0.22 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 127.456 2.302 . . . . 3.6499999999999999 115.764 -177.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -98.94 -6.51 28.66 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 115.651 1.722 . . . . 2.3599999999999999 115.651 -178.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.8 t 57.87 31.54 20.67 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.852 1.661 . . . . 2.7599999999999998 114.331 -178.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -69.07 -16.82 63.78 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.969 0.907 . . . . 2.2000000000000002 111.397 173.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.58 15.37 2.13 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 130.214 3.405 . . . . 3.98 114.368 178.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -131.18 133.84 45.92 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 127.841 2.456 . . . . 2.52 110.48 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.2 mm -107.34 99.45 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.129 0.972 . . . . 1.73 111.097 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -68.32 157.11 36.35 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.531 1.933 . . . . 2.8599999999999999 110.343 170.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.5 -35.23 52.56 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 120.13 1.332 . . . . 2.0299999999999998 113.001 179.404 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -63.91 -30.2 71.3 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.238 -0.914 . . . . 3.4100000000000001 113.182 174.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -83.56 -45.83 13.1 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.862 1.265 . . . . 2.6000000000000001 110.434 175.249 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -49.7 -44.16 47.97 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 126.19 1.796 . . . . 3.3900000000000001 111.812 176.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.5 t -60.56 -22.75 64.02 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 120.594 -1.317 . . . . 2.3500000000000001 114.121 176.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.7 t -68.89 -32.91 56.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 O-C-N 120.015 -1.678 . . . . 2.4399999999999999 110.882 176.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -60.55 -57.15 13.95 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.993 0.917 . . . . 1.8600000000000001 110.961 171.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -53.59 -43.49 68.61 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.965 0.906 . . . . 2.3599999999999999 111.344 176.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 58.9 m -51.97 -54.97 23.43 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.615 1.166 . . . . 0.93000000000000005 111.291 173.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 78.8 mtm -63.44 -43.04 98.57 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 118.817 -0.611 . . . . 1.72 112.412 -177.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 63.1 mt -63.21 -39.37 94.45 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.492 0.587 . . . . 1.3300000000000001 112.182 176.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.45 ' HB3' ' CZ ' ' B' ' 69' ' ' PHE . 87.9 m -65.06 -38.1 89.71 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 118.674 -0.679 . . . . 1.49 112.514 172.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 15.1 mtp -64.75 -36.07 83.13 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.453 1.024 . . . . 2.29 113.165 171.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.66 -53.08 53.06 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.295 0.952 . . . . 0.90000000000000002 111.946 174.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -65.04 -25.97 68.06 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.573 0.953 . . . . 2.46 113.573 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -60.31 -43.07 96.68 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.52 1.128 . . . . 3.0099999999999998 113.074 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -75.23 -45.02 42.97 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.014 1.326 . . . . 2.8100000000000001 111.358 178.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -49.76 -48.68 50.17 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.346 1.859 . . . . 2.0099999999999998 110.939 175.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -56.11 -27.12 52.67 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.462 1.505 . . . . 2.1099999999999999 113.386 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 43.6 mt -80.12 -27.87 39.08 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.184 -0.947 . . . . 1.53 112.432 178.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.404 ' HA ' ' HD3' ' A' ' 92' ' ' LYS . 66.2 mm-40 -87.36 -20.04 27.29 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.747 1.219 . . . . 2.73 113.888 175.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -82.28 -31.8 29.9 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 128.401 2.68 . . . . 2.8199999999999998 113.669 -178.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -92.82 16.35 12.63 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 125.185 1.394 . . . . 2.98 113.298 -176.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.404 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 36.4 mtpt . . . . . 0 C--O 1.252 1.199 0 CA-C-O 115.323 -2.275 . . . . 4.3499999999999996 116.104 -175.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 19.5 mtt . . . . . 0 N--CA 1.473 0.693 0 N-CA-C 108.223 -1.028 . . . . 6.5899999999999999 108.223 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.418 ' CD ' ' H ' ' B' ' 2' ' ' GLU . 1.6 mp0 -87.01 169.53 12.34 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 129.027 2.931 . . . . 6.04 109.461 178.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 41.3 p -65.95 156.04 85.07 Favored Pre-proline 0 N--CA 1.471 0.607 0 C-N-CA 123.663 0.785 . . . . 2.52 110.41 170.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -63.96 -23.9 67.68 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.341 2.027 . . . . 1.72 112.218 173.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 73.7 mt -75.07 -43.21 54.54 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.187 0.995 . . . . 3.3100000000000001 111.895 174.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -66.99 -28.57 68.36 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.011 1.278 . . . . 3.8700000000000001 112.086 168.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -36.07 82.88 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.188 -1.57 . . . . 4.9900000000000002 112.551 167.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.0 -44.79 68.64 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.287 1.035 . . . . 0.93000000000000005 112.371 171.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 50.2 mt -60.82 -42.36 97.54 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.86 1.209 . . . . 1.72 111.838 175.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 20.8 p -68.81 -37.48 79.25 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 117.776 -1.107 . . . . 2.0299999999999998 111.904 173.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 85.3 m -59.09 -42.81 91.37 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.944 1.247 . . . . 1.24 111.45 169.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 8.4 mtt -58.24 -51.44 69.77 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.678 0.791 . . . . 3.4300000000000002 110.61 175.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.32 -36.58 64.52 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 113.883 1.068 . . . . 1.76 113.883 173.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 90.7 m -63.22 -52.66 61.31 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.443 1.497 . . . . 0.70999999999999996 110.928 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.16 -39.1 65.92 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 114.878 -1.056 . . . . 2.5899999999999999 108.525 -175.681 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -57.53 -45.65 84.79 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.039 0.535 . . . . 2.1899999999999999 111.019 176.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 6.7 m80 -68.7 -29.46 67.9 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.776 1.028 . . . . 2.4100000000000001 113.776 177.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 18.7 ttmm -68.04 -28.31 67.28 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.35 1.06 . . . . 3.6099999999999999 113.475 176.225 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -85.79 -45.83 11.24 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.927 0.891 . . . . 2.7000000000000002 112.08 166.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 38.3 t -60.69 -27.25 67.73 Favored 'General case' 0 C--O 1.249 1.054 0 N-CA-C 114.524 1.305 . . . . 1.6699999999999999 114.524 -175.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.96 -2.25 90.28 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 116.637 -2.201 . . . . 1.46 115.268 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.4 mtp85 -75.11 -110.71 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.559 1.544 . . . . 3.75 110.207 172.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -44.37 129.55 6.49 Favored 'General case' 0 C--O 1.248 1.0 0 CA-C-N 120.48 1.491 . . . . 4.1699999999999999 111.201 171.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.43 -35.41 91.67 Favored Glycine 0 N--CA 1.469 0.848 0 CA-C-N 114.533 -1.212 . . . . 2.4300000000000002 115.64 -132.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 2.0 t -62.25 138.27 58.39 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.089 1.756 . . . . 4.1600000000000001 111.754 172.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -130.95 155.87 46.06 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.836 1.654 . . . . 6.1500000000000004 111.861 -169.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.0 mp 76.16 3.44 3.67 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 128.877 2.871 . . . . 4.1699999999999999 111.921 -157.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 10.9 p -143.47 149.03 36.98 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 131.322 3.849 . . . . 1.98 112.082 -166.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 50.4 mt -118.65 121.21 39.62 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.182 1.793 . . . . 2.0800000000000001 111.799 -176.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 4.7 t -91.77 -178.72 5.12 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.089 1.356 . . . . 2.2599999999999998 113.926 166.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 29.8 ttp85 -60.5 -23.91 64.9 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.144 2.177 . . . . 5.4299999999999997 116.597 -161.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 mptt -110.47 -19.44 12.93 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 115.095 1.517 . . . . 8.1199999999999992 115.095 172.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -54.8 -59.59 4.52 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.093 0.957 . . . . 2.3100000000000001 109.32 160.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -61.86 -39.66 92.64 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 127.101 2.16 . . . . 2.3300000000000001 110.963 -177.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -39.67 82.04 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.177 -1.577 . . . . 5.7699999999999996 113.993 178.489 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 32.7 tp10 -90.31 -21.46 22.04 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 118.003 -0.999 . . . . 4.0 112.611 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 37' ' ' LEU . . . . . 0.42 HD23 ' C ' ' B' ' 37' ' ' LEU . 5.7 tt -54.46 -62.37 1.7 Allowed 'General case' 0 C--N 1.343 0.315 0 CA-C-O 118.086 -0.959 . . . . 2.4300000000000002 109.499 164.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 35.1 mt -47.61 -57.62 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 C-N-CA 123.892 0.877 . . . . 1.29 110.479 -175.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -72.96 -2.39 20.78 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 113.894 1.072 . . . . 4.9900000000000002 113.894 -168.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 24.9 mttp -117.7 -33.6 4.48 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 120.358 -1.464 . . . . 3.1299999999999999 114.331 170.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -60.32 -41.32 93.24 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.839 1.255 . . . . 5.25 110.151 170.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -102.0 117.23 34.38 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 106.281 -1.748 . . . . 2.4500000000000002 106.281 158.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 9.2 t -110.1 -9.71 14.7 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.3 1.04 . . . . 3.8399999999999999 112.811 -171.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -54.61 -2.76 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 117.915 2.561 . . . . 3.9199999999999999 117.915 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.37 17.32 59.04 Favored Glycine 0 N--CA 1.476 1.307 0 CA-C-N 120.116 1.325 . . . . 4.6699999999999999 115.208 174.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.7 -163.4 1.02 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.359 1.464 . . . . 6.46 111.652 177.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 78.18 178.04 0.14 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.515 2.726 . . . . 3.2599999999999998 114.713 176.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -165.58 139.95 4.74 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.182 1.793 . . . . 7.3300000000000001 108.517 -175.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -61.56 -31.88 71.93 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 121.057 1.753 . . . . 4.7400000000000002 111.643 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.3 m -70.44 24.81 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.263 1.825 . . . . 3.0899999999999999 115.285 165.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -139.77 15.54 2.5 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.411 1.485 . . . . 2.6099999999999999 111.939 154.115 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 71.7 mt -112.28 -46.59 5.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.612 1.165 . . . . 1.3999999999999999 111.204 -176.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.83 -30.03 71.02 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.055 0.843 . . . . 3.71 111.586 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -78.6 -46.38 19.45 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 128.696 2.798 . . . . 5.3499999999999996 113.967 171.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 48.9 tp -58.25 -35.98 72.54 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.18 0.446 . . . . 2.5600000000000001 111.157 173.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.4 mmm -49.29 -46.24 46.24 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.899 1.28 . . . . 2.3199999999999998 111.194 171.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.3 mptt -68.72 -39.78 80.26 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.745 -1.222 . . . . 7.2000000000000002 112.129 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.5 t -64.98 -29.57 70.5 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-O 122.229 1.014 . . . . 1.8999999999999999 113.303 -176.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.2 mp -76.66 -21.35 55.56 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.594 1.158 . . . . 2.9399999999999999 112.717 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -89.14 127.67 35.74 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.968 1.307 . . . . 2.3399999999999999 110.133 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.32 11.53 21.05 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 120.616 -1.302 . . . . 3.8199999999999998 112.753 -170.286 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 33.4 p30 -163.45 -27.01 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.69 1.737 . . . . 2.3799999999999999 115.69 -165.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 29.9 t 70.38 51.96 0.36 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.436 1.495 . . . . 2.7999999999999998 110.603 -170.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 11.7 p30 -82.86 -54.57 5.0 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.48 1.512 . . . . 3.8999999999999999 109.871 -174.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 171.74 -25.5 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 131.656 3.982 . . . . 8.4299999999999997 113.881 169.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -154.96 154.54 32.74 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 125.331 1.452 . . . . 2.27 110.49 -163.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 3.1 mm -92.99 105.37 16.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 126.072 1.749 . . . . 1.6599999999999999 109.037 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.1 165.32 20.54 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.41 -0.806 . . . . 3.1499999999999999 110.631 167.091 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 69' ' ' PHE . . . . . 0.45 ' CZ ' ' HB3' ' A' ' 80' ' ' CYS . 0.4 OUTLIER -54.1 -38.57 65.51 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 120.421 -1.424 . . . . 3.73 112.997 178.642 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -76.67 -21.7 55.06 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.75 -1.219 . . . . 4.3899999999999997 113.69 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -69.75 -61.45 1.78 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.182 0.993 . . . . 2.2999999999999998 109.507 160.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.04 -32.85 70.13 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 128.504 2.721 . . . . 2.3100000000000001 114.866 -172.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 60.2 p -61.85 -14.75 36.34 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 119.482 -2.011 . . . . 1.76 113.299 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 5.1 p -60.67 -29.37 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 O-C-N 121.06 -1.025 . . . . 2.5499999999999998 112.486 170.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.436 ' CZ ' HD11 ' B' ' 79' ' ' LEU . 67.7 t80 -75.77 -47.72 24.72 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.506 1.522 . . . . 2.25 111.33 175.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 93.8 mt -54.67 -35.7 63.82 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.225 0.61 . . . . 1.49 111.555 169.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 19.3 m -63.14 -53.81 47.5 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.199 0.999 . . . . 1.03 111.312 172.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 19.8 mtm -56.45 -49.7 73.85 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.93 0.892 . . . . 1.6599999999999999 112.191 177.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.436 HD11 ' CZ ' ' B' ' 75' ' ' PHE . 85.2 mt -60.94 -43.83 98.12 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.33 1.052 . . . . 1.5 111.589 178.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.6 t -72.59 -28.79 63.01 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 113.08 0.77 . . . . 2.1499999999999999 113.08 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 86.2 mtp -67.22 -42.74 83.57 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 118.996 0.816 . . . . 2.5499999999999998 111.074 170.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.06 -27.25 69.27 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 118.711 0.687 . . . . 1.1299999999999999 112.706 173.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -73.31 -28.62 62.18 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.311 1.226 . . . . 2.79 114.311 170.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -65.65 -44.79 85.28 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 120.275 1.398 . . . . 2.7599999999999998 109.804 170.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -67.67 -31.84 72.1 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.135 0.974 . . . . 2.9199999999999999 110.614 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.11 -50.88 70.14 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.763 1.225 . . . . 2.8700000000000001 111.852 167.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -59.61 -33.08 71.04 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.501 1.52 . . . . 2.0099999999999998 112.243 -177.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 94.2 mt -79.27 -18.62 52.39 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.836 1.254 . . . . 1.6799999999999999 113.782 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -95.13 -11.79 27.56 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 114.381 1.252 . . . . 3.54 114.381 176.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -94.23 -50.21 5.38 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.556 1.542 . . . . 3.1899999999999999 112.798 174.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -82.0 52.63 2.01 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.274 1.43 . . . . 2.6600000000000001 111.792 -174.404 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 57.2 mmtt . . . . . 0 C--O 1.248 1.021 0 C-N-CA 128.558 2.743 . . . . 4.9299999999999997 114.609 171.515 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 108.471 -0.937 . . . . 7.1399999999999997 108.471 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -144.8 144.84 31.36 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 126.807 2.043 . . . . 3.7400000000000002 106.126 -165.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.9 p -62.64 163.6 14.92 Favored Pre-proline 0 CA--C 1.54 0.561 0 C-N-CA 126.334 1.853 . . . . 1.4299999999999999 113.547 -167.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -67.86 -12.76 36.41 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 122.406 2.071 . . . . 1.29 113.342 169.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.08 -38.08 32.48 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.718 1.145 . . . . 2.3100000000000001 110.891 174.386 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -55.7 -53.97 49.98 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 108.473 -0.936 . . . . 4.7000000000000002 108.473 166.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.6 mttp -64.38 -25.08 67.87 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 112.316 0.488 . . . . 3.5099999999999998 112.316 -176.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.41 -47.02 58.65 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.203 0.91 . . . . 0.93000000000000005 111.722 171.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 43.5 mt -62.83 -44.53 95.9 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.02 0.928 . . . . 1.54 111.387 176.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 88.1 m -61.51 -46.4 90.14 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.459 1.903 . . . . 1.45 111.908 173.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.8 m -61.67 -45.48 93.83 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.215 0.916 . . . . 1.47 110.468 177.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -60.49 -52.61 64.46 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.618 0.645 . . . . 3.7599999999999998 110.937 -177.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.7 p -63.95 -23.63 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 O-C-N 120.96 -1.088 . . . . 2.2000000000000002 113.318 177.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.9 m -65.87 -58.3 5.91 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 117.721 -1.133 . . . . 1.03 109.826 172.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -40.3 66.57 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.822 0.849 . . . . 2.1299999999999999 110.291 175.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -57.31 -49.59 75.61 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 124.718 1.261 . . . . 2.1699999999999999 110.433 -174.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -61.97 -42.22 98.88 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.274 -0.892 . . . . 2.2200000000000002 112.633 175.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -69.5 -36.41 76.46 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.838 -1.164 . . . . 6.8899999999999997 112.764 -176.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -85.12 -20.08 30.85 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.414 1.486 . . . . 2.3700000000000001 114.567 172.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.7 p -55.84 -32.23 63.43 Favored 'General case' 0 N--CA 1.485 1.303 0 O-C-N 119.79 -1.819 . . . . 2.4399999999999999 113.509 171.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 109.72 -131.31 10.41 Favored Glycine 0 C--N 1.34 0.792 0 CA-C-N 114.255 -1.339 . . . . 2.6699999999999999 114.298 126.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -123.32 -14.64 7.39 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 127.112 2.165 . . . . 5.1200000000000001 111.85 -171.56 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -131.59 153.3 50.03 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 126.96 2.104 . . . . 4.2199999999999998 111.705 -170.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.64 -124.32 34.19 Favored Glycine 0 C--N 1.337 0.625 0 CA-C-N 113.302 -1.772 . . . . 2.1800000000000002 109.75 -169.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 42.2 t -98.08 168.99 9.93 Favored 'General case' 0 C--O 1.252 1.19 0 CA-C-O 122.651 1.215 . . . . 2.9700000000000002 111.434 160.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -107.95 22.37 16.06 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 129.594 3.157 . . . . 4.96 111.987 175.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.4 tp -96.0 -5.02 42.12 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.463 1.105 . . . . 3.4900000000000002 110.386 153.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.1 p -150.6 135.69 17.68 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 113.173 0.805 . . . . 1.0800000000000001 113.173 -151.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.5 mp -98.53 108.91 21.72 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.783 1.233 . . . . 2.21 112.297 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.1 p -64.26 158.15 24.03 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 124.562 1.145 . . . . 3.04 112.54 167.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.7 tpt180 -44.39 -43.52 7.7 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.479 0.918 . . . . 4.6900000000000004 113.479 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.77 -33.53 66.36 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.039 1.125 . . . . 4.0599999999999996 114.039 179.599 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -64.86 -51.46 61.91 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.518 1.527 . . . . 2.21 108.589 173.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.3 tp -58.34 -41.64 85.07 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.027 0.931 . . . . 2.3300000000000001 112.732 175.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tmpt? -53.79 -33.68 56.74 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.41 0.684 . . . . 6.9000000000000004 112.385 177.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -79.51 -48.76 13.33 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 118.538 -0.744 . . . . 3.9700000000000002 111.191 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.3 tp -49.15 -59.84 3.31 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.306 1.042 . . . . 1.95 111.263 177.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.5 mt -57.99 -35.0 50.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 123.242 0.617 . . . . 1.1799999999999999 110.556 -177.286 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -72.71 -2.88 21.99 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.563 1.32 . . . . 4.2199999999999998 114.563 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt -133.1 -28.34 1.54 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 127.124 2.17 . . . . 3.1400000000000001 112.476 -172.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -68.54 -123.29 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 107.701 -1.222 . . . . 4.1200000000000001 107.701 144.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -56.98 -53.12 61.69 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 115.869 1.803 . . . . 2.3999999999999999 115.869 -158.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 17.0 t 62.07 -4.06 0.22 Allowed 'General case' 0 CA--C 1.558 1.269 0 N-CA-C 116.59 2.07 . . . . 3.9199999999999999 116.59 172.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -42.82 -49.56 5.76 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 115.911 1.819 . . . . 4.9299999999999997 115.911 -151.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.81 -37.13 0.43 Allowed Glycine 0 N--CA 1.468 0.78 0 C-N-CA 124.781 1.181 . . . . 3.6899999999999999 112.98 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -61.87 -35.36 78.07 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.214 1.006 . . . . 7.3099999999999996 111.834 172.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -71.37 63.53 0.38 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 127.027 2.131 . . . . 2.3100000000000001 114.347 -178.091 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.6 mmmt -92.26 165.23 13.21 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 129.285 3.034 . . . . 7.7800000000000002 109.788 161.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.509 ' CD ' ' H ' ' A' ' 49' ' ' GLU . 3.0 mp0 -42.38 -51.41 4.91 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.106 1.762 . . . . 4.7599999999999998 114.654 -168.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.1 m -71.99 -28.21 63.26 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 114.964 1.468 . . . . 2.9300000000000002 114.964 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.4 t -76.22 -27.52 56.85 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 120.316 -1.49 . . . . 1.8899999999999999 111.004 170.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 74.8 mt -74.11 -22.94 18.39 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 O-C-N 121.327 -0.858 . . . . 1.74 111.039 169.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.27 -51.28 54.87 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.91 1.284 . . . . 3.73 110.488 168.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.472 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 3.4 t70 -69.15 -39.74 78.62 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.269 0.47 . . . . 2.3199999999999998 112.269 178.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 57.4 tp -63.78 -50.9 67.19 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 116.524 -1.703 . . . . 2.0499999999999998 110.757 173.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.1 ttt -53.81 -48.53 69.78 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-N 121.305 1.866 . . . . 1.5700000000000001 110.31 174.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.472 ' HE2' ' HA ' ' A' ' 54' ' ' ASP . 2.4 tmmm? -56.37 -29.47 61.47 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.191 0.996 . . . . 3.4100000000000001 113.502 174.166 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 24.4 t -77.24 -33.2 56.1 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 120.215 -1.553 . . . . 2.1200000000000001 112.912 174.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 18.9 mt -80.56 -47.57 14.0 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.793 0.724 . . . . 2.1299999999999999 111.821 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -79.14 79.07 5.58 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 127.964 2.505 . . . . 2.1800000000000002 111.918 -163.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -68.32 -18.35 64.48 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 116.516 2.043 . . . . 3.7999999999999998 116.516 -177.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.84 -26.99 49.77 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 120.641 1.564 . . . . 2.6699999999999999 111.669 161.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.3 m 58.77 76.21 0.36 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.79 2.036 . . . . 3.5 111.413 177.125 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -146.27 -109.0 0.1 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.305 -0.861 . . . . 3.2000000000000002 110.082 -151.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -139.49 -20.7 0.93 Allowed 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 115.522 1.675 . . . . 5.6100000000000003 115.522 168.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -130.82 153.08 49.46 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 122.95 1.357 . . . . 3.8500000000000001 113.651 174.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 27.3 mt -90.2 113.9 27.02 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 C-N-CA 126.863 2.065 . . . . 2.3500000000000001 110.55 173.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -64.77 156.99 28.77 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.579 1.151 . . . . 3.6299999999999999 110.662 163.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -57.15 -28.98 63.22 Favored 'General case' 0 CA--C 1.549 0.937 0 O-C-N 120.897 -1.127 . . . . 2.9100000000000001 110.859 165.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.81 -25.88 63.98 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 120.097 -1.627 . . . . 6.2599999999999998 113.746 174.2 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -80.97 -53.21 6.64 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.672 1.189 . . . . 2.4199999999999999 109.288 170.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -48.67 -23.93 1.19 Allowed 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 127.273 2.229 . . . . 2.46 114.573 176.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 47.0 m -52.9 -36.22 59.11 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.647 1.579 . . . . 2.27 112.537 171.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 p -79.65 -30.24 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 121.621 -0.674 . . . . 2.1899999999999999 111.696 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -60.23 -56.91 15.76 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.749 0.82 . . . . 1.79 110.611 173.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.1 mt -58.84 -34.62 71.76 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.678 0.791 . . . . 1.6100000000000001 112.625 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 84.1 m -62.71 -54.27 41.84 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.459 1.104 . . . . 0.87 111.173 173.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 46.6 mtp -54.58 -47.02 73.83 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.243 0.928 . . . . 1.78 111.364 177.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.74 -50.21 71.96 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.401 1.08 . . . . 1.46 112.392 178.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 93.1 m -63.82 -33.95 76.83 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.192 0.906 . . . . 1.72 113.429 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 92.5 mtp -64.16 -43.89 93.79 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.221 0.918 . . . . 1.8400000000000001 111.129 175.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.53 -39.73 92.13 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.07 0.548 . . . . 0.72999999999999998 112.272 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -62.44 -31.64 72.38 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.387 0.884 . . . . 2.2799999999999998 113.387 174.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 15.2 t30 -73.29 -37.18 66.31 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.631 1.105 . . . . 1.79 112.134 178.097 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.88 -37.99 89.48 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.195 0.998 . . . . 3.0600000000000001 112.123 167.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.05 -43.38 91.7 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.865 0.866 . . . . 1.95 111.267 174.451 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -63.35 -32.2 73.56 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.367 1.467 . . . . 2.3599999999999999 112.007 176.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 35.0 mt -74.94 -17.97 60.47 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.189 -0.944 . . . . 1.4199999999999999 113.025 175.162 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -94.61 4.24 54.09 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.969 1.707 . . . . 2.6299999999999999 113.779 169.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -94.03 -49.35 5.82 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.889 1.276 . . . . 4.04 110.975 164.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -76.13 20.25 0.21 Allowed 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 126.083 1.753 . . . . 3.0800000000000001 114.251 -178.658 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.025 0 N-CA-C 118.151 2.648 . . . . 4.5700000000000003 118.151 -163.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 24.0 ptt? . . . . . 0 N--CA 1.475 0.784 0 N-CA-C 108.785 -0.82 . . . . 8.1500000000000004 108.785 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 18.2 mp0 -110.34 -109.41 0.34 Allowed 'General case' 0 CA--C 1.539 0.522 0 O-C-N 125.342 1.651 . . . . 5.2400000000000002 108.689 -151.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 2.6 p -123.03 169.31 10.18 Favored Pre-proline 0 N--CA 1.476 0.871 0 C-N-CA 125.259 1.424 . . . . 2.5600000000000001 111.175 -174.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -73.93 -10.65 23.2 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.393 2.062 . . . . 1.8100000000000001 112.744 169.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -67.9 -54.58 17.69 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.693 1.197 . . . . 2.75 111.662 -177.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -57.37 -30.85 65.21 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 118.996 0.816 . . . . 4.0899999999999999 111.979 175.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -74.89 -33.92 62.12 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 120.522 -1.361 . . . . 5.4000000000000004 111.848 176.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.22 -46.19 65.01 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.472 1.509 . . . . 0.81999999999999995 111.304 173.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.3 mp -66.65 -36.73 83.26 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.14 0.882 . . . . 2.4399999999999999 111.381 176.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 54.5 m -56.21 -48.36 76.58 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 121.592 -0.692 . . . . 1.55 111.07 166.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 90.4 m -62.46 -35.46 79.38 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.629 1.172 . . . . 1.1699999999999999 111.766 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -54.84 -59.9 4.1 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 118.439 -0.791 . . . . 3.5600000000000001 110.607 166.612 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 17.8 m -67.83 -17.89 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 CA-C-N 120.332 1.424 . . . . 2.1800000000000002 113.588 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 62.3 m -71.83 -48.87 43.19 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.752 1.621 . . . . 0.78000000000000003 111.171 171.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 64.5 p -58.07 -33.35 68.95 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 118.202 -0.904 . . . . 2.1800000000000002 110.101 166.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -72.76 -49.54 30.23 Favored 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 119.713 1.142 . . . . 2.4900000000000002 111.834 -175.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -72.63 -17.45 61.67 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 120.171 -1.58 . . . . 2.4100000000000001 114.459 178.109 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -82.72 -66.46 0.89 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.392 0.677 . . . . 4.6100000000000003 111.77 166.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -69.69 -29.98 67.54 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.591 1.087 . . . . 1.97 113.633 -175.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 19.9 p -70.91 -19.31 62.61 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 122.445 2.384 . . . . 1.8 111.986 172.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -94.04 17.69 58.28 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 126.886 2.184 . . . . 2.2000000000000002 113.477 168.161 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 51.2 tpt85 -72.9 -28.89 62.74 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.207 1.004 . . . . 3.5499999999999998 111.193 169.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -157.63 153.81 27.38 Favored 'General case' 0 C--O 1.251 1.149 0 C-N-CA 125.866 1.667 . . . . 3.4900000000000002 111.952 170.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.66 -136.35 36.89 Favored Glycine 0 C--N 1.335 0.528 0 C-N-CA 125.559 1.552 . . . . 2.79 112.014 168.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 11.4 m -58.02 128.42 37.0 Favored 'General case' 0 C--O 1.246 0.915 0 O-C-N 122.292 -0.534 . . . . 3.0 111.181 174.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -76.46 111.79 12.3 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 126.134 1.773 . . . . 7.6799999999999997 107.315 148.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 35.4 tp 141.72 -41.69 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 130.038 3.335 . . . . 3.9700000000000002 106.925 -161.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 71.0 p -121.6 141.71 50.83 Favored 'General case' 0 C--O 1.255 1.36 0 CA-C-O 123.22 1.486 . . . . 1.53 112.903 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 22.0 mt -93.72 95.98 9.51 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 111.83 -2.441 . . . . 1.75 107.267 157.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 6.6 m -65.58 155.97 34.15 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 120.721 -1.237 . . . . 2.3399999999999999 110.441 169.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 25.2 ttt180 -41.54 -29.1 0.15 Allowed 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 117.43 2.381 . . . . 4.2400000000000002 117.43 -174.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -85.88 -38.04 18.49 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 115.229 1.566 . . . . 4.5800000000000001 115.229 172.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -56.78 -48.53 77.7 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.049 0.94 . . . . 1.77 108.918 167.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 14.4 tp -63.52 -43.9 95.83 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.055 0.942 . . . . 1.8999999999999999 111.899 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 35' ' ' LYS . . . . . 0.544 ' HE2' HG21 ' B' ' 52' ' ' ILE . 23.4 ttmt -56.5 -47.17 79.88 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 119.268 -0.396 . . . . 3.0800000000000001 111.738 179.084 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.438 ' HG2' ' CE ' ' B' ' 40' ' ' LYS . 33.8 tt0 -59.61 -44.2 93.49 Favored 'General case' 0 CA--C 1.553 1.08 0 N-CA-C 113.452 0.908 . . . . 3.3500000000000001 113.452 174.522 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 31.3 tp -61.18 -55.67 29.61 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.812 1.245 . . . . 1.9099999999999999 111.186 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 19.7 mt -59.07 -52.57 59.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 108.889 -0.782 . . . . 1.0600000000000001 108.889 -178.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.3 -27.15 67.07 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 113.937 1.088 . . . . 5.79 113.937 -173.543 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 40' ' ' LYS . . . . . 0.438 ' CE ' ' HG2' ' B' ' 36' ' ' GLU . 35.9 mtmt -85.49 -53.81 4.96 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 120.093 1.315 . . . . 3.9100000000000001 114.516 170.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -72.73 -31.21 64.8 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 118.245 0.475 . . . . 4.79 110.937 -171.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -110.27 72.56 0.8 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.078 1.351 . . . . 2.4300000000000002 108.911 161.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.7 t -71.39 61.81 0.34 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.971 1.308 . . . . 3.5899999999999999 112.306 174.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.25 166.84 11.21 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 127.337 2.255 . . . . 4.4400000000000004 112.402 -173.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -85.9 -72.64 1.29 Allowed Glycine 0 C--N 1.338 0.649 0 C-N-CA 125.291 1.424 . . . . 3.5800000000000001 109.676 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.519 ' H ' ' CD ' ' B' ' 46' ' ' GLU . 1.2 pm0 -40.27 -30.61 0.11 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 128.831 2.852 . . . . 6.0499999999999998 115.258 164.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -72.99 53.37 0.35 Allowed 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.792 -1.193 . . . . 2.3999999999999999 111.431 163.192 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.465 ' HA ' ' HE2' ' B' ' 48' ' ' LYS . 2.7 mmpt? -59.09 159.81 6.91 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 123.157 1.456 . . . . 5.3200000000000003 111.443 172.144 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -76.87 -8.52 57.5 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.381 -0.825 . . . . 6.1299999999999999 113.103 -156.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 12.3 t -102.6 -14.76 16.62 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.022 1.729 . . . . 3.1600000000000001 113.872 162.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 4.5 m -62.44 -28.48 69.84 Favored 'General case' 0 N--CA 1.482 1.157 0 CA-C-N 121.259 1.845 . . . . 2.6200000000000001 110.493 166.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 52' ' ' ILE . . . . . 0.544 HG21 ' HE2' ' B' ' 35' ' ' LYS . 14.0 mm -52.36 -37.24 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 126.461 1.904 . . . . 1.3100000000000001 113.253 165.389 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -82.92 -27.22 30.75 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.164 0.985 . . . . 3.7200000000000002 112.592 -173.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.76 -46.94 67.49 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 118.428 -0.796 . . . . 2.5 110.461 161.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -54.56 -49.04 71.3 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.407 1.083 . . . . 2.46 110.558 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.42 -48.89 79.2 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.982 0.913 . . . . 1.9099999999999999 111.765 174.226 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -18.58 62.13 Favored 'General case' 0 CA--C 1.555 1.144 0 N-CA-C 114.634 1.346 . . . . 3.4700000000000002 114.634 172.123 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.9 m -94.13 -29.79 14.97 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.41 1.884 . . . . 2.7999999999999998 112.483 -179.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 96.2 mt -74.91 -49.14 21.3 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.475 1.11 . . . . 2.1499999999999999 111.082 165.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -82.84 63.92 7.19 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 125.998 1.719 . . . . 2.3100000000000001 111.643 -172.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 27.7 mttm -56.09 -20.47 17.35 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.084 1.754 . . . . 4.04 112.194 175.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -72.42 -32.58 66.46 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.511 1.924 . . . . 2.1600000000000001 113.877 174.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 21.2 t 62.93 29.38 16.51 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.675 1.19 . . . . 3.04 113.227 -161.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 10.0 p30 -86.44 -14.53 43.0 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.4 1.48 . . . . 2.1699999999999999 112.462 -177.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 69.46 2.06 3.58 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 128.979 2.911 . . . . 5.0300000000000002 116.923 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -100.53 147.34 26.03 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 127.783 2.433 . . . . 2.8300000000000001 110.923 167.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 43.3 mm -106.4 103.52 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 108.128 -1.064 . . . . 1.1200000000000001 108.128 160.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.26 165.51 23.51 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.578 1.551 . . . . 2.5 110.738 165.323 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -52.59 -26.21 12.78 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 115.222 1.564 . . . . 2.2400000000000002 115.222 -175.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.3 -43.84 16.99 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 120.649 -1.282 . . . . 3.3700000000000001 111.647 177.267 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -55.92 -35.53 66.71 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.29 1.036 . . . . 2.3100000000000001 110.133 169.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -76.87 -38.55 53.45 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.365 1.866 . . . . 3.3199999999999998 113.498 176.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 51.9 p -73.05 -34.61 66.39 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 119.767 -1.833 . . . . 1.8600000000000001 111.72 176.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.8 p -69.28 -29.81 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.143 0.883 . . . . 2.46 112.352 172.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.568 ' CZ ' HD11 ' B' ' 79' ' ' LEU . 15.8 t80 -59.06 -57.79 11.5 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.179 -0.951 . . . . 1.7 111.382 166.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 96.6 mt -62.03 -29.47 70.3 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.462 0.705 . . . . 1.8899999999999999 112.321 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 45.5 m -63.37 -53.34 53.99 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.856 1.262 . . . . 1.46 111.622 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 74.1 mtm -59.41 -39.74 84.44 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 119.173 0.897 . . . . 2.0499999999999998 111.471 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.568 HD11 ' CZ ' ' B' ' 75' ' ' PHE . 95.8 mt -61.83 -56.43 19.54 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.12 0.568 . . . . 2.02 111.608 173.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 5.1 t -60.3 -32.45 71.22 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.218 0.917 . . . . 1.6599999999999999 112.592 -177.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 76.9 mtp -71.63 -33.15 68.7 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.841 1.052 . . . . 2.46 113.841 170.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.19 -35.51 81.03 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 120.535 1.516 . . . . 1.0900000000000001 112.391 172.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -64.25 -19.6 65.49 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.215 -0.928 . . . . 2.8100000000000001 112.947 171.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -66.72 -45.21 79.45 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.771 1.169 . . . . 1.8899999999999999 112.063 170.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.88 -46.3 78.87 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.565 1.146 . . . . 3.8500000000000001 110.244 177.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -53.08 -47.38 68.56 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.942 1.697 . . . . 2.73 112.19 175.31 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -61.15 -27.74 68.61 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.476 1.51 . . . . 2.3399999999999999 113.163 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 43.8 mt -79.38 -13.57 59.53 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.208 1.003 . . . . 1.98 112.949 178.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.419 ' OE2' ' HE2' ' B' ' 92' ' ' LYS . 44.7 mm-40 -108.21 8.53 27.95 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.161 1.785 . . . . 3.6499999999999999 113.081 168.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -107.03 -54.77 2.42 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.849 1.259 . . . . 3.6800000000000002 112.145 174.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.28 31.75 0.51 Allowed 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 124.904 1.282 . . . . 3.0600000000000001 112.678 176.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 92' ' ' LYS . . . . . 0.419 ' HE2' ' OE2' ' B' ' 89' ' ' GLU . 2.1 ptmm? . . . . . 0 C--O 1.257 1.469 0 N-CA-C 117.314 2.338 . . . . 4.5599999999999996 117.314 -157.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.5 mtt . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 121.244 0.545 . . . . 11.359999999999999 111.029 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -104.32 -51.14 3.17 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 124.715 1.206 . . . . 5.4900000000000002 113.267 -158.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 44.2 p -111.62 160.02 31.08 Favored Pre-proline 0 N--CA 1.468 0.474 0 CA-C-N 116.002 -0.545 . . . . 1.3799999999999999 111.845 -156.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -59.37 -21.22 59.94 Favored 'Trans proline' 0 CA--C 1.536 0.588 0 C-N-CA 121.771 1.648 . . . . 1.23 111.63 166.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.79 -49.9 14.78 Favored 'General case' 0 C--N 1.344 0.361 0 CA-C-O 118.333 -0.842 . . . . 2.4300000000000002 110.525 174.376 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -62.93 -33.02 74.47 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 120.792 1.633 . . . . 3.4700000000000002 111.875 176.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -67.92 -25.12 65.32 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.665 -1.272 . . . . 4.25 113.04 172.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.49 -44.53 34.99 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.827 0.851 . . . . 0.96999999999999997 111.936 172.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.7 mt -64.13 -40.53 96.37 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 121.107 -0.996 . . . . 1.48 111.962 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.6 p -61.97 -45.16 94.87 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 117.511 -1.233 . . . . 2.4700000000000002 111.162 171.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 54.3 m -53.91 -38.22 64.6 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 119.16 0.891 . . . . 1.29 111.54 173.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.1 tpp -56.3 -48.46 76.62 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 118.766 -0.635 . . . . 3.25 111.89 175.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.7 m -72.27 -29.53 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 119.462 1.028 . . . . 2.2200000000000002 112.67 175.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.8 m -57.43 -57.87 10.77 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.827 1.194 . . . . 0.93999999999999995 111.472 175.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.92 -24.51 58.52 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.62 0.768 . . . . 2.6600000000000001 110.311 -178.238 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -65.33 -59.23 4.26 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-O 117.982 -1.008 . . . . 2.0699999999999998 111.535 170.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -58.78 -42.23 88.51 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 120.782 1.628 . . . . 3.1800000000000002 112.656 -175.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.5 tttt -39.55 -53.71 2.06 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.246 2.218 . . . . 5.7300000000000004 113.937 168.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -95.95 -29.47 14.14 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.31 1.226 . . . . 2.5099999999999998 114.31 -178.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.8 t -73.43 -34.12 65.28 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 127.073 2.149 . . . . 2.0 113.181 -177.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -73.57 -22.04 78.86 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 124.319 0.961 . . . . 2.04 112.338 170.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -86.21 68.74 10.36 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.188 1.395 . . . . 5.0199999999999996 110.206 -177.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.493 ' HG2' ' H ' ' A' ' 24' ' ' GLY . 8.8 tt0 102.78 -176.76 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 129.638 3.175 . . . . 3.9900000000000002 111.588 173.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.493 ' H ' ' HG2' ' A' ' 23' ' ' GLU . . . 57.93 -145.12 40.87 Favored Glycine 0 N--CA 1.47 0.926 0 C-N-CA 124.895 1.236 . . . . 2.0899999999999999 110.7 -170.267 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -79.51 169.49 17.96 Favored 'General case' 0 CA--C 1.553 1.066 0 O-C-N 121.504 -0.998 . . . . 2.4900000000000002 111.054 153.001 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.5 ptpp? -94.66 -5.65 45.11 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.66 1.584 . . . . 5.5499999999999998 115.161 -173.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 25.8 tp -100.96 4.54 42.6 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.609 1.564 . . . . 3.5800000000000001 111.012 169.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 55.0 p -142.6 144.94 33.06 Favored 'General case' 0 C--O 1.246 0.911 0 C-N-CA 125.991 1.717 . . . . 0.92000000000000004 112.397 -165.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 26.1 tp -113.72 88.12 2.77 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.787 1.635 . . . . 2.8199999999999998 108.891 -172.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -59.93 160.98 7.07 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.531 1.533 . . . . 2.0 114.922 -176.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.59 -20.32 1.16 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 128.374 2.669 . . . . 3.21 114.744 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.81 -26.09 13.89 Favored 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 119.98 1.264 . . . . 3.6899999999999999 113.629 167.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -66.16 -53.7 34.41 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.499 1.045 . . . . 1.6799999999999999 109.348 175.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 35.6 tp -50.82 -44.54 59.22 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.712 2.005 . . . . 2.0299999999999998 113.363 -176.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tmpt? -56.17 -34.99 66.72 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.137 1.375 . . . . 5.4000000000000004 113.012 -177.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -99.77 13.53 33.38 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.951 1.3 . . . . 4.3200000000000003 114.32 177.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.9 tp -96.69 -56.04 2.71 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.096 0.862 . . . . 2.6800000000000002 110.296 152.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 23.5 mt -60.46 -61.97 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 119.194 0.906 . . . . 0.93000000000000005 110.161 -168.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -68.31 -11.05 58.86 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.354 1.062 . . . . 4.54 111.982 -177.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.64 -42.12 29.58 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.741 1.616 . . . . 4.9900000000000002 111.303 173.305 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -103.28 -72.53 0.69 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.956 0.902 . . . . 6.9500000000000002 109.283 -178.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.1 mt -72.91 22.61 0.06 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 128.637 2.775 . . . . 3.6899999999999999 114.84 -171.097 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 26.6 p -51.8 -35.7 45.03 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.637 1.975 . . . . 3.5899999999999999 115.151 -175.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -62.03 -19.59 63.04 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.301 1.84 . . . . 4.29 114.941 -173.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -78.58 25.25 2.47 Favored Glycine 0 CA--C 1.532 1.12 0 CA-C-O 118.869 -0.962 . . . . 5.0199999999999996 113.308 172.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 56.93 20.33 5.24 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 126.54 1.936 . . . . 5.46 113.004 -170.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.4 ttm -82.21 37.88 0.52 Allowed 'General case' 0 N--CA 1.471 0.609 0 O-C-N 120.521 -1.362 . . . . 2.5099999999999998 113.151 -174.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.9 pttt -73.27 162.88 28.86 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.147 1.379 . . . . 4.8799999999999999 111.714 170.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -25.44 -60.8 0.07 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 128.677 2.791 . . . . 5.1500000000000004 116.39 -162.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.2 t -70.86 -10.11 58.95 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 115.029 1.492 . . . . 3.1699999999999999 115.029 -173.091 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.3 t -84.13 -13.83 51.91 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.593 1.157 . . . . 2.2000000000000002 112.594 168.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 12.3 mm -79.64 -32.59 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 O-C-N 120.212 -1.555 . . . . 1.5800000000000001 112.794 -173.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.18 -44.03 85.15 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.854 0.862 . . . . 3.0600000000000001 111.736 -175.421 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -72.12 -38.44 69.27 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 122.77 0.428 . . . . 2.3900000000000001 111.387 176.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.98 -49.18 78.68 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 118.679 -0.677 . . . . 2.52 110.134 174.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.42 -44.44 89.07 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.396 1.478 . . . . 1.8700000000000001 111.753 177.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -55.93 -30.82 62.25 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.033 0.933 . . . . 4.0800000000000001 112.751 172.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.65 -23.57 42.46 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.52 1.128 . . . . 1.6899999999999999 113.181 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.5 mt -89.19 -34.14 16.78 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 114.866 1.432 . . . . 1.9099999999999999 114.866 -173.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -82.07 154.65 25.49 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 120.787 1.631 . . . . 1.74 112.582 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -127.84 10.65 6.55 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.067 1.747 . . . . 3.5600000000000001 113.137 175.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -121.69 -33.28 3.63 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.699 1.2 . . . . 2.4300000000000002 114.151 -165.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.5 t 76.66 23.07 1.1 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.938 2.495 . . . . 3.96 112.602 -167.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.9 p30 -76.91 -24.57 52.48 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.833 1.653 . . . . 2.3799999999999999 111.59 177.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 67.39 19.82 10.04 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 128.652 2.781 . . . . 4.3099999999999996 113.784 -166.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . 0.432 25.9 pt-20 -132.61 132.36 42.41 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 126.207 2.908 . . . . 2.1099999999999999 115.978 167.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 20.1 mm -74.59 107.31 5.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-N 112.072 -2.331 . . . . 1.0900000000000001 106.868 177.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -62.15 152.57 32.68 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.478 -1.237 . . . . 4.5099999999999998 108.899 172.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -58.38 -25.88 62.56 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 120.652 -1.28 . . . . 2.1499999999999999 113.371 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -69.69 -34.65 74.22 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.1 0.96 . . . . 3.9700000000000002 113.403 171.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -79.22 -36.91 39.33 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.318 1.447 . . . . 1.8799999999999999 110.229 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -53.69 -35.71 61.4 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.012 1.325 . . . . 2.04 112.201 174.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.9 m -56.03 -30.09 61.36 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 120.799 -1.188 . . . . 2.0699999999999998 113.458 170.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.5 t -71.37 -35.92 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.924 0.889 . . . . 2.1600000000000001 110.565 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -59.95 -50.29 74.32 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.75 0.82 . . . . 1.75 111.925 176.048 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.03 -49.98 74.14 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.28 0.632 . . . . 2.7000000000000002 110.544 175.203 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.9 m -52.9 -52.65 56.88 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.302 1.441 . . . . 0.69999999999999996 112.091 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 40.4 mtp -55.41 -48.27 74.65 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.388 1.075 . . . . 1.9099999999999999 112.284 178.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.3 mt -66.6 -43.28 85.24 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.461 0.704 . . . . 1.47 111.721 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 68.6 m -60.73 -33.72 73.34 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 118.293 -0.86 . . . . 1.8100000000000001 113.013 173.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 89.9 mtp -68.11 -34.97 77.38 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.627 1.103 . . . . 1.9199999999999999 112.481 172.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.47 -43.85 84.34 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 119.645 1.111 . . . . 1.21 111.818 170.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -64.49 -24.03 67.48 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.555 0.946 . . . . 2.2999999999999998 113.555 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -67.41 -44.71 78.12 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.309 0.959 . . . . 2.7000000000000002 112.333 174.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -70.67 -46.01 63.99 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.584 1.554 . . . . 2.7799999999999998 111.393 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -51.55 -50.07 60.78 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.998 1.719 . . . . 2.1099999999999999 110.763 174.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -60.09 -29.02 68.31 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.197 1.399 . . . . 2.3700000000000001 112.906 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.8 mt -76.59 -15.47 59.84 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 118.207 -0.902 . . . . 1.52 113.12 178.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -104.31 -20.32 13.8 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 114.849 1.425 . . . . 3.0099999999999998 114.849 172.154 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -94.13 -44.81 7.83 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 126.973 2.109 . . . . 3.6200000000000001 113.45 -171.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -88.34 11.8 15.78 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 124.07 0.948 . . . . 3.5299999999999998 113.198 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . 0.25 4.0 ttpt . . . . . 0 C--O 1.25 1.112 0 C-N-CA 129.063 2.945 . . . . 3.6499999999999999 113.1 -169.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 35.1 ttp . . . . . 0 N--CA 1.482 1.138 0 N-CA-C 108.04 -1.096 . . . . 5.7300000000000004 108.04 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -34.52 135.47 0.17 Allowed 'General case' 0 N--CA 1.442 -0.845 0 O-C-N 125.774 1.921 . . . . 6.8499999999999996 110.68 146.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.9 p -56.36 158.82 7.18 Favored Pre-proline 0 C--N 1.317 -0.806 0 CA-C-N 112.597 -2.092 . . . . 1.9399999999999999 110.405 164.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -62.64 -20.85 72.05 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 121.784 1.656 . . . . 1.54 111.943 167.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -76.47 -50.89 12.9 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.262 0.937 . . . . 2.6499999999999999 111.143 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -52.89 -45.81 67.69 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 122.327 1.06 . . . . 4.5099999999999998 110.398 169.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 13.8 ttpt -63.0 -25.12 68.24 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.594 0.961 . . . . 5.1600000000000001 113.594 176.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.6 -49.8 43.9 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.938 1.245 . . . . 1.3 110.953 177.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 6.4 mp -61.65 -39.16 90.35 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.81 0.844 . . . . 2.6099999999999999 111.263 174.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 58.9 m -59.18 -50.76 72.79 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.412 1.485 . . . . 1.24 110.954 174.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 89.1 m -61.43 -36.31 80.01 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.218 1.407 . . . . 1.3400000000000001 110.706 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 1.6 ttp -56.24 -59.22 5.26 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.608 1.163 . . . . 3.77 111.82 167.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 78.2 t -60.89 -31.79 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 CA-C-N 120.828 1.649 . . . . 1.9399999999999999 112.684 178.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 87.4 m -72.0 -49.87 33.46 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.337 1.455 . . . . 0.83999999999999997 111.895 -176.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 7.4 p -62.8 -38.09 89.32 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 118.377 -0.82 . . . . 1.8799999999999999 109.302 169.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -58.3 -57.77 11.42 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 118.936 -0.554 . . . . 2.2000000000000002 110.74 -176.234 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -63.2 -36.67 84.42 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.582 1.083 . . . . 2.1600000000000001 112.599 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -76.77 -24.08 52.91 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.506 1.299 . . . . 5.0599999999999996 114.506 -176.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -91.34 -37.88 12.97 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 120.024 1.284 . . . . 2.0299999999999998 112.167 166.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 34.3 t -65.09 -28.64 69.59 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.416 -1.428 . . . . 1.8100000000000001 112.53 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.2 6.92 82.49 Favored Glycine 0 CA--C 1.534 1.252 0 C-N-CA 125.615 1.579 . . . . 1.3600000000000001 114.828 176.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 45.7 mmt-85 -57.57 -41.98 82.18 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 119.455 1.627 . . . . 5.1900000000000004 111.76 170.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -145.12 136.93 25.56 Favored 'General case' 0 C--O 1.256 1.418 0 C-N-CA 126.568 1.947 . . . . 4.2199999999999998 111.405 178.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.03 -118.45 6.56 Favored Glycine 0 C--N 1.34 0.802 0 C-N-CA 127.479 2.466 . . . . 2.6099999999999999 113.148 162.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.5 m -47.72 122.45 4.92 Favored 'General case' 0 C--O 1.246 0.878 0 C-N-CA 125.093 1.357 . . . . 3.48 112.057 170.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 15.1 pttm -106.64 4.14 27.61 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.023 1.729 . . . . 7.2699999999999996 114.811 -178.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.493 ' H ' HD23 ' B' ' 27' ' ' LEU . 1.6 pt? -102.19 -2.09 29.97 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.589 1.555 . . . . 3.9700000000000002 113.011 169.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 28' ' ' THR . . . . . 0.438 HG22 ' HA ' ' B' ' 68' ' ' ASP . 7.7 p -137.89 147.02 44.06 Favored 'General case' 0 C--O 1.244 0.812 0 C-N-CA 128.677 2.791 . . . . 1.3600000000000001 111.539 -173.618 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -96.64 107.94 20.47 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.505 0.722 . . . . 2.4199999999999999 109.936 166.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.75 145.01 55.14 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.144 -0.687 . . . . 2.71 109.144 167.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 5.9 ttt-85 -41.69 -40.54 2.0 Allowed 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.654 1.581 . . . . 3.77 114.748 -173.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.427 ' HG2' ' H ' ' B' ' 33' ' ' GLU . 2.9 ptmt -61.07 -43.56 98.7 Favored 'General case' 0 CA--C 1.555 1.148 0 N-CA-C 115.247 1.573 . . . . 4.9699999999999998 115.247 173.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.427 ' H ' ' HG2' ' B' ' 32' ' ' LYS . 17.8 mt-10 -65.13 -49.6 69.3 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 127.58 2.352 . . . . 1.6299999999999999 107.697 176.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -55.04 -49.37 71.76 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.103 1.361 . . . . 2.3500000000000001 111.214 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -13.91 61.95 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 114.904 1.446 . . . . 4.7599999999999998 114.904 -175.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -84.21 -40.84 17.6 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 112.475 0.546 . . . . 3.1800000000000002 112.475 169.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 tt -50.9 -57.93 7.26 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.04 1.336 . . . . 1.8899999999999999 110.498 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 24.2 mt -59.1 -48.16 87.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 123.994 0.918 . . . . 1.1799999999999999 110.038 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.464 ' HZ3' ' CD ' ' B' ' 46' ' ' GLU . 16.4 tppt? -57.67 -21.51 40.56 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.966 1.306 . . . . 3.8300000000000001 112.986 -175.251 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 mttm -98.74 -42.62 7.13 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 114.32 1.23 . . . . 3.4199999999999999 114.32 165.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -50.83 -48.75 59.82 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 126.348 1.859 . . . . 5.0999999999999996 112.191 -177.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 73.1 mt -125.17 120.22 30.73 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.291 1.437 . . . . 2.54 109.213 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 44.2 t -84.21 -76.0 0.32 Allowed 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 107.733 -1.21 . . . . 4.4199999999999999 107.733 160.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 76.6 mt 52.68 -105.14 0.22 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.468 1.107 . . . . 3.3300000000000001 111.531 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -102.05 7.22 54.6 Favored Glycine 0 N--CA 1.484 1.851 0 C-N-CA 125.537 1.541 . . . . 3.1600000000000001 114.828 172.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.464 ' CD ' ' HZ3' ' B' ' 39' ' ' LYS . 0.7 OUTLIER 70.34 110.95 0.06 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 130.965 3.706 . . . . 8.4299999999999997 109.736 -170.942 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 84.6 mmm -58.73 -38.87 79.3 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.497 1.295 . . . . 2.8300000000000001 114.497 -174.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.412 ' HB2' ' HZ3' ' B' ' 48' ' ' LYS . 1.4 ttpm? 71.16 141.27 0.05 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.481 1.912 . . . . 3.8399999999999999 114.428 157.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -58.57 -31.47 68.03 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 119.922 -1.736 . . . . 3.73 112.043 -172.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 22.7 t -70.18 1.46 4.74 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 115.409 1.633 . . . . 3.3399999999999999 115.409 173.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 2.7 p -124.71 -41.62 2.12 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.259 0.936 . . . . 2.2599999999999998 111.959 157.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 84.6 mt -54.22 -41.91 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 124.434 1.094 . . . . 1.5 112.696 -176.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -63.53 -34.54 78.01 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 119.429 1.013 . . . . 3.2000000000000002 111.733 -173.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -93.82 -35.13 12.88 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.878 1.671 . . . . 4.6900000000000004 113.585 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 7.1 tt -53.37 -42.4 66.83 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.702 1.201 . . . . 2.6499999999999999 110.146 169.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.7 -48.42 72.48 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.639 1.576 . . . . 1.6399999999999999 111.44 171.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 13.4 mttm -59.73 -37.32 78.63 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 119.527 1.058 . . . . 7.0300000000000002 111.641 173.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 5.0 t -65.66 -22.62 66.66 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.018 0.927 . . . . 1.95 113.154 175.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 29.0 mt -77.64 -42.96 32.98 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.981 0.913 . . . . 2.0600000000000001 110.845 168.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -76.2 78.57 3.0 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.886 2.474 . . . . 1.8100000000000001 114.527 -162.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 65.6 mmtt -61.15 -13.1 15.21 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 115.505 1.669 . . . . 3.75 115.505 -170.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -120.05 2.62 10.96 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.862 1.43 . . . . 2.3399999999999999 114.862 176.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 23.0 t 62.96 18.94 11.28 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.702 1.371 . . . . 2.5699999999999998 114.702 172.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 47.5 p-10 -79.7 -11.29 59.86 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.924 1.689 . . . . 2.1400000000000001 112.337 -177.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 67.43 16.98 10.09 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 130.565 3.546 . . . . 4.8700000000000001 113.613 -175.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -111.51 141.5 45.0 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.653 1.981 . . . . 2.27 107.846 165.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 50.4 mm -108.33 102.59 14.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 O-C-N 120.152 -1.592 . . . . 1.25 107.791 172.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 68' ' ' ASP . . . . . 0.526 ' HB3' ' H ' ' B' ' 70' ' ' LYS . 88.9 m-20 -47.38 153.78 0.48 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.074 0.549 . . . . 3.3300000000000001 110.661 168.221 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -47.47 -25.8 1.19 Allowed 'General case' 0 CA--C 1.555 1.138 0 CA-C-O 121.839 0.828 . . . . 2.3100000000000001 112.75 158.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.526 ' H ' ' HB3' ' B' ' 68' ' ' ASP . 6.7 ttpm? -86.85 -25.31 24.58 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 129.108 2.963 . . . . 4.0300000000000002 114.952 176.549 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -80.81 -43.71 19.64 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 119.935 1.243 . . . . 1.8200000000000001 108.57 169.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -50.65 -31.32 15.87 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 129.812 3.245 . . . . 1.9299999999999999 115.659 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 30.9 t -53.23 -38.38 62.9 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.98 -1.075 . . . . 2.0299999999999998 112.124 171.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 57.4 t -67.24 -34.13 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 O-C-N 121.378 -0.826 . . . . 1.52 111.294 -177.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -59.76 -62.74 1.65 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 118.35 0.523 . . . . 1.8200000000000001 110.892 175.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 52.4 mt -62.31 -30.53 71.21 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.202 0.601 . . . . 1.8100000000000001 112.327 -176.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 91.1 m -58.32 -47.8 82.57 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.741 0.816 . . . . 0.81999999999999995 111.029 172.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 79.6 mtm -62.99 -38.21 90.26 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.017 0.826 . . . . 1.55 112.803 177.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 62.9 mt -61.28 -46.09 91.77 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.422 0.555 . . . . 1.55 110.503 173.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 97.1 m -60.84 -38.47 85.63 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.692 0.797 . . . . 1.8700000000000001 112.858 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 28.1 mmt -60.22 -41.41 93.02 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 118.854 0.752 . . . . 3.2799999999999998 111.941 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.91 -38.37 79.55 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.409 0.55 . . . . 0.87 112.054 177.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -71.84 -24.28 61.67 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.025 1.12 . . . . 3.1600000000000001 114.025 177.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -65.05 -46.13 82.51 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.509 0.724 . . . . 2.77 112.015 170.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.33 -44.49 91.38 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.58 1.552 . . . . 3.29 112.149 177.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -50.39 -48.96 55.71 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.025 1.73 . . . . 2.3500000000000001 111.734 177.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -64.83 -21.04 66.71 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.336 1.454 . . . . 2.5299999999999998 113.653 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 44.3 mt -84.24 -20.57 32.02 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.199 1.0 . . . . 1.6899999999999999 112.057 173.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -97.41 -10.15 26.02 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 115.074 1.509 . . . . 3.7599999999999998 115.074 174.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -88.36 -33.44 17.95 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.34 1.456 . . . . 2.8900000000000001 113.652 -177.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -80.05 -6.59 57.89 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 115.086 1.513 . . . . 5.25 115.086 -174.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 114.902 -2.475 . . . . 5.0499999999999998 117.469 -158.189 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 108.075 -1.083 . . . . 5.6500000000000004 108.075 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -109.32 143.15 39.22 Favored 'General case' 0 N--CA 1.432 -1.334 0 N-CA-C 106.982 -1.488 . . . . 4.0999999999999996 106.982 -159.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.543 HG21 ' O ' ' B' ' 40' ' ' LYS . 70.6 p -49.03 149.38 3.37 Favored Pre-proline 0 N--CA 1.47 0.537 0 C-N-CA 125.989 1.716 . . . . 1.4199999999999999 111.467 178.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -64.68 -23.13 63.73 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.25 1.966 . . . . 1.28 111.939 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.29 -44.25 46.69 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.858 1.263 . . . . 2.3799999999999999 111.865 174.454 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -53.24 -53.05 56.37 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.998 1.272 . . . . 4.7000000000000002 110.083 174.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 33.9 mtmt -61.98 -21.11 64.56 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 113.186 0.81 . . . . 4.3700000000000001 113.186 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.54 -45.24 31.51 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.82 0.848 . . . . 0.90000000000000002 111.369 170.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.6 mt -58.23 -47.28 84.02 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.474 1.033 . . . . 1.54 110.832 173.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -66.81 -37.49 84.62 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 116.348 -1.787 . . . . 2.2999999999999998 112.462 175.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 42.1 m -55.65 -42.97 75.79 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 121.415 1.916 . . . . 1.29 110.875 170.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 57.5 mtp -63.88 -47.03 82.27 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.996 1.319 . . . . 3.1499999999999999 112.033 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.517 HG21 ' HB3' ' B' ' 83' ' ' TYR . 58.3 t -65.69 -31.65 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 O-C-N 121.075 -1.016 . . . . 2.25 111.531 175.307 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 93.3 m -67.42 -56.58 9.07 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.565 1.146 . . . . 1.01 110.617 -179.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.0 p -57.97 -42.54 85.26 Favored 'General case' 0 CA--C 1.512 -0.512 0 O-C-N 123.737 0.648 . . . . 2.3399999999999999 109.461 178.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -67.74 -55.29 13.67 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.779 0.674 . . . . 2.54 111.412 -176.276 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -65.48 -29.7 70.39 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.382 -0.824 . . . . 2.27 112.353 -177.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp -70.76 -57.08 5.02 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.33 0.968 . . . . 5.6799999999999997 112.493 171.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 -67.71 -23.25 65.25 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.623 1.101 . . . . 2.1600000000000001 113.135 -178.065 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.3 t -62.99 -19.77 64.65 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.402 1.26 . . . . 2.0800000000000001 114.402 172.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.04 33.55 6.35 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 126.709 2.099 . . . . 1.3600000000000001 113.428 171.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -114.05 28.92 8.39 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.821 1.648 . . . . 6.1900000000000004 112.57 173.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.408 ' HG2' ' H ' ' A' ' 24' ' ' GLY . 4.1 tt0 126.8 -159.83 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.091 1 C-N-CA 132.666 4.387 . . . . 4.3399999999999999 110.26 171.968 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.408 ' H ' ' HG2' ' A' ' 23' ' ' GLU . . . 51.26 -141.24 21.84 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 124.876 1.227 . . . . 2.21 111.622 -170.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.8 t -86.86 179.7 6.68 Favored 'General case' 0 C--O 1.249 1.04 0 CA-C-O 122.203 1.001 . . . . 2.3500000000000001 111.786 158.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -104.44 140.88 37.31 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.434 2.294 . . . . 4.5899999999999999 108.705 166.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 9.7 tp 90.72 -18.26 0.17 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 131.063 3.745 . . . . 3.6699999999999999 110.98 -159.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.6 p -112.45 152.94 28.12 Favored 'General case' 0 C--O 1.246 0.898 0 C-N-CA 125.745 1.618 . . . . 1.3 114.957 177.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.9 mt -107.58 105.83 15.91 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.177 1.391 . . . . 1.45 111.687 163.219 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.9 t -62.0 160.98 11.42 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.78 1.232 . . . . 2.0899999999999999 111.227 163.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.4 ttm-85 -46.56 -21.88 0.23 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 126.465 1.906 . . . . 3.4700000000000002 114.906 -178.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.88 -38.65 10.18 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.126 1.37 . . . . 3.9900000000000002 112.854 -178.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -61.11 -46.46 90.51 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.693 1.197 . . . . 1.4399999999999999 109.559 172.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.7 tp -66.38 -49.43 66.9 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.53 0.732 . . . . 1.9399999999999999 111.398 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.1 ttmt -61.66 -37.17 83.06 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 113.15 0.796 . . . . 3.4900000000000002 113.15 -177.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -57.63 -58.53 7.94 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.764 0.825 . . . . 3.75 112.317 164.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.4 tp -53.29 -54.67 33.01 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.744 1.217 . . . . 2.1699999999999999 112.909 -174.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.3 mt -60.17 -33.65 54.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 118.332 0.515 . . . . 1.0700000000000001 110.896 -174.103 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.497 ' HZ2' ' CD ' ' A' ' 46' ' ' GLU . 23.9 mmmt -67.52 -12.27 59.94 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 121.096 -1.002 . . . . 3.3900000000000001 113.138 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 59.3 mmtt -92.66 -19.65 21.64 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.12 1.368 . . . . 2.6200000000000001 111.757 173.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -91.69 -93.12 0.14 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.632 1.973 . . . . 4.3600000000000003 106.589 178.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -75.52 24.99 0.11 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 128.901 2.88 . . . . 2.5299999999999998 114.544 -161.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 18.4 t -54.81 -25.68 29.83 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.64 -1.287 . . . . 3.0699999999999998 113.237 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.11 -21.43 66.35 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.83 1.652 . . . . 4.2400000000000002 115.332 178.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -108.51 -28.28 4.64 Favored Glycine 0 N--CA 1.476 1.305 0 C-N-CA 124.752 1.168 . . . . 3.79 112.236 163.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.497 ' CD ' ' HZ2' ' A' ' 39' ' ' LYS . 0.2 OUTLIER 83.72 139.59 0.06 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 129.411 3.085 . . . . 7.9299999999999997 111.644 170.001 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.6 mmt -109.07 105.51 15.03 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.51 1.524 . . . . 2.8500000000000001 111.151 -173.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -89.91 164.18 14.68 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.146 1.378 . . . . 4.9900000000000002 110.891 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.25 -50.06 51.22 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 120.997 -1.064 . . . . 5.9100000000000001 111.41 167.416 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.1 t -72.23 41.13 0.08 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.438 1.495 . . . . 3.6699999999999999 113.136 168.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.0 m -160.29 -41.42 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.884 1.674 . . . . 2.3199999999999998 112.66 177.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 33.8 mt -72.3 -38.73 62.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 119.367 0.985 . . . . 2.2999999999999998 112.086 -174.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -80.56 -23.1 40.18 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.757 0.823 . . . . 3.8100000000000001 112.016 -175.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -78.62 -38.99 38.51 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.283 0.633 . . . . 2.7000000000000002 111.673 165.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.79 -44.97 86.65 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.601 -0.714 . . . . 2.6800000000000002 109.509 169.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.2 ttt -58.94 -41.97 88.65 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.306 0.957 . . . . 1.53 112.039 173.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.98 -24.63 67.79 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 119.363 0.983 . . . . 4.2699999999999996 112.77 172.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 t -74.06 -33.18 63.61 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 120.48 -1.388 . . . . 2.3199999999999998 112.37 170.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.7 mp -80.75 -51.75 8.3 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 125.111 1.365 . . . . 2.73 112.816 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -72.69 135.55 45.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.753 0.787 . . . . 1.72 111.886 -178.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.51 -40.45 5.11 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.568 1.547 . . . . 3.5 111.939 178.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 43.4 p-10 -92.93 -11.16 34.06 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 116.389 1.996 . . . . 2.5499999999999998 116.389 -169.123 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.7 t 76.02 29.96 0.75 Allowed 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.881 1.672 . . . . 3.02 113.556 174.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.9 p-10 -90.31 -14.28 33.51 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 126.578 1.951 . . . . 2.3500000000000001 112.691 -176.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 76.27 13.08 2.61 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 128.71 2.804 . . . . 4.3099999999999996 115.674 -174.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -133.91 132.08 39.84 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.557 2.343 . . . . 2.8199999999999998 109.355 -176.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 18.1 mm -98.99 107.84 21.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 120.572 -1.33 . . . . 1.1599999999999999 109.979 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -63.59 161.53 14.55 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.97 0.805 . . . . 3.8100000000000001 112.782 170.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -48.78 -37.39 18.98 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 122.519 1.152 . . . . 2.48 112.21 169.144 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.17 -22.84 48.06 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 116.181 1.919 . . . . 6.71 116.181 174.344 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -78.91 -51.12 10.11 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.398 1.454 . . . . 1.8799999999999999 109.07 170.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -50.25 -22.58 1.81 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 128.055 2.542 . . . . 1.8799999999999999 113.418 175.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.3 m -53.59 -32.51 51.34 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.58 -1.325 . . . . 2.6200000000000001 113.309 170.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 p -75.46 -25.79 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 122.967 0.507 . . . . 2.1400000000000001 111.856 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -63.36 -60.65 3.1 Favored 'General case' 0 C--N 1.343 0.299 0 CA-C-O 118.426 -0.797 . . . . 1.9299999999999999 109.968 172.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -51.93 -46.65 64.76 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.999 0.92 . . . . 2.7799999999999998 111.328 -178.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 56.3 m -55.06 -58.81 6.12 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.906 1.282 . . . . 1.0900000000000001 112.239 176.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 61.0 ttp -59.07 -43.82 91.81 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.633 0.773 . . . . 2.3999999999999999 111.217 -178.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.22 -46.59 80.01 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.535 1.134 . . . . 2.6699999999999999 111.647 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 67.8 m -63.92 -40.92 97.58 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.157 0.583 . . . . 1.8700000000000001 112.307 176.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 59.5 mtp -62.88 -39.33 94.12 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.631 0.65 . . . . 1.8600000000000001 112.029 172.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.01 -37.04 86.31 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.373 0.669 . . . . 1.22 112.554 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -64.03 -28.03 69.52 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.847 1.054 . . . . 2.3199999999999998 113.847 173.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -65.86 -40.5 91.73 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 120.167 1.349 . . . . 2.2400000000000002 111.971 172.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -72.7 -39.52 66.92 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.687 0.795 . . . . 3.2999999999999998 111.697 178.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -52.78 -46.16 67.46 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.037 1.335 . . . . 3.8700000000000001 111.298 172.081 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -62.97 -27.25 69.27 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.488 1.515 . . . . 2.9399999999999999 113.228 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 37.5 mt -80.96 -21.43 40.38 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.543 1.137 . . . . 3.0699999999999998 112.452 176.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.411 ' CD ' ' HZ1' ' A' ' 92' ' ' LYS . 67.3 mm-40 -91.12 -10.24 42.66 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 115.142 1.534 . . . . 3.77 115.142 172.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -83.3 -44.18 15.2 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.737 1.615 . . . . 3.7799999999999998 112.719 169.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -81.72 54.53 2.43 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 126.916 2.086 . . . . 4.5700000000000003 112.348 -167.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.411 ' HZ1' ' CD ' ' A' ' 89' ' ' GLU . 45.9 mmtt . . . . . 0 C--O 1.253 1.272 0 C-N-CA 128.297 2.639 . . . . 5.5800000000000001 115.024 175.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.432 ' HA ' ' OE1' ' B' ' 2' ' ' GLU . 65.3 mtt . . . . . 0 N--CA 1.476 0.826 0 N-CA-C 108.703 -0.851 . . . . 8.2400000000000002 108.703 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.432 ' OE1' ' HA ' ' B' ' 1' ' ' MET . 12.1 mp0 -107.11 -125.59 0.24 Allowed 'General case' 0 CA--C 1.538 0.499 0 O-C-N 125.219 1.574 . . . . 4.8200000000000003 109.432 -151.43 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 3' ' ' THR . . . . . 0.413 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 6.4 p -85.2 170.1 14.29 Favored Pre-proline 0 C--N 1.322 -0.593 0 C-N-CA 130.188 3.395 . . . . 2.8799999999999999 110.26 -169.364 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 4' ' ' PRO . . . . . 0.413 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 42.1 Cg_endo -69.83 -33.14 16.93 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 121.215 1.277 . . . . 1.8799999999999999 112.907 -172.127 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.01 -39.88 68.88 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.085 0.857 . . . . 2.5699999999999998 112.222 -172.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.93 -33.78 67.34 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.595 1.089 . . . . 4.1100000000000003 112.279 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -68.51 -32.28 72.13 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 120.678 -1.264 . . . . 4.7699999999999996 112.522 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -69.04 -51.58 37.55 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.421 1.088 . . . . 0.89000000000000001 110.201 175.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 57.5 mt -54.28 -46.19 72.66 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.584 1.154 . . . . 1.9199999999999999 111.769 174.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 64.4 m -56.65 -52.39 65.08 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.04 0.936 . . . . 1.28 111.181 172.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 51.7 m -55.49 -44.23 76.33 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.659 1.184 . . . . 1.22 111.471 -175.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 9.7 mtt -57.68 -51.77 68.18 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.062 0.945 . . . . 3.27 111.731 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 76.3 t -64.29 -43.59 97.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 124.204 1.001 . . . . 2.0 112.067 178.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 31.3 m -55.6 -58.04 9.44 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.787 1.635 . . . . 1.21 110.248 178.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' THR . . . . . 0.403 ' HG1' ' HE2' ' B' ' 19' ' ' TYR . 0.7 OUTLIER -70.48 -37.85 74.29 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 117.406 -1.283 . . . . 2.6800000000000002 109.571 -174.747 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -57.34 -48.0 80.11 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 118.945 0.793 . . . . 2.1499999999999999 111.003 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.12 -31.97 71.92 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 118.684 0.674 . . . . 2.8300000000000001 111.337 178.158 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 39.0 tttm -69.74 -32.67 71.34 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.304 1.224 . . . . 4.6200000000000001 114.304 173.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.403 ' HE2' ' HG1' ' B' ' 15' ' ' THR . 69.5 m-85 -71.52 -31.55 67.19 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.763 1.225 . . . . 3.3999999999999999 111.569 166.104 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 40.3 t -70.82 -35.16 72.37 Favored 'General case' 0 C--O 1.244 0.785 0 C-N-CA 125.793 1.637 . . . . 1.97 114.86 -176.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.17 7.41 67.47 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 125.375 1.464 . . . . 2.2000000000000002 113.774 167.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.43 -14.9 59.6 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.224 1.512 . . . . 3.8700000000000001 113.496 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' GLU . . . . . 0.563 ' HG2' ' H ' ' B' ' 24' ' ' GLY 0.281 3.5 tm-20 164.0 -167.46 0.01 OUTLIER 'General case' 0 CA--C 1.564 1.502 0 C-N-CA 130.666 3.586 . . . . 3.46 109.712 -176.868 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 24' ' ' GLY . . . . . 0.563 ' H ' ' HG2' ' B' ' 23' ' ' GLU . . . 58.47 -149.07 36.8 Favored Glycine 0 N--CA 1.467 0.751 0 C-N-CA 126.17 1.843 . . . . 3.1200000000000001 112.316 -174.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 41.4 t -66.92 154.73 40.32 Favored 'General case' 0 C--O 1.249 1.071 0 O-C-N 121.27 -1.135 . . . . 2.98 110.274 153.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.0 1.09 37.19 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.415 1.486 . . . . 6.2800000000000002 112.67 177.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 57.8 tp -92.61 -30.11 15.78 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.365 1.466 . . . . 3.6400000000000001 112.239 174.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 16.6 p -128.32 167.38 17.02 Favored 'General case' 0 C--O 1.252 1.202 0 C-N-CA 128.703 2.801 . . . . 1.48 113.679 -163.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 10.5 mt -101.35 114.03 27.64 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.07 1.748 . . . . 1.5700000000000001 110.972 167.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 2.0 p -69.58 165.58 20.79 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.138 -0.976 . . . . 2.9300000000000002 112.935 166.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -41.8 -30.4 0.25 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.905 1.282 . . . . 3.8900000000000001 114.271 169.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.1 -42.96 10.8 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 119.92 -1.738 . . . . 6.1500000000000004 113.082 178.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -52.65 -44.17 65.96 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.621 0.769 . . . . 1.8899999999999999 110.663 167.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.93 -42.99 97.22 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.427 1.891 . . . . 2.3300000000000001 112.404 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -56.45 -40.94 75.64 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 120.274 -1.516 . . . . 3.02 112.457 170.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -68.28 -43.53 77.53 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 117.974 -1.012 . . . . 3.1400000000000001 112.127 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.0 tp -51.41 -61.22 2.38 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 125.294 1.438 . . . . 2.4199999999999999 108.665 173.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 24.5 mt -54.3 -45.23 67.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 CA-C-N 118.739 0.7 . . . . 1.25 109.85 -173.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -72.65 -31.72 65.32 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.223 0.609 . . . . 4.9400000000000004 111.751 -172.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 40' ' ' LYS . . . . . 0.543 ' O ' HG21 ' A' ' 3' ' ' THR . 36.6 mttp -89.25 -28.16 20.11 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 120.624 -1.298 . . . . 3.4199999999999999 113.696 178.226 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -65.83 -61.42 2.07 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.768 1.627 . . . . 5.7199999999999998 110.654 166.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.49 101.46 5.63 Favored 'General case' 0 C--N 1.342 0.253 0 C-N-CA 124.601 1.16 . . . . 2.23 108.454 -178.449 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 5.2 t -70.4 30.82 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 114.557 1.318 . . . . 4.5899999999999999 114.557 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 70.1 mt -118.25 -15.53 9.76 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.158 1.783 . . . . 3.4300000000000002 112.959 -163.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 104.24 -118.84 6.08 Favored Glycine 0 C--N 1.34 0.761 0 C-N-CA 124.454 1.026 . . . . 4.6600000000000001 112.62 177.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -92.5 111.3 22.84 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 113.328 0.862 . . . . 8.4299999999999997 113.328 -164.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 84.0 mmm -65.5 -28.52 69.25 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.823 0.82 . . . . 4.1900000000000004 112.07 155.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 tptt 72.3 144.09 0.07 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.875 2.87 . . . . 6.1200000000000001 111.303 -174.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 20.4 tp10 -49.61 -43.84 46.8 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.268 1.027 . . . . 4.5 113.55 -168.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 24.8 t -66.95 -7.95 25.98 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.316 1.598 . . . . 3.4300000000000002 115.316 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 12.3 t -105.5 -6.49 19.37 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 120.072 1.306 . . . . 2.2400000000000002 113.228 167.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 45.0 mm -73.55 -44.4 53.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 CA-C-N 120.172 1.351 . . . . 1.8500000000000001 110.718 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -71.13 -29.88 65.79 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.812 0.845 . . . . 2.98 112.632 -178.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -71.81 -44.58 63.69 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.847 1.203 . . . . 3.6899999999999999 111.396 167.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.78 -49.61 70.5 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.832 0.742 . . . . 2.1800000000000002 109.266 176.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 14.8 tpt -54.01 -51.32 64.35 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.794 1.638 . . . . 1.8 112.806 173.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -55.8 -39.33 71.17 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.571 1.548 . . . . 5.3099999999999996 112.195 173.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 30.5 m -74.48 -22.72 58.94 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.466 1.506 . . . . 2.04 110.664 -177.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 9.1 mt -83.17 -56.68 3.64 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.317 0.962 . . . . 1.75 113.212 169.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -70.82 139.57 50.96 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.877 0.695 . . . . 1.6599999999999999 112.877 -165.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 37.6 mmtm -135.02 -9.72 2.3 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.623 1.569 . . . . 3.8999999999999999 114.35 -175.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.23 -20.83 50.97 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.913 0.779 . . . . 2.5800000000000001 110.884 164.235 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 22.7 t 72.48 41.13 0.6 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.563 1.945 . . . . 2.7000000000000002 110.82 -178.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -114.43 -125.52 0.28 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.421 1.488 . . . . 3.2400000000000002 108.54 -167.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -144.04 -2.52 0.91 Allowed 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 116.753 2.131 . . . . 4.4500000000000002 116.753 165.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -113.66 141.82 46.76 Favored 'General case' 0 C--O 1.244 0.812 0 C-N-CA 125.853 1.661 . . . . 2.8500000000000001 111.291 177.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 45.1 mm -89.9 111.17 22.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 127.948 2.499 . . . . 1.04 109.846 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.94 159.27 33.01 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 128.092 2.557 . . . . 2.54 111.278 162.061 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -54.08 -35.39 62.03 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.256 1.206 . . . . 2.1299999999999999 114.256 -176.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -71.85 -36.38 70.12 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.71 -1.244 . . . . 3.6200000000000001 111.42 177.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -64.11 -51.78 62.32 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 124.344 1.058 . . . . 1.6799999999999999 109.259 171.146 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -52.05 -43.4 63.78 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.531 1.532 . . . . 2.23 113.309 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 35.8 m -62.91 -21.08 65.77 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.354 -0.841 . . . . 2.6400000000000001 113.098 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 21.2 t -64.24 -40.11 87.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 CA-C-N 119.496 1.044 . . . . 1.6599999999999999 110.661 170.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -59.19 -55.43 35.02 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 118.753 0.706 . . . . 1.8899999999999999 110.665 177.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 66.9 mt -57.77 -38.28 75.16 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.581 1.152 . . . . 1.3899999999999999 110.781 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 99.8 m -61.91 -50.06 73.71 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.179 0.992 . . . . 0.81000000000000005 112.303 173.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.9 mtm -64.57 -37.39 87.4 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 119.559 1.072 . . . . 1.52 112.18 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -60.93 -52.63 64.23 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.63 0.772 . . . . 2.6600000000000001 111.953 172.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 93.8 m -63.86 -35.89 82.14 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.389 0.514 . . . . 1.8300000000000001 112.389 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 49.2 mmm -60.73 -42.92 98.27 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.721 0.808 . . . . 2.1600000000000001 112.834 170.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.6 -33.64 71.26 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.518 1.053 . . . . 0.77000000000000002 112.003 176.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 83' ' ' TYR . . . . . 0.517 ' HB3' HG21 ' A' ' 13' ' ' VAL . 4.4 m-85 -69.82 -23.67 63.35 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.022 1.119 . . . . 2.1699999999999999 114.022 175.387 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -55.29 -49.6 71.71 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 120.561 1.528 . . . . 2.4399999999999999 111.056 166.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.16 -36.44 58.72 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.103 1.761 . . . . 3.04 112.196 -174.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -54.82 -47.14 74.44 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.217 1.407 . . . . 2.3700000000000001 111.281 166.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -67.18 -25.82 66.33 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.474 1.11 . . . . 2.0299999999999998 112.941 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 71.6 mt -78.2 -26.83 47.71 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 118.112 -0.947 . . . . 1.72 112.824 174.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -97.39 10.94 38.34 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.561 1.544 . . . . 3.71 114.263 174.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -93.56 -54.36 3.69 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.739 1.215 . . . . 3.1200000000000001 112.047 162.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -82.66 37.73 0.54 Allowed 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 125.866 1.666 . . . . 3.1400000000000001 112.721 -176.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.26 1.607 0 N-CA-C 118.896 2.924 . . . . 5.25 118.896 -145.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.2 mtt . . . . . 0 N--CA 1.478 0.933 0 N-CA-C 107.918 -1.141 . . . . 7.5700000000000003 107.918 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -139.02 139.3 37.8 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 105.787 -1.931 . . . . 4.0 105.787 -165.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 79.4 p -60.93 162.7 11.68 Favored Pre-proline 0 C--N 1.325 -0.483 0 C-N-CA 126.077 1.751 . . . . 1.4399999999999999 113.869 -170.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -61.8 -18.52 61.19 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.421 2.081 . . . . 1.3400000000000001 112.504 164.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.12 -45.37 34.05 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.508 1.049 . . . . 2.3199999999999998 110.562 175.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -61.32 -37.9 84.93 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.905 -1.122 . . . . 4.5599999999999996 111.148 172.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -69.79 -31.54 69.52 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.019 -1.05 . . . . 3.4199999999999999 112.971 172.446 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.67 -48.52 66.41 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.743 1.217 . . . . 0.90000000000000002 111.603 173.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 74.6 mt -57.85 -47.38 82.86 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.89 1.276 . . . . 1.5800000000000001 110.66 172.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 89.2 m -54.13 -48.48 70.76 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.113 1.365 . . . . 1.6200000000000001 111.8 172.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 92.1 m -66.55 -35.82 81.16 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.968 1.307 . . . . 1.3300000000000001 111.553 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -45.69 66.94 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.717 0.807 . . . . 4.0599999999999996 111.699 176.345 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.2 p -65.31 -29.72 48.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 119.355 0.98 . . . . 2.1000000000000001 112.234 171.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 55.3 m -63.83 -54.77 29.88 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 117.654 -1.165 . . . . 0.87 111.074 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.6 p -60.01 -36.64 77.66 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 119.525 1.057 . . . . 2.1299999999999999 110.481 174.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -68.06 -54.55 17.47 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 119.379 -0.928 . . . . 2.1800000000000002 110.928 -175.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -64.67 -29.44 70.44 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.921 0.888 . . . . 2.5 113.276 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 58.4 tttt -62.95 -70.84 0.18 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 127.537 2.335 . . . . 5.04 112.579 166.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -65.68 -24.85 67.11 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.136 -0.978 . . . . 2.0899999999999999 112.099 -172.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.7 t -60.21 -26.68 66.58 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 114.9 1.444 . . . . 1.8700000000000001 114.9 170.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -95.37 5.86 67.99 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 125.802 1.668 . . . . 1.3600000000000001 114.083 175.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.43 -44.74 92.83 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.96 1.38 . . . . 3.8999999999999999 111.462 172.298 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -146.69 161.05 41.4 Favored 'General case' 0 C--O 1.253 1.28 0 CA-C-O 123.49 1.614 . . . . 4.6799999999999997 113.24 176.386 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.18 -128.57 47.73 Favored Glycine 0 C--N 1.34 0.77 0 C-N-CA 126.944 2.211 . . . . 2.04 111.733 164.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.0 m -52.72 125.27 16.17 Favored 'General case' 0 C--O 1.245 0.822 0 C-N-CA 123.189 0.595 . . . . 2.8799999999999999 110.33 166.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -83.33 -2.88 56.79 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.223 1.009 . . . . 5.3200000000000003 113.328 176.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 9.8 mp -89.88 -34.13 16.2 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.878 2.071 . . . . 4.2000000000000002 111.691 174.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -126.98 163.52 23.51 Favored 'General case' 0 C--O 1.254 1.313 0 C-N-CA 127.661 2.384 . . . . 1.3 114.874 -167.042 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -109.35 105.63 15.1 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 127.582 2.353 . . . . 2.5899999999999999 112.097 -171.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.7 t -84.42 164.45 18.87 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.789 2.036 . . . . 1.96 112.057 175.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.1 tmm_? -60.96 -22.15 64.16 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 116.509 2.04 . . . . 4.8600000000000003 116.509 -161.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.62 -41.27 16.54 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 120.635 -1.291 . . . . 6.0 111.901 166.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -54.46 -49.97 68.81 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 120.302 1.41 . . . . 1.4299999999999999 110.532 175.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -65.64 -45.84 81.5 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.956 1.703 . . . . 2.6400000000000001 112.452 -177.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.255 1.1 ptmt -73.0 -32.69 65.31 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 118.111 -1.436 . . . . 3.6800000000000002 112.67 176.635 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -61.9 -44.34 96.99 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.434 1.47 . . . . 3.5299999999999998 112.97 171.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.9 tp -51.64 -64.96 0.65 Allowed 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 126.292 1.837 . . . . 2.1099999999999999 110.161 170.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 84.6 mt -55.44 -45.56 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-O 118.349 -0.834 . . . . 0.94999999999999996 111.641 -176.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.428 ' HZ3' ' CD ' ' A' ' 49' ' ' GLU . 24.2 mmmt -55.32 -28.74 55.68 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 118.69 0.677 . . . . 3.7400000000000002 112.69 -174.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -97.52 -34.42 11.0 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.472 1.909 . . . . 3.4399999999999999 113.286 -173.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -85.28 -50.43 7.36 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.357 0.663 . . . . 5.3399999999999999 111.616 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.9 mp -92.76 54.89 2.31 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.678 1.591 . . . . 3.3100000000000001 109.518 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.5 t -79.67 35.92 0.31 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.506 1.122 . . . . 2.9900000000000002 113.586 -166.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -91.9 -8.59 45.93 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 116.76 2.133 . . . . 3.9199999999999999 116.76 -161.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 97.86 1.71 58.55 Favored Glycine 0 N--CA 1.474 1.202 0 CA-C-N 119.179 0.899 . . . . 2.9199999999999999 114.437 -176.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.7 -152.4 0.29 Allowed 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 107.941 -1.133 . . . . 6.6500000000000004 107.941 143.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.88 39.48 20.35 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 124.165 1.936 . . . . 2.0499999999999998 110.736 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -74.52 141.71 44.83 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 112.396 -2.184 . . . . 4.6500000000000004 109.586 174.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.428 ' CD ' ' HZ3' ' A' ' 39' ' ' LYS . 2.0 mm-40 -52.1 -39.92 60.51 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.799 1.778 . . . . 4.46 115.799 -148.451 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.1 p -78.4 -28.87 46.95 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 115.337 1.606 . . . . 2.6600000000000001 115.337 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.3 t -56.25 -30.77 62.85 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.999 1.32 . . . . 1.8300000000000001 110.99 172.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 3.1 mt -74.68 -25.56 19.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 C-N-CA 124.141 0.976 . . . . 1.8 112.497 -176.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -86.81 -30.33 21.59 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.627 0.649 . . . . 3.6099999999999999 111.642 178.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -71.82 -34.51 69.38 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.193 0.906 . . . . 2.8199999999999998 111.621 167.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 53.8 tp -61.28 -52.59 64.1 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 117.34 -1.314 . . . . 1.72 110.15 165.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.2 ttt -53.33 -48.87 68.1 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 121.421 1.919 . . . . 1.54 112.112 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.69 -29.83 8.14 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.779 1.632 . . . . 3.52 113.361 174.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 50.2 m -93.49 -29.01 15.76 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.278 1.831 . . . . 2.6899999999999999 112.486 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.4 mt -78.66 -30.45 46.25 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.253 1.021 . . . . 2.2999999999999998 112.596 175.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -73.02 70.63 1.05 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.394 1.477 . . . . 1.3799999999999999 110.769 175.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.3 ttmp? -50.97 -29.61 12.74 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 115.602 1.705 . . . . 4.2199999999999998 115.602 -162.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -95.15 -18.98 20.47 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 115.495 1.665 . . . . 3.0899999999999999 115.495 175.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 59.96 108.94 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.363 1.465 . . . . 3.8500000000000001 112.221 -153.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.4 p30 -140.0 -78.73 0.31 Allowed 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.962 -1.086 . . . . 2.8399999999999999 110.405 173.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -166.81 -28.79 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 130.615 3.566 . . . . 5.8399999999999999 112.218 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -154.4 166.79 32.13 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.564 1.145 . . . . 2.2599999999999998 112.81 -173.269 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 6.9 mm -98.07 108.78 22.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 125.275 1.43 . . . . 0.98999999999999999 112.376 -170.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -74.67 159.13 32.47 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.814 1.646 . . . . 2.7000000000000002 111.665 165.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -46.38 -45.99 18.17 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.124 -1.61 . . . . 2.6400000000000001 113.281 170.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.4 pttm -72.53 -6.59 45.01 Favored 'General case' 0 CA--C 1.55 0.964 0 O-C-N 121.329 -0.857 . . . . 3.1800000000000002 113.282 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -91.42 -61.26 1.69 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.359 1.464 . . . . 1.5900000000000001 109.34 163.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -54.84 -22.96 16.23 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 128.019 2.528 . . . . 2.8500000000000001 115.497 -175.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.45 -30.68 20.51 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 124.986 1.315 . . . . 2.6400000000000001 112.484 167.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.2 p -69.16 -36.26 72.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 119.083 0.856 . . . . 2.4199999999999999 112.184 176.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -60.98 -48.14 83.2 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 118.966 0.803 . . . . 2.1299999999999999 111.317 174.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 73.0 mt -63.21 -36.13 82.61 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.78 0.832 . . . . 1.9399999999999999 111.573 177.117 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 57.8 m -66.2 -47.12 74.93 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.573 1.149 . . . . 0.83999999999999997 111.228 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.9 mtp -57.41 -43.35 83.7 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.826 1.25 . . . . 1.79 111.705 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 72.8 mt -67.8 -45.02 75.95 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.595 0.758 . . . . 1.4099999999999999 111.725 178.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 5.4 m -59.84 -34.79 73.56 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.547 1.067 . . . . 1.3400000000000001 113.749 174.177 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 56.3 mtp -72.44 -34.19 67.62 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.438 0.563 . . . . 2.27 112.026 174.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.34 -47.07 68.47 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.591 -0.693 . . . . 0.80000000000000004 112.499 175.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -68.83 -26.63 65.26 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.361 -0.837 . . . . 2.3100000000000001 113.147 176.053 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -63.86 -49.75 71.54 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.679 0.791 . . . . 2.73 111.902 168.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -60.84 -46.4 90.72 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.319 1.048 . . . . 3.29 111.878 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -50.26 -50.87 48.81 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.559 1.544 . . . . 2.1800000000000002 111.494 175.158 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -64.28 -26.58 68.56 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.197 1.399 . . . . 2.0600000000000001 113.201 -177.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 32.5 mt -78.01 -18.91 55.35 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.812 0.845 . . . . 1.5 111.926 175.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.438 ' CD ' ' HZ3' ' A' ' 92' ' ' LYS . 71.0 mm-40 -91.9 -36.76 13.29 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.165 1.386 . . . . 3.4100000000000001 113.811 173.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -61.52 -28.51 69.36 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.399 1.88 . . . . 3.46 113.607 177.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -91.48 14.95 13.38 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 114.798 1.407 . . . . 2.7000000000000002 114.798 -169.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.438 ' HZ3' ' CD ' ' A' ' 89' ' ' GLU . 58.2 mttp . . . . . 0 C--O 1.251 1.147 0 CA-C-O 115.034 -2.412 . . . . 3.71 116.01 -177.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 79.9 mmm . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 120.668 0.27 . . . . 7.8399999999999999 111.313 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -86.0 128.35 34.84 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 123.803 0.841 . . . . 6.5 110.083 -157.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' THR . . . . . 0.414 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 80.5 p -78.06 175.15 4.9 Favored Pre-proline 0 N--CA 1.472 0.656 0 C-N-CA 126.293 1.837 . . . . 1.6599999999999999 113.733 -165.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 4' ' ' PRO . . . . . 0.414 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 17.6 Cg_endo -52.0 -23.14 16.09 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 124.529 3.486 . . . . 1.53 114.954 163.101 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 56.1 tp -70.41 -48.64 55.13 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 120.092 1.314 . . . . 2.7200000000000002 110.29 174.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.09 -30.65 70.48 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.308 0.504 . . . . 4.8399999999999999 111.203 172.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 21.9 mmtt -66.27 -25.57 66.93 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 119.717 -1.864 . . . . 4.5199999999999996 113.126 169.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.28 -45.32 73.42 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 119.9 1.227 . . . . 0.98999999999999999 111.613 172.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -60.56 -43.2 97.51 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.711 1.204 . . . . 2.8999999999999999 111.655 170.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 25.9 m -57.32 -47.15 82.29 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.192 1.397 . . . . 1.28 111.496 173.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 87.0 m -58.68 -44.29 90.18 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.223 1.009 . . . . 1.3799999999999999 109.867 175.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 3.0 tpp -53.83 -51.47 63.44 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.292 1.037 . . . . 3.3700000000000001 112.61 177.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 10.6 m -67.6 -27.65 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 CA-C-N 118.801 0.728 . . . . 2.1800000000000002 112.511 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 66.2 m -68.34 -47.13 68.31 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.538 1.135 . . . . 0.75 110.93 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.91 -40.63 89.5 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.159 0.584 . . . . 1.73 110.007 166.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -63.66 -55.75 21.06 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 120.276 -0.57 . . . . 1.95 111.355 -169.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 18.7 m170 -62.35 -35.39 78.97 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.454 0.701 . . . . 3.5800000000000001 112.344 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -74.59 -29.85 61.48 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.489 0.922 . . . . 4.1900000000000004 113.489 -175.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -94.95 -37.55 11.1 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.994 1.318 . . . . 2.1099999999999999 112.426 175.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 84.1 p -57.65 -33.27 68.11 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.777 1.171 . . . . 1.9099999999999999 112.666 176.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.88 -3.4 73.75 Favored Glycine 0 CA--C 1.528 0.901 0 CA-C-O 116.378 -2.345 . . . . 1.3400000000000001 116.282 -170.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -65.29 -39.65 92.83 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.779 2.29 . . . . 4.9500000000000002 112.338 178.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -122.0 126.87 49.5 Favored 'General case' 0 C--O 1.254 1.298 0 C-N-CA 129.074 2.949 . . . . 3.3599999999999999 110.46 176.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.98 -128.55 42.6 Favored Glycine 0 C--N 1.337 0.61 0 C-N-CA 126.059 1.79 . . . . 2.1899999999999999 113.646 166.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -52.04 148.11 6.52 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.373 2.669 . . . . 3.3599999999999999 114.194 172.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -106.82 -6.32 17.79 Favored 'General case' 0 CA--C 1.553 1.059 0 N-CA-C 114.45 1.278 . . . . 6.4299999999999997 114.45 -175.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 97.0 mt -99.49 3.56 45.66 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.926 1.29 . . . . 3.3900000000000001 113.005 175.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 2.0 p -145.64 137.95 25.6 Favored 'General case' 0 C--O 1.246 0.871 0 C-N-CA 125.667 1.587 . . . . 1.23 111.938 -166.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 48.4 mt -84.45 126.97 33.74 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 114.605 -1.18 . . . . 1.97 109.926 173.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 3.1 m -105.92 150.34 25.75 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 127.037 2.135 . . . . 3.4500000000000002 110.291 -168.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 31' ' ' ARG . . . . . 0.494 HH11 ' HG3' ' B' ' 31' ' ' ARG . 5.6 mmm-85 -37.61 -46.69 0.88 Allowed 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 117.095 2.258 . . . . 4.3300000000000001 117.095 -165.47 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.71 -34.23 22.97 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 119.604 1.093 . . . . 4.0300000000000002 112.635 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -50.02 -36.54 29.07 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.386 0.994 . . . . 1.8300000000000001 111.087 165.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.404 ' CD1' HD11 ' B' ' 38' ' ' ILE . 0.3 OUTLIER -70.34 -37.98 74.77 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 112.606 0.595 . . . . 2.2999999999999998 112.606 -174.827 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 26.7 mmtm -63.91 -44.08 94.02 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.646 1.178 . . . . 5.6399999999999997 111.777 171.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 36.2 tp10 -74.5 -15.24 60.88 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 125.56 1.544 . . . . 3.0600000000000001 112.812 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 44.7 tp -96.85 -52.17 3.99 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 120.964 1.711 . . . . 2.1299999999999999 111.831 175.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 0.404 HD11 ' CD1' ' B' ' 34' ' ' LEU . 36.6 mt -52.03 -52.04 26.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 CA-C-N 121.306 1.866 . . . . 1.2 109.995 -179.044 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 tttp -71.8 10.96 0.58 Allowed 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 125.394 1.478 . . . . 4.7999999999999998 113.528 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -128.43 -39.7 1.66 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.43 2.292 . . . . 3.4399999999999999 113.941 175.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -70.98 -13.7 62.1 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 119.505 1.048 . . . . 5.1100000000000003 112.514 169.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -134.45 114.46 12.91 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.925 1.69 . . . . 2.3199999999999998 108.292 175.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 12.3 p -85.66 -11.37 53.98 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.548 1.684 . . . . 4.5899999999999999 115.548 -166.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -58.49 -11.99 3.5 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 117.659 2.466 . . . . 3.9399999999999999 117.659 -163.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.36 -49.56 2.67 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 125.188 1.375 . . . . 3.5600000000000001 113.617 177.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -71.13 66.64 0.42 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.7 2.4 . . . . 5.3300000000000001 110.24 174.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.58 -26.3 8.72 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.866 1.666 . . . . 4.0800000000000001 111.558 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 20.0 mtpp 72.54 84.5 0.12 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.869 2.068 . . . . 4.6900000000000004 113.287 159.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -27.76 -52.2 0.08 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 128.856 2.862 . . . . 5.0199999999999996 116.445 -178.22 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 3.0 m -57.83 -28.8 64.42 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.857 1.208 . . . . 2.8199999999999998 114.215 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 15.0 t -77.75 -8.2 57.64 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.368 1.067 . . . . 3.1400000000000001 113.765 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 49.3 mt -85.2 -40.06 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 120.322 1.419 . . . . 1.8700000000000001 113.804 -165.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.24 -23.41 61.22 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 118.981 0.81 . . . . 3.1899999999999999 111.221 172.411 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -76.15 -44.52 37.92 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.451 0.7 . . . . 2.73 111.504 169.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 51.4 tp -55.01 -45.65 75.13 Favored 'General case' 0 C--N 1.344 0.355 0 O-C-N 121.039 -1.038 . . . . 2.21 110.045 168.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 56' ' ' MET . . . . . 0.415 ' SD ' ' HD2' ' B' ' 31' ' ' ARG . 4.6 ttt -58.26 -51.12 71.12 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.951 0.796 . . . . 1.9199999999999999 111.463 175.396 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -54.97 -28.39 51.2 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.649 1.179 . . . . 4.0999999999999996 113.311 173.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.0 t -81.2 -30.3 34.34 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.31 1.044 . . . . 2.0 112.933 177.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 96.1 mt -86.25 -35.89 19.71 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.0 1.32 . . . . 2.3100000000000001 112.798 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -75.94 70.99 2.72 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.489 1.915 . . . . 1.6599999999999999 111.129 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.91 -8.91 2.49 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.475 1.51 . . . . 3.21 114.996 -173.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -110.07 -0.63 17.93 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 120.05 1.295 . . . . 2.5800000000000001 113.71 172.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 73.8 m 55.81 33.93 22.46 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.176 1.39 . . . . 2.7799999999999998 113.628 -178.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -102.37 3.8 38.27 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 129.799 3.24 . . . . 2.46 112.033 -168.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 67.26 -10.3 0.35 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 131.117 3.767 . . . . 4.0599999999999996 115.454 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -109.74 144.88 37.52 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 126.163 1.785 . . . . 2.6499999999999999 110.391 175.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 19.8 mt -114.22 106.7 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 O-C-N 121.161 -0.962 . . . . 1.25 111.241 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -68.91 159.99 31.59 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.989 2.116 . . . . 2.8799999999999999 110.923 172.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.6 -35.48 54.42 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 120.145 -1.597 . . . . 2.5800000000000001 112.829 170.284 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -63.53 -25.05 68.07 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.623 0.769 . . . . 3.8999999999999999 113.059 173.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -89.47 -54.77 3.94 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 125.835 1.654 . . . . 1.8300000000000001 110.17 174.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -58.42 -32.19 68.42 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 127.0 2.12 . . . . 1.76 113.908 -176.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 9.1 p -53.88 -28.01 33.69 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.199 -1.563 . . . . 1.8999999999999999 113.587 168.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 59.7 t -72.31 -31.23 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 120.265 1.393 . . . . 1.6399999999999999 111.25 177.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -63.43 -54.51 35.47 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.556 -0.715 . . . . 2.4399999999999999 110.192 173.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 72.1 mt -54.33 -40.1 67.68 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.552 1.141 . . . . 1.3300000000000001 111.366 174.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.4 m -59.94 -53.97 51.58 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.047 0.939 . . . . 0.80000000000000004 111.544 176.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.9 mtm -60.55 -40.04 90.15 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.373 0.533 . . . . 1.6000000000000001 112.222 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 98.1 mt -59.27 -52.43 65.68 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.356 0.662 . . . . 1.5 110.685 174.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 93.2 m -59.28 -33.55 71.19 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.537 1.31 . . . . 1.6399999999999999 114.537 177.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 81.6 mtp -70.19 -33.72 72.07 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.71 0.804 . . . . 1.99 112.74 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.73 -34.76 58.09 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.42 1.009 . . . . 0.92000000000000004 112.079 171.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -62.03 -27.53 68.95 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.133 0.973 . . . . 2.29 112.926 175.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -60.9 -51.72 68.08 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.738 0.815 . . . . 2.23 111.154 170.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.7 -30.64 64.39 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 126.142 1.777 . . . . 3.2200000000000002 111.913 -176.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.68 -51.19 70.43 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.492 1.517 . . . . 2.1299999999999999 110.793 166.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -61.29 -28.32 69.11 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.786 0.834 . . . . 2.2799999999999998 112.336 178.21 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 63.8 mt -70.64 -39.72 73.5 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.5 -0.75 . . . . 2.1499999999999999 112.083 171.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -75.55 -19.13 59.51 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 115.087 1.514 . . . . 3.3500000000000001 115.087 177.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -78.43 -32.61 48.66 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.143 1.377 . . . . 4.1200000000000001 112.547 171.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -83.6 -8.55 59.29 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.696 0.999 . . . . 3.75 113.696 -173.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.892 0 CA-C-O 116.335 -1.793 . . . . 5.96 115.462 -167.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 107.565 -1.272 . . . . 5.96 107.565 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -115.76 -104.17 0.41 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 125.527 1.767 . . . . 4.0 106.856 -157.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 81.2 p -113.12 155.09 44.85 Favored Pre-proline 0 N--CA 1.466 0.343 0 C-N-CA 124.661 1.184 . . . . 2.0299999999999998 110.316 165.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -67.7 -16.23 46.05 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 121.95 1.766 . . . . 2.27 111.339 165.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.37 -50.44 65.55 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 123.871 0.868 . . . . 2.3700000000000001 111.02 -178.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -58.95 -43.58 91.3 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 118.778 0.717 . . . . 3.6299999999999999 111.777 173.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.37 -24.16 65.67 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.246 -0.909 . . . . 5.6900000000000004 111.428 -175.36 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.52 -49.94 23.97 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.789 0.836 . . . . 1.8 111.094 166.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.5 mt -53.64 -32.11 50.05 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.48 1.036 . . . . 2.4399999999999999 112.176 175.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.27 -40.8 62.21 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 117.571 -1.204 . . . . 2.4500000000000002 112.137 173.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.5 t -61.81 -26.09 67.89 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 120.288 1.403 . . . . 3.0899999999999999 112.187 -177.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 13.4 mtm -65.23 -37.43 87.23 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.798 0.839 . . . . 3.1299999999999999 111.026 174.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 67.1 t -76.81 -32.7 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.076 1.351 . . . . 1.98 111.357 173.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 51.6 m -64.04 -49.41 72.48 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.295 1.038 . . . . 1.1799999999999999 110.65 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.4 p -64.72 -33.31 75.66 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.691 0.678 . . . . 2.3999999999999999 110.108 173.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.41 -56.5 19.61 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 118.411 0.55 . . . . 2.3300000000000001 109.627 178.339 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -45.67 84.37 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 120.48 -1.387 . . . . 2.6099999999999999 111.68 -178.318 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -68.23 -49.1 62.94 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.151 -0.968 . . . . 6.29 113.373 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -76.97 -28.17 55.04 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.875 1.216 . . . . 2.1600000000000001 112.427 178.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.8 p -68.97 -25.57 64.6 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-N 120.955 1.707 . . . . 2.1600000000000001 112.274 170.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -82.91 3.7 82.85 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 125.96 1.743 . . . . 1.9299999999999999 114.298 167.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.6 ttt-85 -64.21 -31.7 73.0 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.865 1.832 . . . . 6.2300000000000004 111.25 171.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -157.41 147.39 20.61 Favored 'General case' 0 C--O 1.249 1.075 0 C-N-CA 124.226 1.01 . . . . 3.8900000000000001 112.878 178.571 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.49 -123.63 30.78 Favored Glycine 0 C--N 1.338 0.694 0 C-N-CA 126.129 1.823 . . . . 2.7000000000000002 112.636 160.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.0 m -47.13 112.5 0.53 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.83 1.252 . . . . 3.3599999999999999 110.752 169.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.16 24.85 2.36 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.582 1.553 . . . . 4.6399999999999997 114.372 -169.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.5 tp -143.44 -43.23 0.28 Allowed 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 124.971 1.308 . . . . 4.1200000000000001 110.559 -177.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 16.9 p -79.83 144.52 33.42 Favored 'General case' 0 C--O 1.248 0.996 0 CA-C-O 122.859 1.314 . . . . 0.93000000000000005 110.849 172.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 28.0 mt -88.26 92.17 9.06 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 105.916 -1.883 . . . . 1.7 105.916 165.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.1 t -60.5 149.77 33.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 119.009 -0.52 . . . . 2.04 109.994 169.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -37.61 -49.7 1.11 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.507 1.923 . . . . 3.9199999999999999 113.26 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.492 ' H ' ' HD3' ' A' ' 32' ' ' LYS . 0.8 OUTLIER -70.06 -28.58 65.56 Favored 'General case' 0 CA--C 1.554 1.121 0 O-C-N 119.51 -1.994 . . . . 5.4900000000000002 115.032 -179.837 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -74.91 -38.37 61.84 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.42 1.488 . . . . 1.5800000000000001 109.921 174.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.7 tp -63.4 -39.63 95.02 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.878 0.871 . . . . 1.8300000000000001 111.462 173.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.2 ttmt -55.25 -40.41 70.88 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 119.094 0.861 . . . . 3.8199999999999998 112.005 175.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -60.6 -59.03 6.04 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.963 0.905 . . . . 3.5099999999999998 111.647 170.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.7 tp -56.34 -48.77 76.09 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.412 1.485 . . . . 2.0699999999999998 113.641 -172.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.2 mt -53.57 -61.32 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 CA-C-N 118.64 0.655 . . . . 0.93000000000000005 110.246 -174.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.87 1.04 28.59 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 113.608 0.966 . . . . 5.1299999999999999 113.608 -172.372 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 43.6 mmtt -91.77 -33.58 14.94 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.012 1.325 . . . . 2.9300000000000002 112.859 174.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -89.24 -51.66 5.46 Favored 'General case' 0 CA--C 1.532 0.25 0 O-C-N 124.265 0.978 . . . . 5.2400000000000002 110.303 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 46.7 mt -78.96 67.27 4.62 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.714 1.206 . . . . 2.6899999999999999 111.33 -176.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 98.9 m -63.78 -12.95 39.82 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.349 1.611 . . . . 3.8799999999999999 115.349 -163.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.503 HD23 ' H ' ' A' ' 44' ' ' LEU . 1.6 pt? -99.69 0.59 42.21 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 126.789 2.036 . . . . 3.5099999999999998 114.733 178.042 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -82.51 121.77 5.54 Favored Glycine 0 CA--C 1.531 1.088 0 O-C-N 121.595 -0.691 . . . . 3.79 114.109 -168.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -72.78 60.17 0.5 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.008 1.723 . . . . 6.2599999999999998 111.347 165.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.3 mmt -78.19 68.99 4.33 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 124.054 1.883 . . . . 3.4199999999999999 110.793 173.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -58.84 113.87 2.27 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 113.083 -1.871 . . . . 5.04 108.301 174.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -52.35 -35.98 52.48 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 117.097 2.258 . . . . 4.7199999999999998 117.097 -136.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.9 t -57.62 -25.56 60.29 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 120.541 1.519 . . . . 3.6600000000000001 113.597 177.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.1 t -69.34 -17.92 63.75 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.991 -1.068 . . . . 2.98 113.611 174.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 17.8 mm -61.08 -41.74 90.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 119.897 1.226 . . . . 1.55 109.679 168.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -77.59 -39.05 46.9 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.61 1.164 . . . . 3.4300000000000002 111.89 -169.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.46 ' CG ' ' HE2' ' A' ' 57' ' ' LYS . 1.2 m-20 -79.33 -26.93 42.1 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.589 1.156 . . . . 3.9700000000000002 112.888 175.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 43.9 tp -59.88 -52.99 63.07 Favored 'General case' 0 C--N 1.344 0.326 0 CA-C-N 118.858 0.754 . . . . 1.97 109.116 159.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -55.99 -48.62 75.52 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.295 1.038 . . . . 2.1899999999999999 111.544 -176.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.46 ' HE2' ' CG ' ' A' ' 54' ' ' ASP . 16.3 mtmm -51.92 -36.98 50.89 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.838 1.255 . . . . 5.0 114.304 171.563 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 50.8 m -84.27 -18.82 35.17 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.177 1.391 . . . . 2.5699999999999998 113.882 -178.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 97.8 mt -83.93 -54.54 4.8 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 124.412 1.085 . . . . 2.1299999999999999 109.973 170.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -78.72 90.22 4.61 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.438 1.095 . . . . 1.6799999999999999 112.482 175.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -78.91 -2.39 39.72 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.95 0.722 . . . . 3.2200000000000002 112.95 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -83.03 -30.46 28.06 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 114.299 1.222 . . . . 2.0800000000000001 114.299 173.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 28.6 t 64.63 23.93 12.9 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.998 0.919 . . . . 3.02 113.131 -159.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 55.3 p-10 -81.8 -10.41 59.34 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.039 1.336 . . . . 2.3999999999999999 111.813 176.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 63.57 4.61 1.85 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 129.545 3.138 . . . . 3.6899999999999999 114.247 -171.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -106.52 131.03 54.17 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 128.508 2.723 . . . . 2.5099999999999998 110.002 175.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 35.0 mm -87.9 113.97 25.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 O-C-N 120.62 -1.3 . . . . 1.51 108.936 168.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -76.87 162.37 27.67 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.462 1.505 . . . . 2.6499999999999999 109.485 167.12 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.37 -43.3 79.06 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 119.91 -1.744 . . . . 3.1000000000000001 112.944 -176.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.1 pttm -70.19 -14.51 62.66 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.023 1.329 . . . . 3.1099999999999999 114.435 174.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -85.41 -41.76 15.14 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.506 1.123 . . . . 1.9399999999999999 110.666 168.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -57.48 -29.85 64.59 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.637 -1.289 . . . . 2.3100000000000001 112.637 174.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.0 m -51.49 -32.42 27.37 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.678 1.191 . . . . 1.6699999999999999 113.738 166.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 32.7 t -70.06 -39.91 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-N 119.652 1.115 . . . . 1.8700000000000001 109.597 179.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -64.76 -54.13 36.21 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 123.458 0.703 . . . . 2.1000000000000001 109.368 177.174 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.1 mt -58.58 -35.43 72.4 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.232 1.013 . . . . 1.8500000000000001 112.075 178.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 86.3 m -63.99 -55.65 20.82 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.378 0.99 . . . . 0.80000000000000004 110.509 175.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 77.2 mtm -59.75 -43.88 94.09 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 118.921 0.782 . . . . 1.51 112.193 -175.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.01 -51.97 64.76 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.928 0.891 . . . . 2.4300000000000002 112.215 174.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 8.9 t -63.06 -32.3 73.64 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.38 0.511 . . . . 1.3899999999999999 112.38 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 80.6 mtp -69.55 -32.67 71.61 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.11 0.782 . . . . 1.54 113.11 171.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.64 -43.09 94.78 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.81 1.186 . . . . 0.90000000000000002 111.776 172.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -63.68 -28.17 69.72 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.077 1.14 . . . . 2.2400000000000002 114.077 176.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -61.12 -47.56 85.68 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.805 0.73 . . . . 1.77 111.673 171.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -66.85 -43.94 82.36 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.322 0.649 . . . . 3.1899999999999999 111.414 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -51.08 61.71 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.73 1.612 . . . . 2.1400000000000001 111.609 175.754 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -66.55 -35.03 79.22 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.192 -0.942 . . . . 3.5299999999999998 111.789 -178.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.1 mt -68.55 -33.05 73.43 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.299 0.64 . . . . 2.3799999999999999 112.092 175.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -75.87 -35.62 59.83 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 114.054 1.131 . . . . 2.8199999999999998 114.054 177.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -71.9 -26.57 62.38 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.17 1.788 . . . . 3.6299999999999999 112.678 178.367 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -87.79 14.27 9.01 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.553 1.316 . . . . 2.6800000000000002 114.553 -177.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.954 0 C-N-CA 126.479 1.912 . . . . 4.3600000000000003 113.507 178.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.0 ttp . . . . . 0 N--CA 1.475 0.789 0 N-CA-C 104.493 -2.41 . . . . 5.2699999999999996 104.493 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.78 -170.16 2.85 Favored 'General case' 0 CA--C 1.557 1.231 0 O-C-N 124.083 0.864 . . . . 4.5899999999999999 109.104 129.061 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 3' ' ' THR . . . . . 0.486 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 72.3 p -121.43 177.6 1.46 Allowed Pre-proline 0 N--CA 1.482 1.168 0 C-N-CA 125.057 1.343 . . . . 1.6399999999999999 113.677 -161.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 4' ' ' PRO . . . . . 0.486 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 24.6 Cg_endo -59.07 -31.02 94.81 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.47 2.113 . . . . 1.5 113.404 167.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.99 -48.41 71.31 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 119.642 1.11 . . . . 2.6600000000000001 111.409 178.414 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -64.77 -39.65 93.96 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 118.773 0.715 . . . . 3.7200000000000002 111.891 174.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -58.09 -31.14 66.83 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.354 -1.466 . . . . 4.6200000000000001 112.632 172.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.35 -31.36 72.1 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.977 0.808 . . . . 1.02 112.631 175.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 58.0 mt -65.82 -52.32 51.56 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.334 1.054 . . . . 2.1400000000000001 110.033 175.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 90.4 m -52.46 -43.64 65.06 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.998 1.319 . . . . 1.8799999999999999 111.51 172.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 59.7 m -64.58 -40.67 95.95 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.764 1.226 . . . . 1.5800000000000001 112.534 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 1.5 tmm? -74.48 -43.81 54.32 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 118.624 0.647 . . . . 3.75 112.598 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 16.4 m -61.76 -20.48 23.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 O-C-N 120.636 -1.29 . . . . 2.3999999999999999 112.065 174.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 98.4 m -63.59 -55.5 23.27 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 117.388 -1.291 . . . . 1.6599999999999999 111.782 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 17.0 p -66.79 -33.46 75.67 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 120.048 1.295 . . . . 1.9399999999999999 110.188 175.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -65.0 -46.52 81.06 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 120.803 -0.359 . . . . 2.1099999999999999 111.917 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 23.8 m-70 -64.21 -49.56 71.48 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.096 0.958 . . . . 4.3799999999999999 111.343 171.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -56.15 -43.5 78.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.664 0.785 . . . . 4.5300000000000002 112.763 -175.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -91.66 -31.42 15.85 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.611 1.164 . . . . 2.71 113.174 -177.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 72.9 m -65.81 -42.07 91.09 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 121.271 1.85 . . . . 1.8999999999999999 111.469 172.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.74 -3.39 90.35 Favored Glycine 0 CA--C 1.531 1.073 0 C-N-CA 126.632 2.063 . . . . 1.7 114.555 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -26.18 67.42 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.871 1.668 . . . . 3.3500000000000001 112.053 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 23' ' ' GLU . . . . . 0.561 ' HG2' ' HE3' ' B' ' 32' ' ' LYS . 0.0 OUTLIER -149.91 167.53 26.38 Favored 'General case' 0 C--O 1.245 0.846 0 C-N-CA 125.676 1.59 . . . . 5.3200000000000003 113.107 159.673 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.11 -105.14 0.42 Allowed Glycine 0 N--CA 1.473 1.161 0 O-C-N 126.227 2.204 . . . . 3.2799999999999998 115.698 128.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -61.4 89.92 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 107.056 -1.461 . . . . 4.9100000000000001 107.056 163.198 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 37.7 mttm -93.09 -26.53 17.42 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 120.315 -1.491 . . . . 6.71 114.695 -158.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.429 ' H ' HD23 ' B' ' 27' ' ' LEU . 2.0 pt? -80.62 -26.2 37.9 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.904 0.882 . . . . 4.4400000000000004 112.242 172.511 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.1 p -103.76 151.23 23.28 Favored 'General case' 0 C--O 1.246 0.903 0 C-N-CA 126.932 2.093 . . . . 1.1399999999999999 113.18 -177.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 20.7 mt -76.65 101.54 5.79 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 106.189 -1.782 . . . . 1.6399999999999999 106.189 154.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.422 ' HB3' ' HE2' ' B' ' 32' ' ' LYS . 17.9 t -62.61 147.41 49.36 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.777 -0.823 . . . . 2.0899999999999999 108.777 165.494 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -41.75 -41.68 2.39 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.801 1.64 . . . . 4.1500000000000004 113.674 -174.245 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.561 ' HE3' ' HG2' ' B' ' 23' ' ' GLU . 0.2 OUTLIER -60.37 -49.26 78.3 Favored 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 117.167 2.284 . . . . 6.2699999999999996 117.167 168.439 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -64.69 -35.67 81.8 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.801 1.637 . . . . 2.3599999999999999 110.86 173.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 40.3 tp -62.6 -51.09 68.67 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.179 0.592 . . . . 2.0899999999999999 110.531 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 35' ' ' LYS . . . . . 0.511 ' HA ' HG21 ' B' ' 52' ' ' ILE . 20.4 mmtt -52.32 -39.77 61.02 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.782 1.233 . . . . 4.0800000000000001 113.183 177.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -68.29 -57.64 5.64 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.147 1.379 . . . . 3.73 111.855 172.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 24.4 tp -52.6 -58.93 5.21 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.457 1.903 . . . . 2.5299999999999998 111.585 -174.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 0.417 ' CD1' HG23 ' B' ' 52' ' ' ILE . 54.0 mt -53.98 -42.82 55.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 CA-C-O 121.626 0.727 . . . . 1.3300000000000001 110.46 -177.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 65.2 tttt -64.15 -18.26 64.27 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 113.145 0.794 . . . . 4.5899999999999999 113.145 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 19.6 mmtp -97.44 -45.57 6.39 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.178 1.391 . . . . 4.1699999999999999 112.294 167.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -61.76 -35.97 79.67 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.605 1.962 . . . . 4.0899999999999999 112.038 -170.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -110.96 -70.52 0.81 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.72 1.208 . . . . 2.1800000000000002 109.766 167.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 2.2 t 67.24 -64.91 0.24 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.18 1.792 . . . . 5.4400000000000004 113.118 -169.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.4 ' HB3' ' H ' ' B' ' 45' ' ' GLY . 4.2 mm? 30.36 -135.06 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 127.942 2.497 . . . . 3.6299999999999999 112.33 -171.391 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 45' ' ' GLY . . . . . 0.4 ' H ' ' HB3' ' B' ' 44' ' ' LEU . . . -89.0 -35.79 8.02 Favored Glycine 0 CA--C 1.528 0.874 0 O-C-N 120.303 -1.498 . . . . 3.21 111.057 165.368 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -89.72 -27.77 19.85 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.369 1.868 . . . . 6.79 114.632 -159.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.77 68.69 7.11 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 123.951 1.834 . . . . 2.73 111.92 -175.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp -134.3 161.22 35.56 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 129.12 2.968 . . . . 6.8499999999999996 108.487 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -40.57 -64.29 0.54 Allowed 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 116.619 2.081 . . . . 3.3999999999999999 116.619 -131.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 13.5 m -65.83 -25.62 67.29 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.272 1.212 . . . . 2.46 114.272 -173.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 5.3 m -62.41 -5.25 2.34 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.611 1.165 . . . . 2.27 112.898 170.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 52' ' ' ILE . . . . . 0.511 HG21 ' HA ' ' B' ' 35' ' ' LYS . 62.9 mt -110.33 -22.69 4.86 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 125.606 1.562 . . . . 1.3100000000000001 112.042 175.058 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -80.06 -48.76 12.77 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.262 0.937 . . . . 3.3100000000000001 112.313 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -68.67 -33.05 73.31 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 118.917 0.781 . . . . 2.7999999999999998 110.252 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 8.3 tt -62.12 -44.3 96.94 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 117.269 -1.348 . . . . 2.3300000000000001 111.073 172.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ttt -58.44 -48.91 79.17 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 121.943 2.156 . . . . 2.1499999999999999 112.133 169.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.23 -20.96 20.6 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 120.09 1.313 . . . . 5.4100000000000001 113.47 174.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 31.0 t -89.25 -38.1 14.47 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.967 1.707 . . . . 2.3799999999999999 112.738 176.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 7.3 mp -71.72 -59.7 2.62 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 126.504 1.921 . . . . 2.3500000000000001 111.809 174.061 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -78.66 95.15 5.2 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 127.869 2.468 . . . . 1.4199999999999999 110.748 -170.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.2 -39.89 84.02 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 114.418 1.266 . . . . 2.8399999999999999 114.418 -169.159 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 53.2 p-10 -99.91 -6.21 27.07 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.045 1.498 . . . . 1.9399999999999999 115.045 -173.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 17.9 t 64.02 26.41 14.06 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.776 1.23 . . . . 2.3700000000000001 113.742 -177.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 50.8 p30 -68.16 -15.98 63.81 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.406 1.482 . . . . 2.1000000000000001 111.493 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 64.58 22.32 12.62 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 129.273 3.029 . . . . 4.3799999999999999 113.563 -175.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -131.74 123.76 28.35 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 127.775 2.43 . . . . 2.98 107.562 175.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 18.8 mm -90.81 110.72 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 O-C-N 120.993 -1.067 . . . . 1.3700000000000001 111.662 -173.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -76.13 150.54 37.18 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.881 1.273 . . . . 2.6600000000000001 110.167 161.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.04 -33.11 72.77 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 119.96 -1.713 . . . . 2.8399999999999999 112.333 -174.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 19.1 pttm -74.32 -9.12 58.29 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.326 1.232 . . . . 3.5299999999999998 114.326 173.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -81.82 -53.19 6.39 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 108.011 -1.107 . . . . 1.78 108.011 157.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -61.37 -25.56 67.25 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 116.518 2.044 . . . . 3.6699999999999999 116.518 -172.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 94.4 p -65.53 -19.69 66.03 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.207 -1.558 . . . . 1.6399999999999999 111.886 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 1.2 p -69.36 -27.78 35.83 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 N-CA-C 113.0 0.741 . . . . 2.48 113.0 170.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 45.8 t80 -61.03 -51.25 69.99 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 120.822 -1.174 . . . . 2.4300000000000002 110.454 170.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 33.5 mt -59.71 -38.4 81.51 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.419 1.088 . . . . 1.3799999999999999 110.658 177.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.4 m -59.86 -54.21 48.82 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.725 1.21 . . . . 0.91000000000000003 111.417 174.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -55.31 -42.81 74.2 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.708 1.14 . . . . 2.1699999999999999 112.942 177.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 93.7 mt -63.83 -48.64 75.99 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.604 0.762 . . . . 1.73 111.52 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 75.1 m -67.58 -32.93 74.03 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 113.038 0.755 . . . . 1.6799999999999999 113.038 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 88.6 mtp -68.71 -36.04 77.95 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.643 0.656 . . . . 2.0499999999999998 112.082 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.91 -42.98 72.63 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 119.068 0.849 . . . . 1.1000000000000001 112.049 172.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -63.0 -25.76 68.54 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 119.686 1.13 . . . . 3.0099999999999998 113.77 176.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -62.54 -51.51 67.11 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 120.0 1.273 . . . . 2.0600000000000001 111.854 168.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -71.65 -29.34 64.52 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.578 1.151 . . . . 3.4100000000000001 112.456 -174.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -58.86 -56.5 21.41 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.584 1.554 . . . . 3.3199999999999998 110.678 164.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -60.17 -27.18 66.91 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.684 1.194 . . . . 2.2000000000000002 113.152 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 68.7 mt -66.37 -40.9 90.01 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 117.507 -1.235 . . . . 2.29 112.021 171.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -86.89 -1.73 58.04 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.782 1.401 . . . . 4.0899999999999999 114.782 176.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -76.43 -33.58 58.78 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 120.79 -1.194 . . . . 3.3199999999999998 111.605 159.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -102.86 7.96 39.31 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.506 1.523 . . . . 2.8799999999999999 113.918 -170.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 N-CA-C 118.844 2.905 . . . . 4.9000000000000004 118.844 -161.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 108.096 -1.076 . . . . 5.9400000000000004 108.096 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 17.6 mp0 -115.87 -119.43 0.31 Allowed 'General case' 0 N--CA 1.445 -0.725 0 O-C-N 125.91 2.007 . . . . 3.4100000000000001 106.887 -159.068 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.663 HG21 ' HA ' ' B' ' 41' ' ' GLU . 3.9 p -151.03 162.73 25.98 Favored Pre-proline 0 N--CA 1.472 0.628 0 N-CA-C 113.828 1.048 . . . . 1.6699999999999999 113.828 -138.091 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -63.65 -39.17 36.46 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.312 2.675 . . . . 2.9300000000000002 113.131 179.167 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.2 tp -71.29 -49.98 37.27 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.136 1.335 . . . . 4.0300000000000002 111.423 -177.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -63.55 -37.57 87.83 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.546 0.738 . . . . 5.3899999999999997 109.868 -177.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -67.53 -35.71 79.6 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 120.878 -1.139 . . . . 4.8700000000000001 112.55 171.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.16 -41.7 85.57 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.832 1.196 . . . . 1.4099999999999999 112.428 173.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.4 mt -62.74 -44.6 95.77 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.154 1.382 . . . . 1.76 110.211 172.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 68.4 m -53.45 -50.98 64.13 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.444 1.097 . . . . 1.6599999999999999 110.649 172.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 99.2 m -56.08 -48.96 75.11 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.727 0.811 . . . . 1.55 110.866 175.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 40.3 ttm -60.85 -45.85 92.9 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.99 1.316 . . . . 2.9500000000000002 112.432 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.3 t -62.65 -41.15 91.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 126.157 1.783 . . . . 2.1000000000000001 110.021 175.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 88.2 m -64.37 -50.7 66.67 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 124.24 1.016 . . . . 0.83999999999999997 111.138 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.3 p -63.66 -36.67 84.62 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.153 0.888 . . . . 2.1600000000000001 110.603 174.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -66.05 -53.18 41.6 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.328 -0.549 . . . . 2.3599999999999999 111.094 -177.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -69.81 -37.24 76.19 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.073 -1.017 . . . . 3.9300000000000002 112.887 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -70.74 -48.48 54.25 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 119.637 1.108 . . . . 4.0999999999999996 112.355 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -69.56 -23.54 63.57 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.17 0.896 . . . . 2.3799999999999999 111.601 172.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.0 t -64.5 -21.37 66.66 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 120.126 1.33 . . . . 2.0699999999999998 112.973 169.739 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.9 -3.76 79.62 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.128 1.347 . . . . 1.6399999999999999 114.946 174.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -67.11 -33.4 75.39 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.723 1.762 . . . . 5.1200000000000001 111.871 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -146.89 141.01 26.11 Favored 'General case' 0 C--O 1.249 1.03 0 C-N-CA 125.039 1.336 . . . . 3.9199999999999999 111.096 -178.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 45.53 -124.3 6.69 Favored Glycine 0 C--N 1.338 0.689 0 C-N-CA 126.232 1.873 . . . . 2.9900000000000002 112.131 165.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.4 m -41.77 114.33 0.52 Allowed 'General case' 0 C--O 1.245 0.857 0 C-N-CA 125.643 1.577 . . . . 2.6899999999999999 111.949 173.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 44.7 mtpt -86.75 109.94 19.58 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.518 1.527 . . . . 4.75 107.648 151.049 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.8 mt 152.03 -61.12 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 130.971 3.709 . . . . 3.8100000000000001 107.431 -164.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.3 p -111.64 160.07 17.58 Favored 'General case' 0 C--O 1.246 0.918 0 C-N-CA 127.022 2.129 . . . . 1.02 112.685 -171.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.2 mt -92.15 108.31 19.85 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 114.285 -1.325 . . . . 1.72 108.382 160.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.85 162.48 24.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.25 0.547 . . . . 2.1099999999999999 111.908 167.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.1 tpt85 -45.87 -27.69 0.93 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 127.682 2.393 . . . . 3.3500000000000001 114.829 -169.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.1 -28.89 12.07 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.552 1.141 . . . . 4.9699999999999998 113.244 177.412 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -58.0 -50.06 74.69 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.455 0.702 . . . . 2.6099999999999999 109.288 171.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.3 tp -62.42 -51.31 68.03 Favored 'General case' 0 C--N 1.344 0.369 0 C-N-CA 123.709 0.804 . . . . 2.1400000000000001 111.223 175.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.3 ttmm -55.77 -38.84 70.42 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 118.547 0.612 . . . . 3.4100000000000001 112.261 -176.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -70.79 -41.8 71.18 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 117.724 -1.132 . . . . 3.7599999999999998 113.228 176.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.02 -54.09 50.07 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.709 1.604 . . . . 2.3199999999999998 111.065 177.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.7 mt -53.25 -47.39 56.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 CA-C-O 122.167 0.984 . . . . 0.81000000000000005 109.221 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -67.59 -8.49 34.76 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 125.246 1.418 . . . . 5.6699999999999999 113.522 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -94.22 -50.33 5.32 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 119.848 -1.782 . . . . 3.6200000000000001 110.646 160.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 73.5 tt0 -52.25 -65.79 0.5 Allowed 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 128.999 2.92 . . . . 4.6200000000000001 111.862 -171.253 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -77.81 115.61 17.69 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 125.777 1.631 . . . . 2.2799999999999998 108.397 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 21.6 p -83.24 1.1 42.52 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.988 1.107 . . . . 5.9900000000000002 113.988 171.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -150.54 -172.56 4.22 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.07 0.948 . . . . 4.04 112.7 -155.828 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.71 9.1 50.8 Favored Glycine 0 N--CA 1.472 1.099 0 C-N-CA 124.207 0.908 . . . . 4.9800000000000004 114.996 170.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 54.32 32.61 16.65 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.431 1.492 . . . . 6.1100000000000003 112.703 -169.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.87 23.85 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.034 1.734 . . . . 2.8100000000000001 114.899 -177.675 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.0 mtpt -78.94 -168.09 1.34 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 127.895 2.478 . . . . 5.0899999999999999 112.133 -175.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -44.5 -62.32 1.23 Allowed 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 116.649 2.092 . . . . 4.8600000000000003 116.649 -161.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.6 t -71.77 -25.44 62.03 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.592 1.087 . . . . 2.4900000000000002 112.788 -175.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.3 m -68.41 -21.53 64.67 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.025 1.33 . . . . 2.7400000000000002 112.045 174.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 81.8 mt -80.9 -31.75 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 123.857 0.863 . . . . 1.51 111.939 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -73.56 -33.03 64.48 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.762 1.165 . . . . 3.5899999999999999 113.67 -174.784 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -70.77 -40.86 72.38 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 118.708 0.685 . . . . 2.3700000000000001 111.185 163.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.12 -47.82 82.12 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 118.474 -0.774 . . . . 1.8 110.296 178.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.5 mtp -53.42 -50.27 65.56 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 120.114 1.325 . . . . 2.2200000000000002 111.332 177.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.65 -35.11 67.99 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.245 1.418 . . . . 3.5099999999999998 113.064 174.56 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.7 m -84.58 -32.71 23.64 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.949 1.3 . . . . 3.27 112.656 -175.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 88.8 mt -76.34 -46.93 25.29 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 125.848 1.659 . . . . 2.5600000000000001 112.271 175.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -70.31 141.18 52.37 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.842 1.657 . . . . 1.6100000000000001 112.984 -172.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -112.44 -26.29 8.78 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 126.295 1.838 . . . . 3.7999999999999998 113.468 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.28 -23.02 57.35 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 120.349 1.431 . . . . 2.4300000000000002 111.652 175.298 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.8 t 70.53 41.64 0.94 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.701 2.4 . . . . 2.23 111.862 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -116.09 -117.24 0.32 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.94 1.296 . . . . 3.0600000000000001 109.249 -160.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -146.63 -10.35 0.47 Allowed 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 116.269 1.951 . . . . 4.4800000000000004 116.269 163.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -105.99 140.01 39.66 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 127.682 2.393 . . . . 2.75 110.937 177.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.2 mm -94.24 112.93 27.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 113.018 -1.901 . . . . 1.1699999999999999 109.938 177.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -61.21 157.08 16.98 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.674 1.19 . . . . 3.5099999999999998 111.01 163.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.76 -27.74 60.04 Favored 'General case' 0 CA--C 1.553 1.063 0 O-C-N 120.518 -1.364 . . . . 2.0899999999999999 111.697 164.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -69.93 -38.81 76.32 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.32 1.848 . . . . 3.7400000000000002 111.983 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 64.4 mt-10 -73.16 -51.86 16.31 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.761 1.624 . . . . 1.6699999999999999 109.246 173.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -49.98 -32.36 14.86 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.647 1.579 . . . . 2.1000000000000001 113.289 174.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.1 m -62.3 -30.81 71.41 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.466 -1.396 . . . . 1.6499999999999999 113.743 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.6 m -79.71 -25.05 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 CA-C-N 120.897 1.68 . . . . 2.5099999999999998 112.282 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -65.72 -64.07 0.95 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.329 0.651 . . . . 1.8700000000000001 111.279 172.541 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -53.82 -44.83 70.55 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 125.319 1.447 . . . . 2.4700000000000002 111.139 -178.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 48.6 m -59.2 -41.41 88.46 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 118.233 -0.889 . . . . 1.04 113.082 176.189 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 67.1 mtm -64.24 -36.04 82.8 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.12 1.327 . . . . 1.9399999999999999 112.204 175.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 78.3 mt -64.77 -43.65 92.58 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 118.866 0.757 . . . . 1.3799999999999999 111.752 173.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 79.8 m -58.57 -42.43 87.96 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 112.903 0.705 . . . . 1.9399999999999999 112.903 171.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 80.2 mtp -64.42 -32.97 74.81 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.687 0.676 . . . . 2.1499999999999999 112.559 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.09 -43.51 57.42 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.769 1.168 . . . . 0.81000000000000005 112.514 173.342 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -61.47 -31.82 71.8 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.298 0.954 . . . . 2.4399999999999999 113.152 175.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -57.41 -49.68 75.42 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.572 0.749 . . . . 1.97 112.866 169.473 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.93 -32.68 65.46 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.149 0.58 . . . . 3.3999999999999999 111.697 -174.015 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.81 -48.65 79.11 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.388 1.475 . . . . 2.48 111.152 166.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -63.65 -36.59 84.32 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.551 1.54 . . . . 2.7200000000000002 111.959 176.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 19.8 mt -72.33 -13.05 61.39 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.635 1.174 . . . . 1.99 114.029 -178.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -93.87 -1.75 54.37 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 114.782 1.401 . . . . 3.6699999999999999 114.782 168.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -105.09 -66.68 0.96 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.11 0.964 . . . . 4.4100000000000001 110.568 165.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -79.8 41.41 0.49 Allowed 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 127.423 2.289 . . . . 4.9199999999999999 112.303 177.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.6 ptpm? . . . . . 0 C--O 1.251 1.159 0 C-N-CA 127.563 2.345 . . . . 7.9699999999999998 114.924 -178.901 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.474 0.761 0 N-CA-C 108.508 -0.923 . . . . 5.0199999999999996 108.508 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -170.72 -172.63 1.22 Allowed 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 128.549 2.74 . . . . 4.4500000000000002 106.107 -153.226 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 64.3 p -81.47 154.69 71.57 Favored Pre-proline 0 N--CA 1.469 0.518 0 O-C-N 121.895 -0.503 . . . . 2.02 111.797 172.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -66.39 -9.16 22.94 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.507 2.138 . . . . 1.5600000000000001 112.576 165.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tt -75.45 -58.64 3.16 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.186 -1.388 . . . . 2.7200000000000002 109.586 169.036 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -48.1 -52.39 20.6 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.864 1.211 . . . . 4.3499999999999996 110.613 170.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 2.2 tptm -64.7 -31.69 73.02 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 113.645 0.98 . . . . 4.3700000000000001 113.645 -175.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.34 -31.29 72.4 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.775 0.83 . . . . 1.01 112.418 170.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 22.3 mt -75.15 -34.62 61.64 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.818 0.735 . . . . 1.8200000000000001 111.255 173.29 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.4 m -59.52 -46.67 88.18 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.326 0.65 . . . . 1.4099999999999999 110.959 166.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 30.1 m -60.56 -42.0 95.72 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.921 1.289 . . . . 1.6599999999999999 111.463 174.184 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 41.6 ttm -57.66 -49.98 74.67 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.372 0.669 . . . . 2.8999999999999999 111.331 172.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 10.5 t -59.52 -35.9 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 124.675 1.19 . . . . 1.7 112.389 174.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 89.0 m -65.68 -47.75 74.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.72 1.608 . . . . 0.80000000000000004 111.819 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.55 -50.21 73.85 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.769 0.713 . . . . 1.79 109.579 167.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -62.19 -46.01 90.83 Favored 'General case' 0 N--CA 1.463 0.218 0 O-C-N 124.192 0.933 . . . . 2.4100000000000001 111.489 -164.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -74.23 -34.77 63.76 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.131 0.789 . . . . 2.5600000000000001 113.131 176.612 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 16.6 ttmm -69.8 -23.96 63.41 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.021 -1.049 . . . . 4.5300000000000002 113.218 177.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 49.4 m-85 -77.73 -39.61 43.88 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.59 1.156 . . . . 2.0499999999999998 112.235 160.184 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 17.5 t -59.78 -19.23 49.23 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 116.032 1.864 . . . . 1.8300000000000001 116.032 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.85 -13.3 83.56 Favored Glycine 0 CA--C 1.54 1.649 0 CA-C-O 118.759 -1.023 . . . . 1.53 114.803 170.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -86.67 73.81 9.96 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.067 1.934 . . . . 5.4000000000000004 110.83 176.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 88.72 -178.16 0.02 OUTLIER 'General case' 0 C--O 1.247 0.946 0 C-N-CA 127.378 2.271 . . . . 3.0099999999999998 111.624 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.51 -150.54 21.08 Favored Glycine 0 C--N 1.339 0.718 0 C-N-CA 124.994 1.283 . . . . 2.1600000000000001 111.538 -177.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 2.3 m -80.3 170.15 16.79 Favored 'General case' 0 C--O 1.251 1.155 0 O-C-N 121.967 -0.725 . . . . 3.2999999999999998 111.412 166.541 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 61.5 mttt -63.9 162.48 13.68 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 125.082 1.353 . . . . 7.1699999999999999 109.5 144.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 9.3 tp 66.61 -24.77 0.11 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.702 2.001 . . . . 3.46 114.486 -174.098 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 57.7 p -110.01 152.85 25.4 Favored 'General case' 0 C--O 1.245 0.845 0 C-N-CA 124.445 1.098 . . . . 1.28 113.673 178.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 51.9 mt -107.48 99.22 8.75 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.868 -1.06 . . . . 1.71 110.717 163.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 35.0 t -55.67 160.16 2.66 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.578 1.151 . . . . 1.8200000000000001 113.381 161.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -45.59 -24.77 0.37 Allowed 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 117.302 2.334 . . . . 3.8100000000000001 117.302 -175.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.29 -50.53 5.77 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-N 120.392 1.451 . . . . 4.0199999999999996 114.096 174.724 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -54.64 -37.18 65.35 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.314 0.646 . . . . 2.04 110.68 179.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 49.9 tp -76.05 -47.19 25.65 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.322 0.86 . . . . 2.3399999999999999 113.322 172.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 17.4 ttmt -52.54 -47.55 66.66 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 120.693 1.588 . . . . 2.9900000000000002 110.986 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.6 tp10 -67.5 -36.0 80.24 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 116.871 -1.538 . . . . 3.7200000000000002 114.253 -178.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 tt -57.82 -54.81 42.69 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 125.672 1.589 . . . . 2.0899999999999999 111.86 173.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 mt -56.67 -39.92 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 N-CA-C 108.849 -0.797 . . . . 1.2 108.849 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 52.8 tttt -70.97 3.13 3.57 Favored 'General case' 0 CA--C 1.559 1.316 0 N-CA-C 114.7 1.37 . . . . 4.21 114.7 177.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 17.5 mmtm -112.24 -57.98 2.2 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 126.097 1.759 . . . . 3.9399999999999999 110.487 166.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 41' ' ' GLU . . . . . 0.663 ' HA ' HG21 ' A' ' 3' ' ' THR . 3.8 mp0 -53.5 -49.96 66.4 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.211 1.805 . . . . 4.5099999999999998 111.894 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -84.22 53.48 2.64 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 120.255 -1.528 . . . . 2.2400000000000002 111.182 176.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 13.1 t -58.81 -13.34 5.91 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.837 1.255 . . . . 3.2200000000000002 113.531 171.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.415 ' CD2' ' H ' ' B' ' 44' ' ' LEU . 2.8 mm? -48.12 -36.78 13.94 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 127.747 2.419 . . . . 2.9100000000000001 112.57 164.552 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.77 9.27 81.38 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.127 0.87 . . . . 2.9399999999999999 115.058 166.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -63.59 -49.12 74.63 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.218 1.009 . . . . 7.3899999999999997 110.696 170.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.92 110.64 1.61 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.74 0.816 . . . . 2.3399999999999999 112.097 172.224 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -128.57 146.7 50.77 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.444 1.498 . . . . 3.5099999999999998 109.616 172.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -6.0 -87.96 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 128.243 2.617 . . . . 3.8900000000000001 116.762 -158.334 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.9 m -57.59 -23.05 48.74 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.297 1.592 . . . . 3.0600000000000001 115.297 -173.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 29.2 t -66.94 -18.62 65.47 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.121 -0.987 . . . . 1.8500000000000001 113.133 173.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 13.8 mm -72.78 -37.3 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 123.923 0.889 . . . . 1.3700000000000001 110.534 171.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -80.13 -37.87 32.65 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.215 1.006 . . . . 3.9399999999999999 111.859 -170.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -67.16 -35.45 79.72 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.492 0.553 . . . . 2.2999999999999998 112.492 167.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 9.6 tt -63.64 -44.78 92.85 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 118.01 -0.995 . . . . 2.4700000000000002 111.035 171.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 26.9 mtp -56.94 -45.59 82.67 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 120.127 1.33 . . . . 2.8900000000000001 110.936 175.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.3 tttm -52.06 -38.02 55.69 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.425 1.09 . . . . 3.8500000000000001 113.001 168.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.8 t -67.36 -33.61 75.58 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 120.818 -1.176 . . . . 2.0299999999999998 112.731 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 20.6 mt -83.03 -45.52 13.94 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 120.943 -1.098 . . . . 1.8799999999999999 113.486 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -79.39 87.8 5.02 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.51 1.924 . . . . 1.8100000000000001 111.33 -156.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.88 -30.33 70.08 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 115.05 1.5 . . . . 3.1699999999999999 115.05 178.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . 0.286 0.0 OUTLIER -78.41 -22.86 47.13 Favored 'General case' 0 CA--C 1.558 1.274 0 CA-C-N 119.273 0.942 . . . . 2.6699999999999999 111.959 167.183 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 8.1 m 53.21 62.71 2.53 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 126.82 2.048 . . . . 3.4100000000000001 113.146 175.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -141.05 -60.53 0.49 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 118.512 -0.756 . . . . 2.6200000000000001 112.171 -140.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 161.73 -35.81 0.0 OUTLIER 'General case' 0 C--N 1.345 0.374 0 C-N-CA 131.511 3.924 . . . . 6.3300000000000001 115.004 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -106.87 135.85 47.7 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 126.358 1.863 . . . . 2.29 108.888 -178.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 67' ' ' ILE . . . . . 0.43 ' HA ' ' OE1' ' B' ' 71' ' ' GLU 0.257 14.6 mt -99.7 109.85 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.599 0.76 . . . . 1.27 111.47 169.98 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 68' ' ' ASP . . . . . 0.433 ' HB2' ' H ' ' B' ' 71' ' ' GLU . 41.1 m-20 -54.23 153.44 5.25 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.491 1.916 . . . . 3.6099999999999999 111.049 166.198 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.33 -35.13 62.37 Favored 'General case' 0 CA--C 1.552 1.03 0 O-C-N 120.533 -1.354 . . . . 2.1800000000000002 110.942 165.282 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.471 ' HE3' ' HA ' ' B' ' 70' ' ' LYS . 0.1 OUTLIER -70.19 -35.81 74.19 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 120.548 -1.345 . . . . 7.0199999999999996 113.122 176.965 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 71' ' ' GLU . . . . . 0.433 ' H ' ' HB2' ' B' ' 68' ' ' ASP . 57.1 mt-10 -65.03 -51.23 62.71 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 119.143 0.883 . . . . 1.71 108.734 168.515 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -56.8 -32.78 66.02 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 120.396 -1.44 . . . . 1.8999999999999999 113.898 -177.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 63.9 p -57.45 -21.95 40.31 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 119.748 -1.845 . . . . 1.99 114.466 171.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 59.6 t -64.94 -36.88 78.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 119.71 1.141 . . . . 1.6000000000000001 111.547 171.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -61.83 -47.26 85.87 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.809 0.843 . . . . 1.5800000000000001 109.86 173.077 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 47.1 mt -58.54 -50.53 73.46 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 117.406 -1.283 . . . . 1.74 110.698 178.347 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 98.6 m -58.66 -46.92 86.13 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.983 1.265 . . . . 1.0700000000000001 111.333 176.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 59.1 ttp -58.01 -47.74 82.14 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.547 0.739 . . . . 2.6400000000000001 112.321 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 94.4 mt -69.84 -46.75 64.92 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.869 0.692 . . . . 1.4299999999999999 112.869 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.76 -33.79 76.45 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.503 1.047 . . . . 1.53 111.646 -178.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 61.5 mtp -75.11 -30.39 60.84 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 118.054 -0.974 . . . . 2.21 113.1 172.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.0 -39.46 94.16 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 120.7 1.591 . . . . 1.1100000000000001 111.863 171.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -67.98 -13.08 61.9 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.491 1.293 . . . . 2.3100000000000001 114.491 173.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -69.43 -45.53 68.92 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.268 0.94 . . . . 2.98 111.912 170.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.0 -44.13 93.57 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.108 1.763 . . . . 3.71 111.643 174.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -54.26 -45.27 72.35 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.646 1.578 . . . . 2.1000000000000001 112.242 175.275 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -66.23 -27.33 67.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.756 1.223 . . . . 3.2999999999999998 112.804 176.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 49.0 mt -74.32 -21.62 59.63 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 120.893 -1.129 . . . . 2.1200000000000001 112.235 175.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -88.8 3.21 51.85 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.488 1.515 . . . . 3.4100000000000001 114.411 168.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -92.89 -46.2 7.62 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.74 1.216 . . . . 4.5099999999999998 111.027 162.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.35 20.73 0.52 Allowed 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 125.29 1.436 . . . . 4.3099999999999996 114.234 -178.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.256 1.444 0 C-N-CA 128.06 2.544 . . . . 4.7599999999999998 117.736 -166.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.503 -0.828 0 N-CA-C 108.471 -0.936 . . . . 8.4100000000000001 108.471 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 -112.38 -138.08 0.37 Allowed 'General case' 0 CA--C 1.542 0.646 0 O-C-N 125.871 1.982 . . . . 4.0499999999999998 109.26 -155.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.498 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 6.2 p -99.12 175.54 2.4 Favored Pre-proline 0 C--N 1.316 -0.864 1 C-N-CA 132.644 4.378 . . . . 2.1200000000000001 111.011 -151.71 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.498 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 74.4 Cg_endo -77.07 -29.91 4.78 Favored 'Trans proline' 0 C--N 1.351 0.668 0 CA-C-N 121.076 1.42 . . . . 1.5800000000000001 112.886 -168.342 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 18.0 tp -85.71 -39.2 17.46 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 117.007 -1.473 . . . . 2.6000000000000001 112.519 -174.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -58.28 -37.93 75.98 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 120.487 1.494 . . . . 4.6799999999999997 109.915 172.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 ttmp? -65.41 -39.1 91.76 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.532 1.133 . . . . 3.5600000000000001 112.663 171.211 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.71 -40.66 69.32 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.043 0.937 . . . . 0.91000000000000003 113.106 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.3 mt -62.34 -42.78 99.67 Favored 'General case' 0 C--O 1.238 0.486 0 O-C-N 121.286 -0.884 . . . . 1.73 109.969 170.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 92.5 m -56.05 -44.35 78.77 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 117.042 -1.456 . . . . 1.5 110.748 170.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.0 m -56.54 -52.13 65.96 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 121.481 1.946 . . . . 1.48 112.329 178.16 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.08 -29.08 69.93 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 113.994 1.109 . . . . 3.0299999999999998 113.994 178.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 80.2 t -76.19 -32.22 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 123.954 0.901 . . . . 2.6299999999999999 112.741 171.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 56.8 m -61.34 -55.37 32.44 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.423 1.489 . . . . 0.85999999999999999 110.176 175.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.33 -25.26 64.12 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.862 1.265 . . . . 2.6200000000000001 111.504 -177.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -59.77 -37.65 79.64 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.256 -0.902 . . . . 1.7 111.675 167.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -76.99 -27.9 54.89 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 120.196 -1.565 . . . . 2.0499999999999998 112.954 175.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -56.44 -59.62 4.71 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.725 1.148 . . . . 5.4000000000000004 110.715 164.081 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -86.51 -45.71 10.85 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 114.298 1.222 . . . . 2.1400000000000001 114.298 -167.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.3 m -67.02 -31.03 71.3 Favored 'General case' 0 C--O 1.249 1.056 0 CA-C-N 120.605 1.548 . . . . 3.27 111.362 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.39 2.07 88.21 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 126.873 2.178 . . . . 1.6799999999999999 114.582 173.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.4 ttt85 -74.69 -46.08 40.18 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.749 1.775 . . . . 5.0199999999999996 111.264 175.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -133.0 147.98 52.27 Favored 'General case' 0 C--O 1.252 1.224 0 CA-C-O 122.663 1.22 . . . . 5.5199999999999996 112.845 -174.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.49 -122.96 14.07 Favored Glycine 0 C--N 1.343 0.936 0 C-N-CA 128.308 2.861 . . . . 2.3799999999999999 112.395 168.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.7 m -44.27 109.18 0.14 Allowed 'General case' 0 C--O 1.246 0.877 0 C-N-CA 125.065 1.346 . . . . 4.0700000000000003 110.995 161.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 40.4 tptt -72.71 -27.57 62.15 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.606 1.562 . . . . 5.9299999999999997 112.949 -172.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.445 ' H ' HD23 ' A' ' 27' ' ' LEU . 1.9 pt? -90.29 -17.3 27.65 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.503 1.521 . . . . 4.9299999999999997 114.253 178.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.8 p -106.26 152.6 23.31 Favored 'General case' 0 C--O 1.254 1.326 0 C-N-CA 123.921 0.888 . . . . 2.0800000000000001 111.293 178.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 12.2 mt -82.98 107.28 15.47 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 113.306 -1.77 . . . . 1.8600000000000001 106.912 148.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.2 t -66.56 162.69 20.34 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.552 -0.717 . . . . 2.0800000000000001 109.969 162.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -46.74 -36.62 7.42 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.89 1.223 . . . . 3.3900000000000001 113.226 -177.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -79.74 -30.79 40.95 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 120.728 -1.233 . . . . 5.79 113.858 177.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -69.36 -33.95 73.84 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.867 1.212 . . . . 1.5700000000000001 110.887 170.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -64.75 -53.47 46.64 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.606 1.162 . . . . 3.1699999999999999 109.597 174.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.1 mttm -50.87 -47.15 60.52 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.406 -0.809 . . . . 4.1699999999999999 112.49 170.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -53.91 -66.72 0.34 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.575 1.55 . . . . 3.2599999999999998 112.257 173.244 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.4 tp -49.09 -51.38 31.97 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.571 1.948 . . . . 2.0699999999999998 111.466 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 84.2 mt -61.21 -57.83 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 N-CA-C 109.321 -0.622 . . . . 1.21 109.321 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -60.53 -30.99 70.1 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 121.491 -0.755 . . . . 4.0499999999999998 112.399 -174.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.2 mmtm -76.11 -57.95 3.57 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.25 1.82 . . . . 3.6299999999999999 112.761 176.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -108.66 6.6 25.95 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 113.519 0.933 . . . . 6.25 113.519 -163.628 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.8 mt -142.91 50.21 1.44 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 127.557 2.343 . . . . 3.6099999999999999 108.171 168.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 24.7 t -73.19 51.34 0.31 Allowed 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 127.394 2.278 . . . . 3.75 115.9 -166.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -86.74 151.62 23.23 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.579 -1.325 . . . . 4.1100000000000003 111.67 178.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.11 -23.51 73.03 Favored Glycine 0 N--CA 1.48 1.625 0 N-CA-C 116.219 1.248 . . . . 3.21 116.219 -167.307 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -98.26 0.69 46.16 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.558 1.143 . . . . 6.3300000000000001 112.37 174.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.9 tpt -82.65 78.38 9.28 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.679 1.591 . . . . 2.0699999999999998 107.808 171.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.8 ttpt -143.87 167.9 21.21 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.849 1.66 . . . . 4.0700000000000003 110.577 -151.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -60.67 -42.37 96.92 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 119.44 -2.037 . . . . 3.6699999999999999 114.504 -161.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.9 m -72.37 -3.78 26.07 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.268 1.581 . . . . 3.1600000000000001 115.268 176.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.8 p -109.3 -34.81 6.45 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.688 1.131 . . . . 2.0600000000000001 112.106 166.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.1 mt -76.29 -38.98 34.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.409 1.484 . . . . 1.55 113.498 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -71.02 -34.46 71.34 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 120.114 1.324 . . . . 2.5899999999999999 112.898 -173.018 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -87.42 -26.34 23.34 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.815 1.646 . . . . 4.7800000000000002 113.068 175.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 62.3 tp -59.24 -44.57 92.35 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 118.312 -0.852 . . . . 2.2000000000000002 109.846 158.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -48.18 81.35 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 119.795 1.18 . . . . 1.8 110.06 179.229 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.2 mttp -58.11 -33.26 68.92 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.123 0.969 . . . . 5.6799999999999997 113.172 172.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.8 t -79.17 -27.02 42.65 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 114.368 1.247 . . . . 1.8300000000000001 114.368 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.5 mt -81.56 -25.87 35.49 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.734 2.014 . . . . 2.1299999999999999 111.373 174.636 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.517 ' C ' ' HE2' ' A' ' 61' ' ' LYS . 36.8 t0 -69.12 120.65 15.3 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.478 1.111 . . . . 1.8600000000000001 109.748 166.043 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.534 ' HE3' HG11 ' A' ' 74' ' ' VAL . 0.8 OUTLIER -84.38 6.3 23.74 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 119.909 -1.745 . . . . 3.23 114.29 -172.635 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -153.03 -86.06 0.07 Allowed 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 124.83 1.252 . . . . 3.3399999999999999 110.516 -170.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.0 m 156.82 92.73 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 130.191 3.396 . . . . 2.3700000000000001 108.004 -174.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.3 p30 -152.23 -6.45 0.22 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.976 1.31 . . . . 2.21 113.399 -177.527 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 63.91 1.71 1.2 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 128.238 2.615 . . . . 4.3799999999999999 114.288 -170.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -106.19 138.3 42.62 Favored 'General case' 0 C--O 1.246 0.872 0 C-N-CA 127.319 2.248 . . . . 3.3599999999999999 110.435 178.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 41.2 mm -103.85 98.37 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 113.709 -1.587 . . . . 1.1899999999999999 107.894 159.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.99 157.33 25.36 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.612 1.165 . . . . 2.73 111.64 163.583 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -55.95 -25.26 42.73 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 115.159 1.54 . . . . 2.6000000000000001 115.159 -178.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 mtmp? -87.35 -35.17 18.53 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 117.267 -1.349 . . . . 3.4300000000000002 111.893 170.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.421 ' O ' HG12 ' A' ' 74' ' ' VAL . 40.1 mt-10 -54.2 -49.84 68.44 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 120.382 1.446 . . . . 1.98 108.979 166.593 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -49.93 -32.3 14.48 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 128.09 2.556 . . . . 2.7000000000000002 114.953 -178.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 72.5 p -57.93 -27.4 63.34 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.041 -1.037 . . . . 2.5 112.809 174.387 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.534 HG11 ' HE3' ' A' ' 61' ' ' LYS . 2.0 p -73.99 -30.0 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.217 -0.927 . . . . 2.3500000000000001 112.015 179.334 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -64.98 -49.96 68.24 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.944 -0.762 . . . . 1.9199999999999999 108.944 169.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.0 mt -61.04 -36.6 79.99 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.177 0.591 . . . . 2.0600000000000001 111.695 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.2 m -59.99 -53.16 61.12 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.714 1.206 . . . . 1.05 111.402 174.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.9 mtm -66.94 -37.64 84.69 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 119.121 -0.466 . . . . 1.8899999999999999 112.192 -177.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 92.9 mt -60.53 -47.52 85.82 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 119.095 -0.479 . . . . 1.8899999999999999 111.331 171.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 19.6 m -55.47 -39.79 70.84 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.691 0.796 . . . . 2.0 112.795 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 36.1 mtp -70.12 -33.54 71.95 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 119.003 -0.523 . . . . 1.8899999999999999 112.235 176.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.53 -46.76 68.69 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 119.211 0.914 . . . . 0.95999999999999996 113.176 -178.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -68.34 -24.25 64.79 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.333 -0.854 . . . . 2.9300000000000002 112.613 175.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -71.8 -33.37 68.5 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 114.036 1.124 . . . . 1.78 114.036 174.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.0 -32.27 51.08 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.131 0.572 . . . . 3.1000000000000001 111.324 179.503 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -54.73 29.33 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.804 0.842 . . . . 2.3399999999999999 110.782 161.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -59.22 -14.96 12.58 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.277 1.431 . . . . 2.3199999999999998 113.89 177.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 41.0 mt -90.42 -12.54 37.15 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 117.273 -1.346 . . . . 2.04 114.624 172.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -102.41 -38.28 7.66 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.738 1.215 . . . . 2.8399999999999999 113.931 167.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -56.68 -33.83 66.79 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.274 1.829 . . . . 4.1200000000000001 113.287 -177.222 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.528 HD22 ' H ' ' A' ' 91' ' ' ASN . 0.1 OUTLIER -83.13 -8.24 59.53 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 116.744 2.127 . . . . 5.2599999999999998 116.744 -172.634 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.96 0 CA-C-O 116.054 -1.927 . . . . 3.6699999999999999 115.927 -169.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 18.1 mtt . . . . . 0 N--CA 1.476 0.848 0 N-CA-C 107.098 -1.445 . . . . 5.9199999999999999 107.098 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.412 ' O ' ' HE2' ' B' ' 7' ' ' LYS . 8.6 mp0 -130.1 137.48 50.2 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 125.561 1.788 . . . . 5.5199999999999996 107.507 -161.31 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.26 162.13 27.06 Favored Pre-proline 0 N--CA 1.48 1.051 0 C-N-CA 123.942 0.897 . . . . 2.6200000000000001 111.792 -177.526 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -63.54 -26.62 69.73 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 121.643 1.562 . . . . 2.27 112.94 178.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.91 -37.71 39.23 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.174 0.897 . . . . 2.8799999999999999 111.08 174.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -58.76 -42.04 87.98 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.314 0.961 . . . . 3.9300000000000002 111.369 170.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 7' ' ' LYS . . . . . 0.412 ' HE2' ' O ' ' B' ' 2' ' ' GLU . 68.3 mttm -62.56 -36.69 83.44 Favored 'General case' 0 N--CA 1.463 0.188 0 O-C-N 121.433 -0.792 . . . . 3.9900000000000002 111.714 176.57 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.29 -47.12 71.56 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 118.937 0.789 . . . . 1.2 112.554 172.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -55.84 -50.0 71.75 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.769 1.628 . . . . 2.7400000000000002 113.346 173.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 22.0 p -66.95 -35.91 81.04 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 117.461 -1.257 . . . . 2.1600000000000001 110.821 178.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 95.9 m -59.59 -43.41 93.68 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 119.688 1.131 . . . . 1.5600000000000001 110.641 170.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -60.58 -55.08 37.63 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.073 0.549 . . . . 3.8199999999999998 111.248 175.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 51.7 t -58.33 -31.79 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 CA-C-N 118.698 0.681 . . . . 1.95 111.879 178.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 92.5 m -65.73 -57.6 7.64 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 117.614 -1.184 . . . . 1.05 110.876 175.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.7 p -57.04 -37.55 71.93 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 119.744 1.157 . . . . 1.9099999999999999 111.611 175.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -66.8 -57.9 6.13 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 123.661 0.601 . . . . 1.98 109.969 -176.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.23 -33.62 67.69 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.65 -0.656 . . . . 2.1800000000000002 112.67 -175.213 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -64.55 -34.38 78.11 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.585 1.084 . . . . 5.3600000000000003 112.198 174.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -85.85 -30.11 23.2 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.077 0.853 . . . . 2.1299999999999999 111.833 176.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 35.3 t -69.45 -25.6 64.18 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 114.206 1.187 . . . . 1.6599999999999999 114.206 174.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.66 12.19 67.87 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.853 1.692 . . . . 2.0600000000000001 114.702 172.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -75.66 -36.73 60.05 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 118.757 1.278 . . . . 4.9699999999999998 111.935 172.159 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -157.34 156.87 33.07 Favored 'General case' 0 C--O 1.248 0.985 0 CA-C-O 121.637 0.732 . . . . 2.9900000000000002 111.519 -163.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.94 -128.13 46.46 Favored Glycine 0 C--N 1.338 0.689 0 N-CA-C 109.185 -1.566 . . . . 2.4300000000000002 109.185 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 38.7 m -79.02 153.51 30.21 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-O 122.345 1.069 . . . . 3.3500000000000001 111.975 164.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -57.3 174.18 0.21 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 115.174 -0.921 . . . . 7.46 110.669 142.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 23.6 mt 73.34 -56.99 0.64 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.603 1.561 . . . . 3.2400000000000002 109.405 -169.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 40.6 p -103.38 146.65 28.16 Favored 'General case' 0 C--O 1.255 1.367 0 N-CA-C 115.863 1.801 . . . . 1.1899999999999999 115.863 -170.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 64.9 mt -102.44 103.46 13.85 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 128.484 2.714 . . . . 1.8500000000000001 111.601 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.5 p -65.77 170.76 4.92 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 115.111 1.522 . . . . 2.7799999999999998 115.111 178.301 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 31' ' ' ARG . . . . . 0.417 ' HD2' ' SD ' ' B' ' 56' ' ' MET . 10.7 tpt180 -47.6 -11.41 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 128.147 2.579 . . . . 5.0800000000000001 115.659 167.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.43 -47.91 3.14 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.812 1.245 . . . . 4.3099999999999996 112.275 168.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -52.91 -38.45 61.83 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.743 0.817 . . . . 2.29 111.428 179.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.498 HD23 ' HG2' ' B' ' 56' ' ' MET . 7.6 tp -71.9 -45.66 60.44 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.605 0.762 . . . . 2.21 112.539 178.626 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -71.58 -37.19 71.04 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 120.609 -1.307 . . . . 5.21 111.145 -176.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -54.24 -52.15 62.27 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.157 1.383 . . . . 2.8799999999999999 111.982 164.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 42.9 tp -58.24 -53.17 61.32 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.988 1.267 . . . . 1.99 112.376 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 27.4 mt -54.64 -55.07 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 N-CA-C 109.131 -0.692 . . . . 1.22 109.131 176.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -68.2 -11.84 59.94 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.08 1.141 . . . . 4.2000000000000002 114.08 -173.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 12.8 mmtp -92.59 -29.64 16.05 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 125.057 1.343 . . . . 3.8900000000000001 114.034 178.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -100.28 -49.93 4.1 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.635 0.774 . . . . 5.7400000000000002 111.733 177.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -81.1 56.19 2.74 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.857 1.263 . . . . 2.3900000000000001 110.383 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 72.3 m -79.24 -7.31 58.17 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.382 1.473 . . . . 3.79 113.432 176.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.4 HD23 ' H ' ' B' ' 44' ' ' LEU . 1.8 pt? -83.94 137.56 33.58 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.847 1.259 . . . . 2.7200000000000002 112.015 -176.69 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.1 -108.14 2.44 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.414 -0.674 . . . . 3.8799999999999999 111.414 178.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -169.08 118.46 0.68 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.08 1.752 . . . . 5.7699999999999996 106.947 -174.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.66 -13.61 60.04 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 122.231 1.015 . . . . 3.8199999999999998 112.871 -173.026 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.4 mtpp 71.93 45.8 0.39 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 128.123 2.569 . . . . 5.1900000000000004 110.215 170.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . 0.268 7.3 pt-20 -63.4 2.96 0.34 Allowed 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 119.893 3.294 . . . . 4.1900000000000004 119.893 -138.537 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 29.4 t -53.47 -29.92 38.25 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 119.129 -2.232 . . . . 2.7999999999999998 111.488 149.132 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 8.6 t -68.63 -15.38 63.51 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.041 1.336 . . . . 2.6200000000000001 114.003 171.503 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 5.9 mm -68.96 -21.68 25.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 CA-C-N 120.512 1.506 . . . . 2.1600000000000001 111.461 173.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -77.36 -44.79 28.15 Favored 'General case' 0 C--O 1.224 -0.247 0 N-CA-C 113.754 1.02 . . . . 3.4399999999999999 113.754 164.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.35 -30.86 66.68 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.422 1.465 . . . . 2.54 114.086 -178.085 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -51.81 -39.45 58.75 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 117.997 -1.001 . . . . 2.5299999999999998 110.399 162.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 56' ' ' MET . . . . . 0.498 ' HG2' HD23 ' B' ' 34' ' ' LEU . 23.1 mtp -63.32 -55.74 22.17 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-O 116.912 -1.518 . . . . 2.6099999999999999 112.383 173.259 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -61.13 -32.78 72.47 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 122.238 2.29 . . . . 4.4500000000000002 112.995 -175.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 21.2 m -72.49 -42.68 64.61 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.142 1.377 . . . . 2.1099999999999999 112.183 177.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 8.8 mp -74.41 -31.89 62.48 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 117.992 -1.004 . . . . 2.7200000000000002 112.858 173.117 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -108.4 56.06 0.63 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 128.568 2.747 . . . . 1.99 110.863 178.527 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 61' ' ' LYS . . . . . 0.583 ' H ' ' HE2' ' B' ' 61' ' ' LYS . 0.0 OUTLIER -58.17 -19.7 35.19 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 115.453 1.649 . . . . 3.2799999999999998 115.453 -173.536 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -89.34 -6.61 56.54 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.121 1.526 . . . . 1.77 115.121 173.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 57.8 m 63.06 22.96 13.72 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.903 1.681 . . . . 2.0800000000000001 114.635 174.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 37.0 p30 -89.8 -2.33 58.2 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.505 1.122 . . . . 2.8999999999999999 111.913 177.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 74.71 -31.41 0.21 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 129.935 3.294 . . . . 4.1900000000000004 114.559 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -73.41 135.55 44.21 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 122.629 1.204 . . . . 2.5600000000000001 110.188 176.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 77.9 mt -124.42 106.23 16.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 124.8 1.24 . . . . 1.5 108.551 -176.402 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -90.23 160.96 15.92 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 127.043 2.137 . . . . 3.71 109.919 165.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -39.18 -42.56 0.98 Allowed 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.985 1.714 . . . . 2.4399999999999999 113.892 170.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -80.16 -10.56 59.77 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.182 0.993 . . . . 4.0099999999999998 113.471 -171.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -91.08 -47.3 7.63 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.3 1.04 . . . . 1.8999999999999999 109.509 161.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -63.57 -28.06 69.67 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 129.083 2.953 . . . . 2.71 115.546 -171.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 13.4 p -54.48 -24.04 18.73 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.674 -1.266 . . . . 2.2000000000000002 113.033 175.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 p -58.1 -34.82 50.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 N-CA-C 113.009 0.744 . . . . 2.7000000000000002 113.009 171.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -66.3 -51.27 58.98 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.015 1.326 . . . . 1.6499999999999999 109.972 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 28.9 mt -61.16 -43.2 99.25 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.764 0.825 . . . . 1.48 110.123 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 24.1 m -57.49 -51.45 69.4 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.41 1.084 . . . . 1.1499999999999999 111.469 176.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 3.8 mmm -56.97 -44.7 82.88 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.568 0.747 . . . . 2.54 112.638 178.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 96.8 mt -68.23 -43.31 78.22 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.604 0.762 . . . . 1.45 111.668 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 80.0 m -61.64 -33.0 73.18 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.274 -0.891 . . . . 1.6000000000000001 112.554 175.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 41.1 mtp -69.14 -37.91 78.53 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.163 0.892 . . . . 2.8500000000000001 112.925 171.048 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.54 -46.34 88.84 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.207 0.912 . . . . 1.24 112.121 174.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -64.62 -27.72 69.13 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.094 1.146 . . . . 2.4500000000000002 114.094 174.527 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -70.67 -39.6 73.47 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.281 0.946 . . . . 2.4100000000000001 111.338 174.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -68.29 -40.41 81.77 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.906 0.882 . . . . 4.1799999999999997 111.475 177.113 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -52.68 -50.87 62.43 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.566 1.546 . . . . 2.9100000000000001 111.481 172.624 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -59.23 -25.72 64.26 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.256 1.422 . . . . 2.4500000000000002 113.144 -178.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 60.1 mt -77.37 -22.25 52.02 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 117.842 -1.075 . . . . 2.29 112.787 177.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -99.53 0.8 43.1 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.043 1.337 . . . . 4.1500000000000004 113.567 169.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -84.2 -36.28 22.9 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.815 1.246 . . . . 3.71 111.78 164.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -100.49 28.3 5.15 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.46 1.504 . . . . 3.2200000000000002 113.409 -170.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 3.7 ptmm? . . . . . 0 C--O 1.246 0.901 0 N-CA-C 118.011 2.597 . . . . 5.3700000000000001 118.011 -156.338 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.86 0 N-CA-C 107.992 -1.114 . . . . 6.6699999999999999 107.992 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -147.64 146.7 29.44 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 126.743 2.017 . . . . 5.0800000000000001 106.594 -164.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 75.6 p -53.17 162.78 1.02 Allowed Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 124.289 1.036 . . . . 1.6000000000000001 111.225 164.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.75 -19.49 36.1 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 121.952 1.768 . . . . 1.5 111.965 168.02 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -79.06 -41.41 28.84 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.977 0.911 . . . . 4.1699999999999999 112.24 178.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -58.06 -46.21 85.8 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.347 1.059 . . . . 4.0300000000000002 110.094 176.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -60.53 -31.86 70.92 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 114.078 1.14 . . . . 3.6800000000000002 114.078 172.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.14 -34.04 75.6 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.274 0.943 . . . . 1.0 111.655 -175.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 71.4 mt -57.86 -51.81 68.06 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.055 0.942 . . . . 1.9199999999999999 110.476 170.636 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 m -58.77 -43.84 90.5 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.026 1.331 . . . . 1.74 112.004 175.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 51.2 m -60.83 -38.78 86.63 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.668 1.587 . . . . 1.5900000000000001 110.853 178.156 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.86 -52.8 47.29 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.171 0.988 . . . . 3.8900000000000001 111.453 172.353 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t -54.73 -28.8 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 O-C-N 120.555 -1.341 . . . . 1.9199999999999999 112.503 174.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 94.4 m -68.56 -46.55 69.15 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.033 1.333 . . . . 1.3500000000000001 113.372 -177.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.0 p -69.41 -42.96 74.36 Favored 'General case' 0 CA--C 1.504 -0.817 0 CA-C-N 119.724 1.147 . . . . 2.27 108.85 172.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -60.92 -57.22 13.57 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 124.622 1.201 . . . . 2.1000000000000001 110.729 -171.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -64.76 -40.84 95.95 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 122.244 -0.285 . . . . 2.5600000000000001 110.554 -175.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -67.24 -41.74 85.16 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.359 -0.838 . . . . 3.8199999999999998 112.776 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -68.8 -37.04 78.99 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.421 1.01 . . . . 2.1000000000000001 112.297 173.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.5 m -62.71 -27.31 69.17 Favored 'General case' 0 C--O 1.25 1.114 0 N-CA-C 114.934 1.457 . . . . 2.73 114.934 172.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.29 -4.63 80.73 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 126.703 2.097 . . . . 1.3500000000000001 114.071 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -54.67 -37.37 65.66 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.395 1.598 . . . . 4.0 112.608 178.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 173.12 -155.57 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 128.858 2.863 . . . . 7.04 109.539 176.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 72.92 -142.09 31.39 Favored Glycine 0 C--N 1.336 0.582 0 C-N-CA 127.131 2.3 . . . . 2.1200000000000001 110.181 176.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.9 t -64.43 142.3 58.47 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 122.882 1.325 . . . . 2.5 110.153 149.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -97.49 137.64 36.13 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.885 1.674 . . . . 9.2100000000000009 107.609 174.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.6 mt 92.47 -31.16 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 129.219 3.008 . . . . 4.2000000000000002 111.416 -161.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.418 HG22 ' HA ' ' A' ' 68' ' ' ASP . 81.5 p -116.7 161.97 18.4 Favored 'General case' 0 C--O 1.251 1.142 0 N-CA-C 114.638 1.347 . . . . 1.55 114.638 179.071 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -120.45 102.81 8.7 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.647 1.179 . . . . 2.4199999999999999 112.162 -179.336 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.4 p -77.75 173.64 11.86 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 120.776 -1.202 . . . . 2.02 112.381 165.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -39.51 -42.86 1.19 Allowed 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 116.857 2.169 . . . . 3.4399999999999999 116.857 -163.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.57 -26.99 45.67 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 119.632 -1.917 . . . . 5.2999999999999998 114.057 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -72.95 -51.19 19.4 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 107.339 -1.356 . . . . 2.1699999999999999 107.339 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.21 -32.45 74.13 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.737 0.643 . . . . 1.96 112.737 175.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -67.13 -38.81 86.22 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 120.11 -1.619 . . . . 4.6200000000000001 112.784 173.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -64.66 -29.29 70.29 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-O 117.794 -1.098 . . . . 4.4800000000000004 113.634 171.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.1 tt -73.27 -66.79 0.64 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.203 1.401 . . . . 2.0800000000000001 112.358 177.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.9 mt -56.26 -43.94 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 124.647 1.179 . . . . 0.82999999999999996 110.525 -168.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.3 tttp -70.97 -3.85 21.64 Favored 'General case' 0 N--CA 1.439 -1.012 0 N-CA-C 113.994 1.109 . . . . 4.0899999999999999 113.994 -176.045 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -108.76 -21.63 12.59 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.196 1.798 . . . . 3.73 113.387 168.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -76.84 -62.08 1.76 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.855 2.062 . . . . 4.6200000000000001 110.047 178.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 60.3 mt -92.57 101.05 13.47 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.514 -1.366 . . . . 2.4300000000000002 113.241 -163.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 77.8 m -88.03 48.81 1.69 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.626 2.371 . . . . 4.2699999999999996 112.315 -169.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 38.8 mt -129.27 -1.21 5.09 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.55 1.94 . . . . 3.7799999999999998 113.791 -163.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 140.81 33.69 0.13 Allowed Glycine 0 N--CA 1.472 1.07 0 C-N-CA 125.763 1.649 . . . . 2.79 112.752 -170.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 26.78 65.08 0.08 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 130.209 3.404 . . . . 8.3300000000000001 113.355 172.037 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 52.1 mmm -20.82 117.27 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.797 2.439 . . . . 2.71 117.122 -158.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.3 tmtt? -48.41 122.84 5.79 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.604 1.962 . . . . 7.4000000000000004 110.297 178.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.31 -39.66 87.8 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.019 1.489 . . . . 5.0099999999999998 115.019 -157.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.2 t -76.35 -21.41 56.15 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.525 1.057 . . . . 3.4900000000000002 113.507 174.044 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.0 m -73.66 -9.64 58.88 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.774 -1.204 . . . . 2.71 112.527 173.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 20.1 mm -67.59 -25.96 34.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 123.608 0.763 . . . . 1.79 112.076 165.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -78.04 -46.45 20.88 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 114.223 1.194 . . . . 2.7000000000000002 114.223 -163.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.28 -33.22 73.96 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.005 0.821 . . . . 3.25 110.762 166.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 67.9 tp -61.48 -39.36 90.65 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 117.982 -1.009 . . . . 1.8700000000000001 113.33 177.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 18.0 ptm -74.94 -34.5 62.09 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 120.2 1.364 . . . . 1.8100000000000001 112.973 169.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -73.83 -23.35 59.63 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 120.781 -1.199 . . . . 6.5999999999999996 112.735 -178.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.1 t -58.43 -36.89 74.31 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.958 1.703 . . . . 2.5099999999999998 111.348 163.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.6 mt -74.17 -33.69 63.55 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.128 0.971 . . . . 2.3199999999999998 111.306 178.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -80.8 94.02 6.35 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.107 1.763 . . . . 2.52 114.131 -175.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.46 ' HZ1' HG21 ' A' ' 74' ' ' VAL . 12.0 mptt -63.02 -34.1 76.84 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.6 1.16 . . . . 3.5800000000000001 111.594 174.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.87 -34.86 51.45 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.706 1.202 . . . . 2.02 111.491 175.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.0 m 55.66 61.68 2.73 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.024 2.13 . . . . 3.79 111.509 -164.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -105.77 -55.35 2.34 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 117.399 -1.286 . . . . 2.7599999999999998 112.036 -167.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 152.29 -32.35 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.73 1 C-N-CA 133.368 4.667 . . . . 5.1600000000000001 116.091 175.549 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -90.87 143.5 26.66 Favored 'General case' 0 C--O 1.244 0.803 0 CA-C-O 123.079 1.419 . . . . 2.5299999999999998 108.314 169.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 35.6 mm -110.45 111.43 36.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 126.302 1.841 . . . . 1.6699999999999999 107.051 173.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.418 ' HA ' HG22 ' A' ' 28' ' ' THR . 0.0 OUTLIER -74.71 175.32 8.04 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.315 1.046 . . . . 2.9100000000000001 112.991 169.983 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -46.92 -48.56 21.3 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.122 1.369 . . . . 2.4100000000000001 113.682 170.233 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -80.67 -31.81 36.2 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.862 1.265 . . . . 5.6799999999999997 112.226 -171.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -55.58 -65.88 0.51 Allowed 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 123.98 0.912 . . . . 1.8 110.217 159.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -59.42 -32.6 70.33 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.26 2.224 . . . . 2.5499999999999998 114.619 -172.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 69.5 m -62.85 -14.87 51.13 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 119.909 -1.744 . . . . 2.1000000000000001 113.06 -176.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.46 HG21 ' HZ1' ' A' ' 61' ' ' LYS . 46.0 t -70.53 -24.22 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 O-C-N 120.893 -1.129 . . . . 2.04 112.418 171.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -67.16 -50.0 62.76 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.473 1.109 . . . . 1.97 110.356 171.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -56.15 -44.54 79.37 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.226 1.01 . . . . 2.27 111.411 172.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.4 m -53.43 -57.41 10.76 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 118.544 -0.741 . . . . 0.68000000000000005 111.578 174.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 14.3 ptp -66.58 -29.09 69.08 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 118.924 0.784 . . . . 1.8500000000000001 112.864 -177.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.1 mt -67.21 -50.86 59.25 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-N 119.011 0.823 . . . . 1.4399999999999999 111.44 171.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.2 m -62.18 -34.71 76.94 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 119.056 0.843 . . . . 1.8 112.151 177.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 35.5 mtp -65.56 -37.79 87.73 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.03 0.832 . . . . 1.75 112.732 172.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.38 -34.71 54.9 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 119.632 1.106 . . . . 1.01 113.152 175.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.468 ' CD2' HD11 ' B' ' 9' ' ' LEU . 0.2 OUTLIER -64.21 -28.42 69.73 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.018 0.826 . . . . 2.8300000000000001 112.993 175.618 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -56.41 -52.08 65.97 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.275 0.63 . . . . 2.1000000000000001 111.004 167.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.47 -32.96 66.65 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.094 1.357 . . . . 3.4700000000000002 112.509 -176.085 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -57.22 -48.94 77.53 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.476 1.51 . . . . 2.9199999999999999 110.889 170.186 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -61.41 -38.67 87.94 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.919 1.288 . . . . 2.8900000000000001 112.716 174.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.1 -20.97 64.08 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.484 0.92 . . . . 2.77 113.484 176.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -95.02 -4.49 46.41 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.513 1.301 . . . . 4.3700000000000001 114.513 172.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -96.65 -54.75 3.13 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.114 1.366 . . . . 3.9300000000000002 111.685 172.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.32 46.11 1.01 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.561 1.544 . . . . 4.0700000000000003 111.53 174.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.205 0 C-N-CA 129.165 2.986 . . . . 5.4900000000000002 115.736 -172.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 107.438 -1.319 . . . . 6.0 107.438 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -95.99 172.79 7.78 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 124.92 1.387 . . . . 6.3499999999999996 110.705 176.112 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' THR . . . . . 0.444 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 0.2 OUTLIER -76.16 176.26 3.47 Favored Pre-proline 0 CA--C 1.542 0.661 0 C-N-CA 129.034 2.934 . . . . 3.04 111.99 179.307 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 4' ' ' PRO . . . . . 0.444 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 42.4 Cg_endo -71.04 -16.6 32.17 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 121.966 1.778 . . . . 2.0800000000000001 115.097 -173.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -73.01 -49.68 27.47 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 120.671 1.578 . . . . 2.3599999999999999 110.038 177.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 6' ' ' GLU . . . . . 0.504 ' H ' ' CD ' ' B' ' 6' ' ' GLU . 18.7 mp0 -67.45 -45.47 75.91 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.244 1.818 . . . . 5.8799999999999999 108.748 -178.334 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.55 -36.4 69.24 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.098 1.359 . . . . 6.2199999999999998 112.699 171.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.19 -48.78 64.33 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 117.515 -1.231 . . . . 2.2599999999999998 111.197 170.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.468 HD11 ' CD2' ' A' ' 83' ' ' TYR 0.274 0.3 OUTLIER -63.15 -24.11 67.74 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.68 1.582 . . . . 3.1600000000000001 112.962 179.674 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.1 m -52.16 -34.5 45.16 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.942 0.897 . . . . 1.3600000000000001 111.992 165.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.88 -22.04 58.88 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 117.222 -1.371 . . . . 2.6299999999999999 113.169 -179.015 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 19.9 mtp -72.02 -44.67 63.03 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 119.685 1.13 . . . . 3.6099999999999999 111.475 175.123 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 2.9 m -66.05 -23.84 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 O-C-N 121.055 -1.028 . . . . 2.3999999999999999 111.273 175.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 58.7 m -75.74 -49.49 18.06 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.501 1.52 . . . . 0.93000000000000005 111.707 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.2 p -66.57 -40.24 88.87 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 119.129 0.877 . . . . 1.5600000000000001 109.605 170.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -63.02 -58.88 5.81 Favored 'General case' 0 C--O 1.224 -0.284 0 O-C-N 123.872 0.732 . . . . 2.0899999999999999 110.488 -174.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -57.81 -46.43 84.7 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 118.004 0.365 . . . . 2.5600000000000001 110.588 -175.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.74 -30.53 65.7 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.333 0.864 . . . . 5.2599999999999998 113.333 -174.218 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -82.19 -19.69 39.32 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.104 0.866 . . . . 2.6099999999999999 112.811 169.569 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 21.3 p -81.22 -27.96 35.05 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.008 1.484 . . . . 1.4099999999999999 115.008 178.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.06 -9.58 86.01 Favored Glycine 0 CA--C 1.538 1.504 0 O-C-N 120.506 -1.371 . . . . 2.3300000000000001 112.736 168.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.7 -23.16 63.39 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.136 1.774 . . . . 3.8700000000000001 113.923 -168.075 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -150.41 157.95 43.61 Favored 'General case' 0 C--O 1.245 0.852 0 C-N-CA 126.863 2.065 . . . . 4.1600000000000001 108.454 172.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.69 -3.91 0.21 Allowed Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.383 1.468 . . . . 2.8700000000000001 114.011 -170.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 8.5 t 41.66 -137.74 0.19 Allowed 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 124.877 1.271 . . . . 4.9800000000000004 112.9 -144.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . 0.316 0.0 OUTLIER 53.2 -176.15 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.658 1 C-N-CA 132.703 4.401 . . . . 11.25 114.893 -173.301 . . . . . . . . 4 3 . 1 . 013 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 14.4 tp -85.86 39.35 0.8 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.822 1.649 . . . . 4.6100000000000003 111.001 170.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 22.5 p -134.31 141.32 46.89 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.827 2.051 . . . . 1.1899999999999999 112.446 -167.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 53.8 mt -97.75 98.16 9.62 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.917 1.687 . . . . 1.77 111.2 172.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 29.1 t -54.09 151.9 6.51 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.167 1.387 . . . . 2.2200000000000002 110.893 158.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 25.4 ttm-85 -42.81 -37.56 1.84 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.52 1.928 . . . . 4.71 115.229 -172.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 17.1 tptt -87.39 -21.81 25.41 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 118.099 2.629 . . . . 8.9399999999999995 118.099 175.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -60.29 -49.62 76.9 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 108.178 -1.045 . . . . 2.3999999999999999 108.178 164.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -56.48 -50.4 71.87 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.967 1.707 . . . . 2.6000000000000001 111.386 -177.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 35' ' ' LYS . . . . . 0.413 ' HA ' HD12 ' B' ' 38' ' ' ILE . 0.0 OUTLIER -54.38 -42.52 70.44 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.056 1.132 . . . . 3.8900000000000001 114.056 -177.051 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -82.66 -35.53 26.79 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 118.251 -0.88 . . . . 4.9900000000000002 111.709 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.36 -42.29 81.77 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 118.096 -0.955 . . . . 2.1899999999999999 111.211 175.324 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 0.413 HD12 ' HA ' ' B' ' 35' ' ' LYS . 47.3 mt -44.9 -53.84 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 CA-C-N 120.178 1.354 . . . . 1.5800000000000001 110.27 171.251 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 4.5 ttpm? -78.19 -0.9 30.23 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 125.346 1.458 . . . . 3.6099999999999999 114.401 -174.078 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.85 -33.64 6.67 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 127.1 2.16 . . . . 4.1299999999999999 111.831 175.54 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.14 -68.51 0.38 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.889 1.675 . . . . 4.6299999999999999 107.185 170.098 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.13 141.25 52.7 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 121.33 -0.856 . . . . 3.2599999999999998 109.079 170.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 5.1 t -84.3 9.29 13.44 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.422 0.897 . . . . 4.3399999999999999 113.422 171.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 9.3 mp -89.71 153.38 20.75 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.372 1.469 . . . . 4.7199999999999998 111.688 -169.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.71 146.71 48.62 Favored Glycine 0 CA--C 1.532 1.146 0 N-CA-C 110.803 -0.919 . . . . 3.73 110.803 169.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.513 ' HG2' ' H ' ' B' ' 48' ' ' LYS . 23.4 tt0 -57.26 145.38 32.06 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.845 1.054 . . . . 10.41 113.845 -164.256 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 76.3 mmm -40.49 -40.95 1.33 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.322 1.849 . . . . 4.4900000000000002 113.271 161.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.513 ' H ' ' HG2' ' B' ' 46' ' ' GLU . 0.8 OUTLIER 99.53 140.05 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.968 1 C-N-CA 134.613 5.165 . . . . 3.4399999999999999 108.117 -172.267 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -43.13 -47.76 6.21 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.973 1.709 . . . . 3.8700000000000001 113.579 -176.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -65.02 -15.29 62.16 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 115.39 1.626 . . . . 2.8900000000000001 115.39 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 40.5 t -92.71 -15.27 26.9 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 120.074 1.306 . . . . 2.4500000000000002 112.663 171.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 37.3 mm -65.02 -26.96 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 124.752 1.221 . . . . 2.25 111.636 -177.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -63.72 -60.42 3.32 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 119.35 0.977 . . . . 5.96 112.417 178.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.35 -25.98 61.74 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.138 0.792 . . . . 3.4199999999999999 113.138 177.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -63.62 -58.21 7.64 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-O 118.766 -0.635 . . . . 2.2200000000000002 109.785 169.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ppp? -66.15 -36.28 82.69 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 118.935 0.789 . . . . 2.6600000000000001 110.873 -172.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -60.1 -23.8 64.12 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 127.774 2.43 . . . . 3.7200000000000002 113.994 173.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 9.3 t -80.34 -21.82 42.07 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.939 -1.101 . . . . 2.79 112.187 174.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.3 mt -90.67 -46.39 8.3 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.762 1.625 . . . . 2.25 109.809 178.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -67.6 137.05 55.36 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.89 1.276 . . . . 2.4300000000000002 110.82 172.011 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.21 -43.08 7.52 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.545 -1.347 . . . . 2.9199999999999999 111.43 175.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -86.39 -15.1 41.44 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.294 0.85 . . . . 2.0699999999999998 113.294 -168.445 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 9.3 t 67.85 16.33 9.66 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.588 1.555 . . . . 2.0099999999999998 112.218 -169.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -73.47 -24.67 60.24 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 130.384 3.473 . . . . 2.1600000000000001 110.318 174.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 64.69 0.52 1.16 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 128.524 2.729 . . . . 5.9699999999999998 115.573 169.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -77.14 130.67 37.64 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 108.088 -1.078 . . . . 2.1200000000000001 108.088 138.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 48.0 mt -100.54 112.97 34.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 124.999 1.32 . . . . 1.28 108.516 173.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.94 164.31 25.9 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 122.444 0.298 . . . . 2.5800000000000001 111.466 172.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -43.83 -42.68 5.79 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.366 1.466 . . . . 2.52 113.537 179.192 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 ttpm? -76.04 -25.47 55.67 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.406 2.282 . . . . 3.5099999999999998 113.842 -177.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -74.85 -50.4 17.18 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 107.77 -1.196 . . . . 1.6000000000000001 107.77 167.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -56.81 -36.04 69.46 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.618 1.967 . . . . 2.1200000000000001 115.14 -178.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 89.7 p -67.74 -15.28 63.56 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 118.684 -2.51 . . . . 1.77 113.599 175.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 27.9 t -70.37 -30.42 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 O-C-N 120.668 -1.27 . . . . 2.04 111.711 170.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -60.84 -53.44 57.37 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.528 -0.732 . . . . 2.27 110.427 166.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 41.5 mt -57.23 -39.14 74.9 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.648 0.779 . . . . 1.3700000000000001 112.189 176.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 91.5 m -55.34 -56.19 22.94 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.793 1.637 . . . . 0.93999999999999995 111.627 174.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 22.0 ptp -68.15 -35.83 78.7 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 112.917 0.71 . . . . 1.8100000000000001 112.917 -177.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 97.4 mt -61.84 -45.31 94.37 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 122.921 0.488 . . . . 1.76 110.904 172.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 3.0 t -61.18 -32.19 71.93 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.173 0.897 . . . . 1.8799999999999999 112.817 177.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 68.3 mtp -71.57 -34.86 70.32 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.918 1.081 . . . . 1.99 113.918 172.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.46 -44.2 83.4 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.763 1.165 . . . . 1.05 110.475 171.16 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -64.71 -22.02 66.88 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.009 0.744 . . . . 2.3399999999999999 113.009 -179.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -61.18 -62.12 2.07 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 119.245 0.929 . . . . 2.1400000000000001 112.59 162.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.97 -30.47 65.31 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 119.343 0.974 . . . . 3.6800000000000002 112.51 -172.05 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -58.44 -46.96 85.49 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.481 1.912 . . . . 3.6000000000000001 112.143 169.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -60.7 -29.7 69.49 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.443 -1.411 . . . . 3.1600000000000001 112.193 169.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 86.5 mt -83.99 -5.03 59.15 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 117.893 -1.051 . . . . 2.6600000000000001 113.443 171.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -89.83 -23.9 21.57 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.874 1.67 . . . . 6.4699999999999998 112.618 170.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.44 -44.63 64.45 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.803 1.241 . . . . 3.52 110.682 163.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -90.34 4.02 52.02 Favored 'General case' 0 CA--C 1.558 1.265 0 N-CA-C 114.944 1.461 . . . . 3.0600000000000001 114.944 -176.105 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 1.1 tttp . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 117.969 2.581 . . . . 5.5800000000000001 117.969 -166.375 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.8 mmt . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 108.868 -0.79 . . . . 5.9800000000000004 108.868 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -99.0 151.28 21.09 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 128.517 2.727 . . . . 4.8300000000000001 108.702 -176.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.05 153.95 42.22 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 126.485 1.914 . . . . 2.8700000000000001 112.278 -175.086 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -65.93 -26.83 51.26 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.699 2.266 . . . . 2.1099999999999999 113.482 -167.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -65.31 -36.03 82.81 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.597 0.759 . . . . 3.2599999999999998 111.238 171.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -73.11 -36.9 66.85 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.129 -0.982 . . . . 4.1200000000000001 111.321 174.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -61.93 -33.37 74.13 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.063 -1.023 . . . . 4.4900000000000002 112.491 169.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.31 -46.58 60.34 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.997 1.319 . . . . 1.23 112.232 174.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 66.6 mt -72.41 -29.48 63.77 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 120.605 -1.309 . . . . 2.04 113.026 177.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.8 p -71.1 -32.34 68.91 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 120.695 -1.253 . . . . 2.6699999999999999 112.669 169.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.1 m -53.96 -39.96 66.42 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.852 1.206 . . . . 1.3999999999999999 110.782 171.028 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -61.05 -44.24 97.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.072 0.949 . . . . 4.1500000000000004 113.48 176.202 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.8 m -71.5 -19.6 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 CA-C-N 119.969 1.259 . . . . 2.25 113.097 176.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 87.4 m -80.48 -33.36 36.65 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.715 2.006 . . . . 1.3100000000000001 113.211 -179.128 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 p -70.82 -39.78 72.85 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.216 0.916 . . . . 1.96 108.87 158.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -62.98 -57.37 10.96 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.407 0.549 . . . . 1.6499999999999999 112.326 -167.506 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 -54.79 -44.99 74.23 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.728 -0.608 . . . . 3.3599999999999999 111.812 174.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -67.62 -42.72 81.89 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.872 0.869 . . . . 4.1500000000000004 112.492 -171.19 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -78.35 -29.21 47.38 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.605 -0.685 . . . . 2.1099999999999999 112.457 174.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.4 t -56.98 -19.04 15.99 Favored 'General case' 0 C--O 1.247 0.939 0 N-CA-C 114.738 1.385 . . . . 1.97 114.738 174.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.68 -5.04 88.61 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 116.823 -2.098 . . . . 1.8799999999999999 116.869 175.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 -76.94 -23.9 52.41 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 119.87 1.835 . . . . 4.8399999999999999 115.633 -174.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -162.65 162.29 26.95 Favored 'General case' 0 C--O 1.248 0.993 0 C-N-CA 126.861 2.065 . . . . 5.0899999999999999 109.805 -173.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 47.09 -137.58 9.7 Favored Glycine 0 N--CA 1.474 1.214 0 C-N-CA 125.836 1.684 . . . . 1.9299999999999999 113.877 174.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.2 t -73.6 167.97 20.25 Favored 'General case' 0 C--O 1.251 1.164 0 CA-C-O 123.121 1.439 . . . . 2.5800000000000001 112.982 173.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 38.9 mttp -117.07 67.47 0.73 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 130.604 3.562 . . . . 7.4400000000000004 109.501 -175.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 164.18 -10.77 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.969 1 C-N-CA 133.71 4.804 . . . . 3.8100000000000001 110.502 -174.458 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.6 p -107.76 160.46 15.7 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.466 2.307 . . . . 1.3899999999999999 112.282 167.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.8 mt -108.76 101.53 10.65 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.75 1.62 . . . . 1.51 111.307 162.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.4 m -71.1 160.8 32.23 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 125.102 1.361 . . . . 2.8999999999999999 113.138 -177.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -41.07 -47.03 3.08 Favored 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 115.472 1.656 . . . . 5.0099999999999998 115.472 -172.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.52 -30.29 13.41 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 121.122 1.783 . . . . 4.46 113.271 -178.086 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -49.87 -41.73 46.09 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.665 1.186 . . . . 1.51 110.32 163.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -68.55 -50.31 52.88 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.496 1.118 . . . . 2.7200000000000002 112.032 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -56.77 -38.52 72.59 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.223 -0.923 . . . . 4.1100000000000003 113.232 -178.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.0 tp10 -66.03 -44.17 85.44 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.36 0.664 . . . . 3.71 112.786 173.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.2 -51.65 69.06 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.664 1.185 . . . . 2.0499999999999998 111.94 -176.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 35.3 mt -54.21 -48.65 66.26 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 CA-C-O 121.925 0.869 . . . . 0.82999999999999996 110.478 179.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? -69.35 -8.88 50.33 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.371 1.068 . . . . 5.2000000000000002 112.405 -176.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.61 -71.14 0.66 Allowed 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.738 1.615 . . . . 4.5 112.805 157.474 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -40.61 -51.39 2.98 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.256 1.422 . . . . 4.3499999999999996 111.864 -172.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.32 9.76 17.0 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 115.608 1.707 . . . . 2.8599999999999999 115.608 -162.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 53.1 t -73.13 74.72 1.26 Allowed 'General case' 0 CA--C 1.551 1.012 0 CA-C-O 123.945 1.831 . . . . 3.5600000000000001 113.043 -177.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -80.5 -47.75 13.82 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 126.366 1.866 . . . . 5.0099999999999998 109.243 166.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -125.04 162.52 19.32 Favored Glycine 0 CA--C 1.534 1.281 0 N-CA-C 108.054 -2.018 . . . . 4.7999999999999998 108.054 139.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.07 120.42 31.24 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.686 1.743 . . . . 7.8899999999999997 110.591 -178.335 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.9 ptm -70.55 141.0 51.9 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.071 -1.018 . . . . 2.3300000000000001 110.825 168.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.41 166.91 22.08 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.93 1.085 . . . . 4.5 113.93 -166.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.35 -45.33 69.11 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 127.06 2.144 . . . . 5.9900000000000002 114.087 -168.366 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.4 p -76.06 -40.41 53.3 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 126.099 1.76 . . . . 2.4100000000000001 112.342 177.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.8 m -61.02 -28.6 69.17 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.43 -0.794 . . . . 2.4300000000000002 112.597 174.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.3 mt -70.91 -35.09 58.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-O 117.612 -1.185 . . . . 1.24 112.243 171.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.32 -29.0 57.13 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 120.432 1.469 . . . . 3.04 113.5 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -72.67 -38.01 67.75 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.103 0.865 . . . . 2.3700000000000001 112.025 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -58.67 -47.32 84.9 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.445 0.698 . . . . 2.46 109.666 169.323 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.26 -44.76 80.0 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.796 1.239 . . . . 1.8999999999999999 111.93 173.86 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.12 -22.92 61.63 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 119.881 1.219 . . . . 4.0599999999999996 113.047 173.33 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.1 t -80.84 -36.93 30.85 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 119.81 -1.806 . . . . 2.46 112.714 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.5 mp -64.57 -49.08 72.58 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 121.073 -1.017 . . . . 2.9300000000000002 110.608 168.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -103.05 71.44 1.13 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.255 1.822 . . . . 2.4399999999999999 111.718 -164.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -50.97 -27.94 8.77 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.916 1.686 . . . . 3.1699999999999999 114.074 -168.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 41.4 p30 -100.69 -11.52 19.89 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.318 1.847 . . . . 2.9300000000000002 114.744 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.4 t 50.49 52.65 14.41 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.825 1.25 . . . . 4.1600000000000001 112.047 -168.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.5 p30 -83.9 -11.13 57.37 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.575 1.55 . . . . 2.48 111.1 174.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 70.28 13.72 7.6 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 130.256 3.423 . . . . 4.4500000000000002 113.997 -177.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -131.65 120.97 23.55 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 127.209 2.204 . . . . 2.48 108.924 179.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 47.4 mt -101.72 108.14 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.004 -1.06 . . . . 1.6000000000000001 111.709 -178.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -64.34 155.74 31.34 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 127.71 2.404 . . . . 2.5499999999999998 111.571 164.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -34.68 68.33 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.477 -1.389 . . . . 2.04 114.324 -179.17 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? -83.72 -24.66 31.12 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 120.497 -1.377 . . . . 2.9900000000000002 112.502 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -60.46 -54.25 47.85 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 108.777 -0.823 . . . . 1.9299999999999999 108.777 157.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -62.07 -33.05 73.69 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 126.706 2.003 . . . . 3.1200000000000001 115.77 -174.414 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.41 -21.65 65.56 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 120.872 -1.143 . . . . 1.8100000000000001 112.452 -171.222 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.1 p -57.45 -35.29 49.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 123.632 0.773 . . . . 2.3199999999999998 112.573 170.398 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.469 ' CE1' HD11 ' A' ' 79' ' ' LEU . 18.2 t80 -61.79 -61.01 2.81 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 126.144 1.778 . . . . 2.1299999999999999 111.299 -173.274 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.5 mt -68.15 -24.54 65.0 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.451 -0.785 . . . . 2.3999999999999999 111.332 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 30.0 m -61.59 -54.88 37.07 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.199 0.909 . . . . 0.68999999999999995 110.983 168.296 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 78.1 mtm -58.36 -37.66 75.66 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.258 0.935 . . . . 1.46 112.888 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.469 HD11 ' CE1' ' A' ' 75' ' ' PHE . 43.6 mt -73.36 -46.24 50.25 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.853 0.686 . . . . 1.5700000000000001 112.853 178.41 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 1.7 t -71.11 -25.86 62.78 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.418 -0.801 . . . . 1.8100000000000001 112.721 178.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 44.6 mmm -58.82 -48.51 81.06 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.807 1.243 . . . . 1.74 111.657 165.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.67 -37.85 85.58 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.17 -0.957 . . . . 0.84999999999999998 112.067 174.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -64.88 -33.11 75.24 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.161 1.171 . . . . 2.27 114.161 173.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -58.25 -46.7 85.49 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.608 1.095 . . . . 2.1899999999999999 111.499 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -75.47 -35.36 60.87 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.086 1.354 . . . . 3.8500000000000001 111.984 -172.442 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.21 -46.02 79.63 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.991 1.716 . . . . 2.25 110.981 167.02 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -69.02 -27.49 65.72 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.672 1.189 . . . . 2.5899999999999999 112.466 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 78.6 mt -70.33 -41.36 73.33 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.967 -1.083 . . . . 1.8500000000000001 111.546 171.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -71.47 -13.73 61.91 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.954 1.464 . . . . 3.21 114.954 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -75.14 -58.95 2.97 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.377 -0.827 . . . . 4.6299999999999999 111.182 163.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -68.32 -11.52 59.63 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 115.524 1.675 . . . . 3.8799999999999999 115.524 -165.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.908 0 C-N-CA 126.583 1.953 . . . . 4.9299999999999997 115.223 -179.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 118.02 -0.991 . . . . 5.6699999999999999 108.834 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -131.06 -131.82 0.2 Allowed 'General case' 0 CA--C 1.544 0.729 0 O-C-N 124.032 0.832 . . . . 9.1699999999999999 113.043 -164.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 72.4 p -66.84 168.75 9.64 Favored Pre-proline 0 C--O 1.237 0.42 0 C-N-CA 128.832 2.853 . . . . 2.8799999999999999 113.189 -156.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -65.01 -14.51 45.7 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 121.571 1.514 . . . . 1.96 112.489 168.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.2 -40.92 74.31 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-N 119.987 1.267 . . . . 3.0299999999999998 112.298 174.609 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -60.26 -27.6 67.38 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 120.676 1.58 . . . . 4.1500000000000004 112.58 171.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -74.7 -25.64 59.28 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.646 -1.284 . . . . 5.4400000000000004 111.869 171.498 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.45 -47.89 30.79 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.726 1.211 . . . . 1.02 112.116 172.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mp -60.5 -41.63 94.71 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 120.552 1.523 . . . . 2.4100000000000001 112.086 176.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 17.6 p -65.68 -39.41 91.29 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 118.147 -0.93 . . . . 2.0600000000000001 112.231 174.153 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 87.8 m -57.3 -45.48 84.13 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.775 1.17 . . . . 1.28 110.893 169.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 4.4 tmm? -60.18 -53.08 61.91 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.089 1.355 . . . . 3.79 111.584 -176.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 9.9 p -64.79 -25.06 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 O-C-N 121.241 -0.912 . . . . 2.1600000000000001 112.801 175.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 56.3 m -74.9 -45.42 42.82 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 117.978 -1.01 . . . . 0.75 111.276 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 8.6 p -58.48 -38.44 77.62 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.825 0.738 . . . . 1.5900000000000001 110.105 164.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -63.77 -51.98 62.41 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.927 -0.309 . . . . 2.4100000000000001 111.723 -173.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -78.16 -21.81 49.67 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 114.157 1.169 . . . . 2.23 114.157 -177.276 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -68.6 -54.88 13.75 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.068 0.849 . . . . 4.3499999999999996 111.374 167.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -73.25 -27.49 61.61 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 121.577 -0.702 . . . . 2.3500000000000001 112.412 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 10.5 p -68.74 -25.66 64.85 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.92 1.691 . . . . 2.3700000000000001 113.21 172.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.24 5.4 84.4 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 126.684 2.088 . . . . 1.6499999999999999 114.678 170.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -70.42 -29.11 65.63 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.166 1.483 . . . . 3.6800000000000002 112.171 172.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -156.75 153.84 29.03 Favored 'General case' 0 C--O 1.249 1.034 0 CA-C-O 121.899 0.857 . . . . 3.9500000000000002 112.255 176.542 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 58.08 -127.82 46.03 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 126.689 2.09 . . . . 2.5600000000000001 110.972 166.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.91 121.69 11.14 Favored 'General case' 0 C--O 1.249 1.027 0 O-C-N 122.267 -0.549 . . . . 3.0499999999999998 110.127 167.086 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -76.72 54.74 1.0 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 128.367 2.667 . . . . 7.4800000000000004 110.393 166.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 53.7 tp -161.28 -51.09 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 126.213 1.805 . . . . 2.7400000000000002 107.906 -178.312 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.6 p -92.28 157.42 16.67 Favored 'General case' 0 C--O 1.254 1.338 0 CA-C-O 123.513 1.625 . . . . 1.49 112.626 175.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -103.4 107.21 17.95 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 111.636 -2.529 . . . . 3.0800000000000001 107.814 167.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 41.4 t -70.91 143.03 51.1 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 108.594 -0.891 . . . . 2.1200000000000001 108.594 161.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -24.36 -51.51 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 128.727 2.811 . . . . 5.5700000000000003 116.352 -175.217 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -44.18 91.63 Favored 'General case' 0 CA--C 1.554 1.112 0 N-CA-C 116.107 1.891 . . . . 5.04 116.107 174.134 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -59.95 -43.74 94.81 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.862 2.065 . . . . 1.8 109.514 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.38 -44.93 70.5 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.245 1.418 . . . . 3.3399999999999999 110.834 -179.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -54.96 -42.11 71.94 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.069 -1.02 . . . . 2.8700000000000001 112.283 174.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -59.9 -49.06 79.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.532 0.733 . . . . 3.0299999999999998 111.805 174.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.5 tp -57.78 -44.52 86.29 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.144 0.978 . . . . 2.23 112.715 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 73.8 mt -56.74 -55.4 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 N-CA-C 109.558 -0.534 . . . . 1.29 109.558 171.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -63.5 -17.52 62.84 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 112.95 0.722 . . . . 4.5800000000000001 112.95 -175.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -87.25 -48.56 7.92 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 125.902 1.681 . . . . 4.7000000000000002 113.917 -178.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -116.09 -8.84 11.77 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 125.399 1.687 . . . . 6.5499999999999998 114.384 -159.254 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 24.0 tp -121.34 88.72 2.99 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.753 1.221 . . . . 2.5499999999999998 109.073 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 17.9 p -82.4 13.89 3.34 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 115.088 1.514 . . . . 4.4400000000000004 115.088 -157.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 8.0 mp -75.98 134.16 40.24 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.121 0.968 . . . . 3.5299999999999998 111.173 -169.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.59 -20.97 59.86 Favored Glycine 0 CA--C 1.532 1.15 0 CA-C-O 119.625 -0.541 . . . . 2.9399999999999999 113.83 177.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -87.39 -3.81 59.02 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.886 1.275 . . . . 5.6900000000000004 113.629 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 7.3 tpt -77.06 39.16 0.23 Allowed 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 124.309 2.004 . . . . 2.27 112.144 171.43 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -57.84 125.89 25.01 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 127.138 2.175 . . . . 3.98 109.848 -174.329 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 65.1 tt0 -58.38 -29.37 65.97 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 115.267 1.58 . . . . 3.5499999999999998 115.267 -166.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -66.66 -14.39 62.41 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 120.556 1.525 . . . . 2.4100000000000001 113.789 173.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 9.4 t -97.19 -7.84 31.44 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.669 1.588 . . . . 2.2999999999999998 112.422 172.047 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 12.5 mt -65.28 -40.39 88.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 119.843 1.202 . . . . 1.29 110.813 176.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -72.0 -23.89 61.48 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.206 0.817 . . . . 3.0800000000000001 113.206 -174.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -76.1 -37.22 58.38 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.467 0.707 . . . . 2.3900000000000001 111.809 172.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 10.3 tt -62.62 -49.39 75.38 Favored 'General case' 0 C--N 1.343 0.316 0 O-C-N 121.506 -0.746 . . . . 2.4399999999999999 110.184 168.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.09 -48.78 67.49 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 124.341 1.056 . . . . 3.1800000000000002 111.72 177.443 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -58.4 -36.47 73.61 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.313 1.845 . . . . 4.0300000000000002 113.056 173.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 67.9 m -77.57 -19.43 55.67 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.317 1.847 . . . . 2.1699999999999999 114.315 177.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 20.4 mt -78.08 -54.37 6.34 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.338 -0.851 . . . . 1.8 109.568 159.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -82.88 53.43 2.41 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 129.699 3.2 . . . . 2.0600000000000001 112.197 -172.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -58.53 -19.17 35.42 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.049 1.74 . . . . 3.2200000000000002 113.642 -172.43 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 50.9 p30 -96.23 -8.33 33.23 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.39 1.876 . . . . 2.1800000000000002 115.145 174.72 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 68.1 m 60.68 28.64 18.35 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.916 1.686 . . . . 2.1499999999999999 114.743 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 47.1 p30 -79.11 -8.54 59.06 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.173 -0.954 . . . . 2.29 111.562 177.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 71.12 -15.22 0.42 Allowed 'General case' 0 C--O 1.236 0.369 0 C-N-CA 131.038 3.735 . . . . 3.9700000000000002 115.282 171.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -78.3 150.14 33.37 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-O 122.752 1.263 . . . . 3.71 110.16 159.39 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 37.1 mm -113.72 112.14 39.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 125.824 1.649 . . . . 1.3100000000000001 108.561 164.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 68' ' ' ASP . . . . . 0.444 ' CG ' ' HZ2' ' B' ' 70' ' ' LYS . 0.0 OUTLIER -82.73 168.68 16.97 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.607 1.163 . . . . 2.8799999999999999 111.315 163.54 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -56.63 -33.27 66.14 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.508 0.929 . . . . 2.5499999999999998 113.508 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.444 ' HZ2' ' CG ' ' B' ' 68' ' ' ASP . 8.6 mtmp? -70.14 -44.28 69.19 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.555 -1.34 . . . . 4.1699999999999999 111.975 176.378 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -59.59 -47.91 83.74 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 118.838 0.744 . . . . 1.77 109.812 171.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -59.42 -31.91 69.71 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.849 1.66 . . . . 2.0499999999999998 114.851 179.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 38.3 t -56.43 -30.63 63.06 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.753 -1.217 . . . . 1.99 112.518 171.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 45.5 t -60.13 -44.47 95.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 O-C-N 121.394 -0.817 . . . . 1.54 110.471 175.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -58.24 -53.3 59.88 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.659 0.784 . . . . 1.6000000000000001 111.384 176.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 59.8 mt -60.28 -40.2 89.6 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.131 0.973 . . . . 1.55 111.604 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.9 m -62.02 -53.26 58.12 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.322 1.449 . . . . 0.80000000000000004 110.981 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.9 mtm -57.43 -38.79 74.95 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.383 0.512 . . . . 1.52 112.383 179.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 95.1 mt -70.39 -47.28 61.59 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 118.572 -0.728 . . . . 1.5800000000000001 111.699 178.347 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 65.0 m -64.4 -30.18 71.23 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 120.034 1.288 . . . . 1.8 113.872 175.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 81.3 mtp -64.39 -48.69 74.49 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.074 0.852 . . . . 2.2400000000000002 111.242 165.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.76 -39.01 92.84 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.298 0.953 . . . . 0.89000000000000001 112.513 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -66.66 -33.31 75.36 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.427 1.012 . . . . 3.3199999999999998 112.803 174.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.96 -49.99 58.5 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.271 1.028 . . . . 1.78 111.001 172.419 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -64.2 -46.69 82.8 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.802 1.241 . . . . 4.2000000000000002 110.725 -175.488 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -62.39 -41.26 98.53 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.234 1.813 . . . . 2.0600000000000001 112.509 174.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -64.26 -32.43 74.02 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 120.802 -1.186 . . . . 2.7200000000000002 111.104 174.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 66.0 mt -73.22 -17.25 61.37 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 117.934 -1.031 . . . . 1.8300000000000001 113.573 173.085 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -83.34 -15.01 51.66 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.905 1.23 . . . . 4.8700000000000001 113.679 168.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -85.57 -59.65 2.25 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.075 1.35 . . . . 3.1200000000000001 111.645 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.62 -4.67 32.3 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 115.064 1.505 . . . . 2.8599999999999999 115.064 -170.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.046 0 C-N-CA 126.649 1.98 . . . . 4.7800000000000002 114.969 175.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.6 ttm . . . . . 0 N--CA 1.476 0.852 0 N-CA-C 107.289 -1.374 . . . . 8.3300000000000001 107.289 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.4 mp0 -123.29 -67.8 0.92 Allowed 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 107.169 -1.419 . . . . 4.9199999999999999 107.169 -157.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 24.9 p -151.73 157.73 34.4 Favored Pre-proline 0 C--O 1.238 0.485 0 C-N-CA 128.569 2.747 . . . . 3.2400000000000002 108.617 177.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.77 -25.98 16.43 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 122.926 2.418 . . . . 2.6899999999999999 111.199 162.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.66 -47.01 85.55 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.676 1.59 . . . . 2.8599999999999999 112.351 -178.578 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -60.8 -34.73 74.95 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.258 0.481 . . . . 4.0599999999999996 111.746 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.33 -28.82 65.42 Favored 'General case' 0 CA--C 1.552 1.033 0 O-C-N 119.851 -1.781 . . . . 4.3899999999999997 112.17 175.424 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.16 -39.89 62.95 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.63 -0.669 . . . . 1.7 111.657 173.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 97.6 mt -59.9 -47.0 87.55 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.859 0.754 . . . . 1.3799999999999999 110.887 172.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 m -52.96 -54.52 33.76 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.424 1.49 . . . . 2.5499999999999998 112.031 171.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.7 t -66.86 -28.48 68.37 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-N 120.5 1.5 . . . . 2.6600000000000001 112.879 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.98 -48.45 63.1 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 117.782 -1.104 . . . . 3.77 112.365 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.0 p -63.74 -24.5 35.97 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-N 120.689 1.586 . . . . 2.27 111.848 175.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.9 m -73.9 -53.07 10.96 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.347 1.459 . . . . 0.72999999999999998 111.923 179.459 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.4 p -63.77 -35.01 79.18 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.701 1.137 . . . . 2.0499999999999998 110.533 171.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -59.05 -62.87 1.56 Allowed 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 108.925 -0.768 . . . . 1.8799999999999999 108.925 177.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.99 -31.13 69.74 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.647 1.112 . . . . 2.4700000000000002 112.725 -172.165 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -57.77 -49.25 77.22 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.704 -0.623 . . . . 4.2300000000000004 112.358 169.46 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -83.94 -29.57 26.99 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.951 -1.093 . . . . 2.9199999999999999 113.397 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.9 p -69.46 -30.69 68.65 Favored 'General case' 0 C--O 1.242 0.689 0 O-C-N 120.82 -1.175 . . . . 2.2999999999999998 111.047 172.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.57 -1.15 70.04 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 127.518 2.485 . . . . 1.72 115.467 171.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -72.23 -42.56 65.55 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.879 1.839 . . . . 5.8799999999999999 111.37 -177.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -149.56 166.44 29.22 Favored 'General case' 0 C--O 1.244 0.775 0 C-N-CA 125.781 1.633 . . . . 3.8500000000000001 113.011 -177.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.62 -132.77 51.62 Favored Glycine 0 C--N 1.339 0.735 0 C-N-CA 125.292 1.425 . . . . 2.5800000000000001 110.779 171.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.5 m -64.34 138.21 58.31 Favored 'General case' 0 C--O 1.249 1.051 0 O-C-N 121.934 -0.745 . . . . 2.6400000000000001 110.555 163.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 36.1 pttt -67.81 -24.81 65.33 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.31 0.644 . . . . 5.3799999999999999 111.929 171.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.0 mt -81.57 -23.74 36.95 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.931 1.292 . . . . 3.71 113.683 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 61.1 p -109.26 146.15 34.74 Favored 'General case' 0 C--O 1.244 0.799 0 CA-C-N 119.934 1.243 . . . . 1.24 111.276 175.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.84 83.37 2.54 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.245 -1.02 . . . . 2.1499999999999999 108.245 163.251 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.0 m -58.16 143.62 43.4 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 123.914 0.885 . . . . 3.7000000000000002 108.803 176.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 35.7 ptt-85 -47.47 -34.89 7.89 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 117.241 2.312 . . . . 6.3300000000000001 117.241 -158.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.5 ptmm? -51.76 -39.53 58.71 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 116.337 1.977 . . . . 4.6600000000000001 116.337 168.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -68.1 -52.57 33.49 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 128.334 2.654 . . . . 1.6499999999999999 108.747 169.355 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.6 tp -64.37 -33.95 77.03 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.799 0.666 . . . . 2.6099999999999999 112.799 -172.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -8.84 54.07 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 115.184 1.55 . . . . 4.8099999999999996 115.184 -179.239 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -74.96 -66.79 0.71 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 118.592 -0.718 . . . . 3.9500000000000002 109.758 156.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 31.8 tp -44.33 -54.49 5.76 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.319 1.448 . . . . 2.5299999999999998 113.26 -167.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 28.6 mt -48.14 -44.47 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 123.43 0.692 . . . . 0.96999999999999997 112.102 -176.018 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.275 0.0 OUTLIER -84.45 -9.07 58.71 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-O 118.626 -0.702 . . . . 4.1600000000000001 110.896 -167.769 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -67.28 -57.58 6.39 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.733 1.151 . . . . 2.6699999999999999 109.627 168.1 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -54.95 -69.16 0.14 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.885 2.074 . . . . 4.5099999999999998 110.421 171.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -79.23 65.23 4.34 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.66 1.219 . . . . 2.6699999999999999 108.402 176.165 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.8 p -59.96 -55.09 38.31 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.411 1.884 . . . . 3.5 111.647 176.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.464 HD12 ' H ' ' A' ' 44' ' ' LEU . 4.4 mp -14.28 -110.82 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.737 1 C-N-CA 132.378 4.271 . . . . 4.7000000000000002 115.876 -174.789 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -147.13 -28.63 0.07 OUTLIER Glycine 0 N--CA 1.473 1.119 0 O-C-N 121.473 -0.767 . . . . 3.6000000000000001 114.595 175.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 27.1 mp0 -63.24 -43.04 99.15 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 128.339 2.656 . . . . 5.5199999999999996 111.581 -177.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.17 67.59 6.04 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 123.961 1.838 . . . . 2.1200000000000001 110.333 165.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.3 tptp -72.5 160.23 32.64 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 111.49 -2.595 . . . . 6.8799999999999999 109.652 160.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.565 ' CD ' ' H ' ' A' ' 49' ' ' GLU . 4.4 mp0 -52.25 -45.85 65.53 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.624 1.57 . . . . 4.75 113.188 -170.503 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.8 t -80.02 -15.17 57.77 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.507 1.299 . . . . 3.04 114.507 178.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.9 m -68.04 -19.27 64.87 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.129 1.332 . . . . 2.6800000000000002 111.712 173.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 70.6 mt -85.93 -24.12 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 125.548 1.539 . . . . 1.49 112.808 -175.087 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -57.0 -58.08 9.74 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.698 -0.852 . . . . 3.6200000000000001 108.698 162.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -66.45 -38.61 87.74 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.339 0.866 . . . . 2.5299999999999998 113.339 -175.168 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.68 -51.35 70.32 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 118.582 -0.723 . . . . 2.3999999999999999 110.395 171.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.08 -33.26 70.03 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.236 0.925 . . . . 1.8200000000000001 112.5 -176.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.3 mtpt -58.72 -39.38 80.67 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.446 1.021 . . . . 4.7599999999999998 112.489 170.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.7 t -77.41 -30.37 53.48 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.617 0.969 . . . . 1.77 113.617 173.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.52 -36.36 76.36 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 124.398 1.079 . . . . 2.6200000000000001 112.143 178.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -72.45 77.48 1.04 Allowed 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.682 1.193 . . . . 1.6200000000000001 111.276 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 3.5 0.21 Allowed 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.863 1.665 . . . . 5.3600000000000003 114.974 -170.209 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 38.7 p30 -137.67 -0.79 2.11 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 127.298 2.239 . . . . 3.0899999999999999 114.525 173.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.9 m 60.73 37.48 18.92 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 115.182 1.549 . . . . 4.1299999999999999 115.182 168.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -88.11 -32.0 18.92 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 126.905 2.082 . . . . 2.7599999999999998 112.975 177.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 105.89 -1.17 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.043 1 C-N-CA 136.455 5.902 . . . . 4.0999999999999996 114.087 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -107.92 136.38 47.73 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 128.21 2.604 . . . . 2.4900000000000002 110.429 178.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 24.7 mm -112.05 114.34 46.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 124.173 0.989 . . . . 1.5800000000000001 108.468 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -103.48 156.92 17.4 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.558 2.343 . . . . 3.3199999999999998 108.589 173.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -37.82 -45.19 0.81 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.976 1.71 . . . . 2.4399999999999999 114.241 176.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.3 pttt -63.9 -18.31 64.07 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.965 1.306 . . . . 3.6800000000000002 114.025 -177.006 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -105.14 -53.17 2.71 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 127.797 2.439 . . . . 2.9100000000000001 108.147 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -45.25 -35.1 3.17 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 128.384 2.674 . . . . 2.0699999999999998 114.81 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.1 m -68.79 -15.3 63.47 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 120.657 -1.277 . . . . 1.9399999999999999 113.182 178.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 84.3 t -67.06 -31.37 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-N 119.348 0.977 . . . . 2.2599999999999998 110.637 169.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -59.33 -53.19 61.08 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 118.983 0.811 . . . . 1.77 110.323 168.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 22.1 mt -62.73 -35.91 81.28 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.255 0.622 . . . . 1.5700000000000001 111.186 -176.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.4 m -63.2 -42.39 99.31 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 125.12 1.368 . . . . 1.1599999999999999 111.507 172.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 44.3 ttm -61.6 -42.6 99.1 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.499 1.12 . . . . 3.3799999999999999 111.431 178.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.34 -56.66 10.05 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.056 0.543 . . . . 2.7999999999999998 111.253 173.193 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.3 m -60.99 -34.34 74.65 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.8 1.037 . . . . 1.5800000000000001 113.8 -175.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 56.0 mtp -76.7 -24.99 53.11 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.927 1.24 . . . . 2.25 113.918 173.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.3 -43.63 40.61 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 120.525 1.511 . . . . 0.93999999999999995 111.454 169.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -63.61 -28.73 70.12 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.494 1.043 . . . . 2.23 112.914 173.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -54.38 -56.72 15.72 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.577 0.751 . . . . 2.0699999999999998 111.75 165.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.75 -42.35 81.93 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.855 0.862 . . . . 3.2400000000000002 111.661 -176.171 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.52 -44.44 69.14 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.589 1.956 . . . . 2.2400000000000002 112.347 172.15 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -70.62 -32.2 69.44 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.577 -1.327 . . . . 3.0800000000000001 111.723 176.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.3 mt -84.41 -1.52 55.69 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 125.466 1.507 . . . . 1.9399999999999999 113.546 174.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -74.11 -22.42 59.48 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 121.088 -1.007 . . . . 5.2300000000000004 112.348 162.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -106.28 -65.07 1.1 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.379 1.872 . . . . 5.0099999999999998 111.39 176.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -84.22 42.84 0.9 Allowed 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 126.726 2.011 . . . . 4.2199999999999998 112.467 -178.422 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.5 mmtt . . . . . 0 C--O 1.252 1.215 0 C-N-CA 130.375 3.47 . . . . 8.2899999999999991 115.959 -177.669 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.75 0 N-CA-C 103.636 -2.727 . . . . 5.1100000000000003 103.636 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.722 ' CD ' ' H ' ' B' ' 2' ' ' GLU . 7.5 mp0 -58.03 171.37 0.53 Allowed 'General case' 0 C--O 1.246 0.908 0 C-N-CA 126.119 1.767 . . . . 6.04 109.203 140.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 48.4 p -90.74 165.59 21.96 Favored Pre-proline 0 N--CA 1.469 0.486 0 C-N-CA 125.053 1.341 . . . . 1.75 112.629 -163.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -63.41 -20.66 70.51 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 121.818 1.679 . . . . 2.1600000000000001 112.898 168.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -80.19 -43.39 21.62 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-O 117.136 -1.412 . . . . 2.4300000000000002 111.905 175.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.93 -46.98 81.67 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.436 1.471 . . . . 4.6200000000000001 110.922 168.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -57.97 -27.8 63.78 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.103 -0.998 . . . . 5.1699999999999999 112.959 172.44 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.09 -39.85 54.39 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 120.597 -1.314 . . . . 1.6599999999999999 111.659 176.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 96.0 mt -66.22 -32.5 73.96 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.016 0.926 . . . . 1.73 112.011 171.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.4 m -60.44 -55.98 26.96 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.087 0.858 . . . . 1.8500000000000001 110.777 161.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 83.4 m -53.07 -39.48 63.33 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.15 1.38 . . . . 2.48 111.375 -174.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -48.25 -42.6 30.91 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.027 1.731 . . . . 3.9700000000000002 112.864 174.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 66.4 t -62.41 -28.64 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 124.967 1.307 . . . . 2.2000000000000002 112.674 178.32 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 14.5 m -66.07 -39.96 90.5 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.991 1.716 . . . . 1.1200000000000001 112.423 -179.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -44.94 68.34 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 126.548 1.939 . . . . 1.8400000000000001 108.713 169.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -67.73 -43.97 78.72 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 123.719 0.637 . . . . 2.04 111.721 -169.209 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.46 -47.84 83.93 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.895 0.878 . . . . 2.9300000000000002 111.479 170.44 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 3.7 ttmp? -73.19 -40.61 64.63 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.667 0.988 . . . . 3.8100000000000001 113.667 -171.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -70.67 -26.07 63.27 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.047 -0.978 . . . . 2.3199999999999998 112.187 166.055 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 32.3 m -68.19 -40.54 82.19 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 120.702 1.592 . . . . 1.49 113.118 167.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.59 -12.88 83.78 Favored Glycine 0 CA--C 1.532 1.153 0 C-N-CA 125.769 1.652 . . . . 1.78 112.9 -178.079 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.06 97.83 0.53 Allowed 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 105.832 -1.914 . . . . 4.5700000000000003 105.832 153.122 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 65.17 175.45 0.21 Allowed 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 126.175 1.79 . . . . 5.4400000000000004 114.655 167.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.66 -140.03 30.56 Favored Glycine 0 N--CA 1.474 1.231 0 C-N-CA 125.919 1.723 . . . . 2.1899999999999999 113.036 174.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 67.6 m -78.36 162.42 26.47 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.517 -0.99 . . . . 3.3199999999999998 112.553 171.339 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 19.2 ttmt -85.65 128.24 34.72 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 127.187 2.195 . . . . 7.1299999999999999 107.363 156.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.0 tt 91.59 -24.66 0.06 Allowed 'General case' 0 N--CA 1.492 1.625 0 C-N-CA 128.819 2.848 . . . . 3.54 112.321 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.55 137.1 47.06 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 125.287 1.435 . . . . 1.8100000000000001 109.623 170.559 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 75.7 mt -98.29 98.39 9.65 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.928 1.291 . . . . 1.5900000000000001 110.627 175.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 3.6 m -52.43 153.56 2.93 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 122.102 0.953 . . . . 2.3199999999999998 112.493 163.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 19.1 ttp85 -48.52 -39.55 23.7 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.893 1.277 . . . . 3.6299999999999999 114.162 -172.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -68.59 -40.72 80.37 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 119.58 -1.95 . . . . 6.3600000000000003 111.7 178.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -53.77 -51.13 64.39 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.638 1.575 . . . . 1.76 109.245 177.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 15.0 tp -64.77 -45.61 85.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.477 1.111 . . . . 2.04 112.657 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 2.1 tmpt? -58.17 -34.31 70.18 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 118.883 0.765 . . . . 4.8399999999999999 111.711 175.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -68.64 -54.54 15.75 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.624 0.769 . . . . 4.4000000000000004 111.676 172.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.43 -52.74 64.17 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 126.16 1.784 . . . . 2.1099999999999999 112.294 -176.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 29.0 mt -59.72 -44.44 93.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 119.338 0.972 . . . . 1.45 110.092 178.439 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.425 ' HZ1' ' CD ' ' B' ' 49' ' ' GLU . 13.8 tppt? -66.65 -11.79 55.36 Favored 'General case' 0 CA--C 1.557 1.23 0 O-C-N 121.512 -0.743 . . . . 5.0499999999999998 112.488 178.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmtm -105.46 -35.59 7.43 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.796 2.038 . . . . 5.2300000000000004 114.591 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -69.71 -63.26 1.11 Allowed 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 124.8 1.24 . . . . 5.04 109.668 170.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -86.32 56.83 4.16 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.022 0.929 . . . . 2.4199999999999999 108.976 179.17 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 4.8 t -70.09 24.78 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 125.588 1.555 . . . . 3.6099999999999999 114.868 -173.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 38.6 mt -77.41 -3.86 42.41 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 128.746 2.818 . . . . 3.54 113.516 -177.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.14 -49.24 4.19 Favored Glycine 0 N--CA 1.47 0.945 0 C-N-CA 125.042 1.306 . . . . 3.9100000000000001 112.692 179.016 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -60.48 -10.16 4.61 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.583 1.553 . . . . 5.46 114.381 176.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 8.0 tpt -71.31 69.05 0.54 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.106 1.762 . . . . 2.0600000000000001 111.203 170.054 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -88.94 153.41 21.05 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.656 1.982 . . . . 3.7799999999999998 112.845 -166.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.425 ' CD ' ' HZ1' ' B' ' 39' ' ' LYS . 5.3 mp0 -49.64 -57.32 7.42 Favored 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 127.12 2.168 . . . . 4.25 112.096 -165.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 12.0 m -73.12 -0.21 13.45 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.317 1.599 . . . . 2.5699999999999998 115.317 -179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 15.7 t -97.27 -33.39 11.47 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.437 1.095 . . . . 2.7400000000000002 111.451 164.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 38.8 mt -58.81 -35.33 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 124.677 1.191 . . . . 1.6100000000000001 110.015 166.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -61.66 -25.04 67.14 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.515 1.126 . . . . 3.8399999999999999 113.829 170.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.491 ' HA ' ' HE2' ' B' ' 57' ' ' LYS . 7.8 t70 -89.93 -32.95 16.6 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 121.021 1.737 . . . . 4.1799999999999997 113.051 173.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -52.0 -41.72 62.41 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 118.646 -0.693 . . . . 2.5600000000000001 109.42 158.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -53.49 52.56 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 120.139 1.336 . . . . 2.1400000000000001 111.55 175.389 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 57' ' ' LYS . . . . . 0.491 ' HE2' ' HA ' ' B' ' 54' ' ' ASP . 30.0 mtmm -51.1 -44.1 61.21 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 118.988 0.813 . . . . 3.7000000000000002 112.9 176.119 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 38.9 m -76.06 -40.39 53.37 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.895 1.278 . . . . 2.02 113.279 -176.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 9.6 mp -71.36 -35.8 71.26 Favored 'General case' 0 C--O 1.225 -0.194 0 O-C-N 120.959 -1.088 . . . . 2.3399999999999999 111.808 178.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -100.11 98.49 9.2 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 119.612 1.096 . . . . 1.4299999999999999 113.897 -163.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -98.14 -14.8 20.22 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.933 1.693 . . . . 3.27 115.278 -176.145 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.88 -21.27 60.15 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 119.448 1.022 . . . . 2.5800000000000001 110.303 152.523 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 50.6 m 60.78 66.69 0.89 Allowed 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.04 1.736 . . . . 4.3399999999999999 111.165 168.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -147.3 -116.49 0.07 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.665 1.586 . . . . 3.5600000000000001 109.5 -148.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -149.74 -5.18 0.36 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 116.57 2.063 . . . . 4.54 116.57 169.168 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -115.37 139.13 50.27 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.89 1.276 . . . . 2.46 111.527 167.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 8.0 mm -94.27 110.78 24.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 126.24 1.816 . . . . 1.1699999999999999 109.858 172.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -58.22 156.26 10.1 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.593 1.157 . . . . 3.3999999999999999 110.705 166.38 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.99 -39.52 66.1 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.164 -1.585 . . . . 2.3500000000000001 111.525 169.263 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -76.59 -18.07 58.84 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.751 1.389 . . . . 3.8799999999999999 114.751 178.095 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -73.97 -50.33 20.46 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 108.322 -0.992 . . . . 1.8799999999999999 108.322 163.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -61.1 -26.28 67.56 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 128.814 2.845 . . . . 1.96 115.338 -177.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 68.6 m -47.91 -34.55 9.17 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 120.851 -1.156 . . . . 2.21 113.441 172.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 6.6 m -69.22 -22.45 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 O-C-N 121.208 -0.933 . . . . 2.6400000000000001 113.155 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -64.97 -59.54 4.05 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.101 0.96 . . . . 1.8100000000000001 110.031 175.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 58.6 mt -55.19 -37.65 67.34 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.792 0.837 . . . . 1.52 110.839 176.075 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 30.8 m -57.95 -61.84 2.25 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.619 1.168 . . . . 0.91000000000000003 111.677 173.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 24.3 ptp -68.08 -32.21 72.37 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 118.949 0.795 . . . . 1.8300000000000001 112.848 -174.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -46.02 81.22 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.923 0.889 . . . . 3.25 110.529 175.027 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.6 t -69.9 -27.67 64.98 Favored 'General case' 0 CA--C 1.545 0.786 0 O-C-N 121.736 -0.602 . . . . 2.1200000000000001 112.5 175.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 61.6 mtp -67.19 -40.38 86.53 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.837 -1.164 . . . . 1.96 112.768 168.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.81 -37.3 78.76 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.566 1.076 . . . . 0.77000000000000002 111.397 172.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 5.0 m-30 -65.7 -24.16 66.93 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.955 1.094 . . . . 2.1899999999999999 113.955 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -70.28 -41.3 73.59 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 119.82 1.191 . . . . 2.2400000000000002 111.866 174.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -65.61 -44.56 86.19 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.375 1.07 . . . . 3.3199999999999998 110.519 176.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.82 -47.05 77.88 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.14 1.776 . . . . 2.0600000000000001 111.884 174.037 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -63.66 -21.37 66.34 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.192 1.397 . . . . 2.6099999999999999 112.382 175.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 85.5 mt -88.27 -7.19 57.16 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 114.305 1.224 . . . . 1.79 114.305 176.156 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -70.18 -35.2 73.79 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.171 0.896 . . . . 5.1399999999999997 111.779 161.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -100.75 -65.34 0.97 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.538 1.935 . . . . 3.54 112.681 -168.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -79.91 34.36 0.29 Allowed 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 125.594 1.558 . . . . 3.9100000000000001 112.501 175.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.875 0 C-N-CA 131.521 3.928 . . . . 7.1699999999999999 117.518 -172.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.9 ptt? . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 108.569 -0.9 . . . . 7.9000000000000004 108.569 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -110.67 -93.92 0.43 Allowed 'General case' 0 CA--C 1.537 0.445 0 O-C-N 124.907 1.379 . . . . 3.75 108.633 -153.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.433 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 1.2 p -153.26 179.61 1.25 Allowed Pre-proline 0 N--CA 1.478 0.965 0 C-N-CA 127.03 2.132 . . . . 1.46 109.123 169.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.433 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 95.0 Cg_endo -76.9 -9.31 18.12 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 121.471 1.447 . . . . 1.47 113.7 171.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -76.92 -49.63 15.15 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.022 1.329 . . . . 2.71 112.67 -178.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -56.66 -34.96 67.86 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.574 1.079 . . . . 4.5 110.876 169.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.7 mtpm? -73.24 -26.65 61.21 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.575 -1.328 . . . . 4.71 113.415 173.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.0 -49.99 39.11 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.756 1.222 . . . . 1.21 109.921 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.3 mt -56.16 -45.49 79.65 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.319 1.048 . . . . 1.8500000000000001 111.258 171.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.4 m -54.42 -53.34 55.48 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.091 0.956 . . . . 1.77 111.736 171.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 t -67.39 -32.76 73.9 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 120.094 1.315 . . . . 2.2200000000000002 112.172 -178.118 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 95.4 mtp -59.0 -51.65 69.16 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.412 1.085 . . . . 2.8900000000000001 112.452 169.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.2 m -68.82 -28.55 40.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 CA-C-N 119.153 0.888 . . . . 2.1800000000000002 112.745 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 90.9 m -60.84 -57.02 14.41 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.88 1.272 . . . . 0.85999999999999999 110.089 173.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -57.94 -40.06 79.59 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 122.789 0.436 . . . . 2.21 110.736 172.475 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -64.14 -47.86 78.29 Favored 'General case' 0 C--N 1.334 -0.077 0 C-N-CA 119.901 -0.719 . . . . 1.97 112.078 -171.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -40.67 74.57 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.881 1.218 . . . . 2.8100000000000001 111.759 178.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -58.37 -47.33 84.17 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.684 1.993 . . . . 3.73 113.427 178.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -70.78 -37.38 73.33 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.827 0.851 . . . . 2.3900000000000001 112.481 168.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.3 m -64.22 -20.59 66.13 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.816 -1.178 . . . . 2.27 113.771 178.187 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -98.33 40.35 2.51 Favored Glycine 0 CA--C 1.533 1.186 0 C-N-CA 127.501 2.477 . . . . 1.99 113.11 171.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.1 mmp_? -105.08 -17.89 14.34 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.275 1.03 . . . . 4.96 113.169 167.261 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -175.03 172.41 2.84 Favored 'General case' 0 C--O 1.248 0.984 0 C-N-CA 127.172 2.189 . . . . 4.7000000000000002 110.737 -173.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.57 -135.48 50.57 Favored Glycine 0 C--N 1.337 0.629 0 C-N-CA 124.915 1.245 . . . . 1.97 111.726 171.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.1 m -84.89 164.46 18.38 Favored 'General case' 0 C--O 1.246 0.872 0 CA-C-O 121.494 0.664 . . . . 2.54 112.079 163.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -84.64 156.31 21.6 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.18 0.992 . . . . 4.9299999999999997 110.224 157.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.2 tp 73.15 -2.74 2.64 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.745 2.018 . . . . 3.9300000000000002 112.392 -159.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 61.3 p -138.89 150.41 45.93 Favored 'General case' 0 C--O 1.253 1.272 0 C-N-CA 125.342 1.457 . . . . 0.95999999999999996 113.798 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.1 mt -114.87 109.79 18.68 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.711 2.004 . . . . 1.5600000000000001 111.631 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.9 t -84.42 173.76 10.63 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.042 1.337 . . . . 2.3199999999999998 112.042 167.535 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -51.36 -41.72 60.83 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 114.724 1.379 . . . . 3.8900000000000001 114.724 -163.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.42 ' HZ2' ' HB2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -82.68 -28.94 30.27 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 120.332 1.424 . . . . 3.7400000000000002 113.414 178.545 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -56.45 -46.09 80.5 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.281 0.946 . . . . 1.7 109.81 166.267 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -73.09 -41.86 63.61 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.124 0.97 . . . . 2.3300000000000001 111.016 -173.575 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.74 -41.16 77.04 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.253 -0.905 . . . . 6.4400000000000004 113.28 167.488 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -70.61 -31.43 68.41 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.943 0.72 . . . . 3.2599999999999998 112.943 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 tt -64.75 -63.48 1.11 Allowed 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.47 -0.937 . . . . 2.23 108.47 174.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.7 mt -56.28 -56.72 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-N 119.044 0.838 . . . . 1.05 112.305 -172.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 mmmm -79.26 4.22 15.67 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.496 1.295 . . . . 5.0599999999999996 114.496 -171.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -112.37 -36.5 5.26 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 117.718 -1.134 . . . . 3.21 113.656 166.075 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -66.27 -34.15 77.35 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.104 1.361 . . . . 3.9399999999999999 112.81 172.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -105.82 108.72 20.38 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 107.974 -1.121 . . . . 2.3999999999999999 107.974 168.008 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 28.2 p -80.13 51.99 1.47 Allowed 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.101 0.96 . . . . 4.7699999999999996 113.227 -178.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.5 mp -111.11 153.51 25.59 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.773 2.029 . . . . 4.54 112.722 -170.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -82.91 -17.95 66.44 Favored Glycine 0 CA--C 1.536 1.355 0 O-C-N 121.219 -0.926 . . . . 3.8199999999999998 112.59 166.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -79.34 -157.18 0.12 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 129.561 3.144 . . . . 5.9000000000000004 111.024 178.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.8 tpt 55.86 22.01 5.29 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 123.494 1.616 . . . . 3.1400000000000001 113.589 -178.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.6 tttm -72.03 154.44 41.13 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 113.732 -1.576 . . . . 5.6699999999999999 114.136 -141.051 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.7 mp0 -66.02 -22.17 66.43 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 116.058 1.873 . . . . 5.5999999999999996 116.058 -134.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.7 t -67.09 -15.23 63.59 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.3 -1.5 . . . . 2.4700000000000002 113.783 171.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.7 t -82.98 -12.23 57.46 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.667 1.187 . . . . 2.9199999999999999 113.4 170.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 18.0 mm -74.87 -35.05 34.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 124.568 1.147 . . . . 1.6899999999999999 110.924 -176.302 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.92 -33.23 75.23 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.661 1.584 . . . . 3.0600000000000001 110.899 176.747 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -75.23 -47.39 28.35 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-O 118.397 -0.811 . . . . 2.4199999999999999 111.79 165.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.23 -45.12 68.58 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.581 1.082 . . . . 2.3900000000000001 110.87 -172.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.6 ppp? -62.88 -48.67 77.97 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 122.149 -0.344 . . . . 2.29 111.701 175.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -18.95 47.81 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.406 2.282 . . . . 4.0499999999999998 114.342 173.29 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.9 m -94.98 -27.63 15.55 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 127.411 2.284 . . . . 3.1699999999999999 112.934 177.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 96.9 mt -76.91 -33.46 57.75 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.366 1.066 . . . . 1.9199999999999999 112.002 165.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -73.35 68.65 1.09 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.985 2.114 . . . . 1.78 112.582 -173.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.1 tttt -54.29 -23.84 16.68 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 127.97 2.508 . . . . 4.5899999999999999 114.009 -175.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -85.06 -23.13 28.69 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.472 1.286 . . . . 2.4100000000000001 114.472 173.057 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.3 t 57.73 63.75 1.73 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.043 1.337 . . . . 2.54 112.432 -167.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -120.12 -108.75 0.35 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.427 2.291 . . . . 2.7400000000000002 109.338 -172.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -142.45 -19.9 0.69 Allowed 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 115.231 1.567 . . . . 6.04 115.231 167.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -132.7 145.5 51.1 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 122.599 1.19 . . . . 2.4700000000000002 110.815 -169.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 8.8 mm -86.88 113.48 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 125.713 1.605 . . . . 1.27 107.666 174.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.34 174.12 11.92 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.767 0.827 . . . . 3.0899999999999999 111.702 167.694 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -54.5 -38.24 66.25 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-O 122.564 1.173 . . . . 2.2599999999999998 112.163 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -78.45 -22.06 48.17 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.107 2.163 . . . . 3.1200000000000001 113.577 -173.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -79.01 -54.11 6.35 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.213 1.805 . . . . 1.72 109.005 161.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -53.7 -37.72 63.55 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 128.122 2.569 . . . . 2.4399999999999999 115.005 -173.455 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -20.23 56.7 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 120.988 -1.07 . . . . 2.02 113.755 174.555 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 53.3 t -70.13 -28.24 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 120.875 -1.141 . . . . 1.79 110.973 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -64.58 -53.56 45.93 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.369 -0.832 . . . . 1.98 110.928 171.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -54.64 -45.79 73.84 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.427 1.091 . . . . 2.1200000000000001 110.548 177.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 88.1 m -53.6 -49.28 68.12 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.373 1.069 . . . . 0.81000000000000005 112.263 176.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 50.4 mtm -62.18 -47.48 84.29 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 118.684 0.675 . . . . 1.3700000000000001 112.596 178.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.8 mt -65.56 -36.75 84.7 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.737 -0.602 . . . . 1.5800000000000001 112.125 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 4.3 t -68.44 -32.34 72.3 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 118.467 -0.777 . . . . 1.3200000000000001 112.477 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -47.72 85.12 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 118.855 0.752 . . . . 3.6899999999999999 110.921 171.185 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.26 -38.02 89.04 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.196 0.907 . . . . 1.6899999999999999 113.086 -175.316 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -68.68 -29.93 68.5 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.134 0.79 . . . . 2.6699999999999999 113.134 174.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -73.79 -44.27 56.45 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.943 0.792 . . . . 2.3799999999999999 111.669 171.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -72.44 -16.7 61.82 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.435 1.094 . . . . 4.4900000000000002 111.664 -173.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -50.91 -57.83 7.52 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.624 1.97 . . . . 3.1200000000000001 111.682 166.037 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -55.18 -28.9 56.22 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.973 0.909 . . . . 3.79 112.584 176.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 71.6 mt -83.39 -18.47 38.69 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.782 0.833 . . . . 1.96 111.324 -172.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.412 ' HA ' ' HZ3' ' A' ' 92' ' ' LYS . 71.3 mm-40 -90.4 -15.32 31.22 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.905 1.446 . . . . 3.7999999999999998 114.905 164.485 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -77.15 -29.2 54.47 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.607 1.163 . . . . 3.4700000000000002 111.818 163.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -85.95 56.89 4.18 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.711 2.005 . . . . 5.2800000000000002 112.64 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.412 ' HZ3' ' HA ' ' A' ' 89' ' ' GLU . 39.7 mmtm . . . . . 0 C--O 1.25 1.118 0 C-N-CA 128.548 2.739 . . . . 4.9400000000000004 114.037 172.05 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.479 1.007 0 N-CA-C 107.927 -1.138 . . . . 5.7199999999999998 107.927 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -69.57 170.06 11.42 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 126.459 1.904 . . . . 6.0899999999999999 109.663 168.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 71.6 p -71.03 159.62 85.02 Favored Pre-proline 0 N--CA 1.476 0.854 0 O-C-N 121.984 -0.447 . . . . 1.8999999999999999 111.52 177.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -62.46 -20.06 69.36 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.005 1.803 . . . . 1.3 112.738 174.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -83.13 -41.72 18.19 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.736 1.215 . . . . 3.2999999999999998 111.949 174.511 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -58.29 -31.88 67.9 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.606 1.094 . . . . 3.6099999999999999 110.923 164.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.81 -30.46 62.73 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.106 -1.621 . . . . 4.0800000000000001 112.921 172.43 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.16 -43.35 92.08 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.206 -0.934 . . . . 1.0 111.027 168.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 81.6 mt -61.36 -44.77 96.6 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.429 1.091 . . . . 1.54 111.84 169.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 85.7 m -53.43 -47.2 69.84 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.73 1.212 . . . . 2.1600000000000001 110.543 174.004 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 27.3 m -59.42 -52.5 65.36 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.041 0.937 . . . . 1.5800000000000001 109.326 174.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 4.3 tpp -50.13 -53.56 26.71 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.943 1.697 . . . . 3.2799999999999998 112.299 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 21.2 m -70.99 -21.27 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 112.706 0.632 . . . . 2.4500000000000002 112.706 -175.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 61.5 m -83.42 -45.29 13.84 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.034 1.333 . . . . 0.84999999999999998 111.283 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -54.61 -41.08 69.52 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.497 -0.557 . . . . 1.6499999999999999 109.497 164.204 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -71.75 -35.22 70.05 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 120.326 -0.55 . . . . 2.1800000000000002 111.662 -176.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -64.42 -51.12 64.74 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 120.444 -1.41 . . . . 2.6699999999999999 112.095 170.82 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -55.93 -51.84 66.23 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.924 0.889 . . . . 6.3600000000000003 111.788 177.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.476 ' CD2' HD13 ' B' ' 37' ' ' LEU . 56.1 m-85 -83.43 -34.99 25.35 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 117.372 -1.299 . . . . 1.9399999999999999 112.504 -172.257 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 60.2 p -68.39 -28.68 67.31 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 121.351 1.887 . . . . 1.6699999999999999 111.733 174.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.27 17.37 5.08 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 125.81 1.671 . . . . 1.7 114.516 170.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 5.6 mmp_? -92.45 62.88 4.03 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 120.372 2.086 . . . . 6.6100000000000003 109.608 166.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 71.2 -177.91 0.21 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.195 1.398 . . . . 4.3300000000000001 112.123 -175.321 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.72 -146.0 50.14 Favored Glycine 0 CA--C 1.53 0.988 0 N-CA-C 109.829 -1.309 . . . . 2.1699999999999999 109.829 -156.272 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 73.3 m -78.67 153.97 30.54 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.277 -1.131 . . . . 3.5099999999999998 111.405 161.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 15.4 ttpt -68.24 55.81 0.07 Allowed 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 125.344 1.458 . . . . 7.7699999999999996 111.153 160.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -170.88 -31.99 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 126.42 1.888 . . . . 3.2999999999999998 111.658 -165.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 20.7 p -119.34 151.58 38.22 Favored 'General case' 0 C--O 1.242 0.694 0 C-N-CA 125.764 1.626 . . . . 1.0800000000000001 113.422 -175.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 87.4 mt -114.53 119.44 36.82 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.274 2.23 . . . . 1.77 112.243 178.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 4.8 t -104.18 179.22 4.34 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 113.506 0.928 . . . . 2.98 113.506 162.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 31.0 ttp180 -56.16 -36.02 67.84 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.71 1.744 . . . . 4.0800000000000001 115.71 -161.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -29.04 64.0 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 120.457 -1.402 . . . . 5.4800000000000004 113.452 173.546 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -72.22 -51.68 19.93 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 108.006 -1.109 . . . . 2.1000000000000001 108.006 177.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 mt -67.71 -33.15 74.33 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-O 117.475 -1.25 . . . . 2.5 113.884 176.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.7 ttmt -53.13 -48.63 67.75 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 120.816 1.644 . . . . 3.46 111.788 170.05 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -66.38 -45.54 79.7 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.378 0.881 . . . . 3.8599999999999999 113.378 176.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 37' ' ' LEU . . . . . 0.476 HD13 ' CD2' ' B' ' 19' ' ' TYR . 55.1 tp -74.05 -45.24 50.72 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 117.682 -1.152 . . . . 2.04 112.572 -175.837 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 28.6 mt -57.25 -52.43 56.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 CA-C-N 121.041 1.746 . . . . 1.3700000000000001 107.999 176.235 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . 0.344 0.0 OUTLIER -70.49 8.46 0.82 Allowed 'General case' 0 CA--C 1.558 1.268 0 CA-C-O 122.022 0.915 . . . . 5.4900000000000002 113.106 -178.91 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 10.1 mmtm -118.99 -29.6 5.23 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 127.158 2.183 . . . . 5.8200000000000003 115.696 170.546 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -67.86 -29.73 68.94 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.964 1.256 . . . . 5.6100000000000003 109.706 160.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.451 HD21 HD11 ' B' ' 79' ' ' LEU . 3.7 mm? -111.49 63.86 0.62 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 126.391 1.877 . . . . 2.6400000000000001 109.015 170.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.9 t -62.72 -33.69 75.64 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 120.443 -1.411 . . . . 3.3999999999999999 111.945 -178.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.421 HD23 ' H ' ' B' ' 44' ' ' LEU . 1.8 pt? -90.49 -5.0 56.57 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.022 1.729 . . . . 4.0 114.996 172.227 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -103.79 10.98 52.97 Favored Glycine 0 N--CA 1.475 1.296 0 CA-C-O 118.401 -1.222 . . . . 3.4300000000000002 115.915 -162.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 70.87 -83.52 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.339 1.855 . . . . 5.6299999999999999 112.663 169.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 1.1 mmt 70.71 87.91 0.11 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 128.455 2.702 . . . . 3.3599999999999999 113.309 -168.19 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 mttp -61.59 133.61 55.85 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.655 -1.278 . . . . 3.5899999999999999 110.951 166.452 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -36.06 -56.89 0.72 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 127.12 2.168 . . . . 3.7999999999999998 114.998 -177.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 29.3 t -67.28 -15.01 63.44 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.389 1.255 . . . . 3.4100000000000001 114.389 -176.566 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 10.5 t -85.43 -12.51 51.82 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.405 1.002 . . . . 2.3100000000000001 112.796 171.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 71.3 mt -77.74 -37.53 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 CA-C-N 119.316 0.962 . . . . 2.7599999999999998 109.871 179.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -70.79 -39.93 72.85 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.718 1.207 . . . . 2.9100000000000001 113.108 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -68.77 -40.25 79.8 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 118.489 0.586 . . . . 2.9900000000000002 111.4 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 25.4 tp -59.23 -48.42 81.68 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 117.429 -1.272 . . . . 1.8999999999999999 110.437 172.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 58.0 mmm -50.18 -48.83 53.86 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 120.158 1.344 . . . . 2.29 111.823 173.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -16.82 48.83 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.107 1.763 . . . . 4.2800000000000002 113.994 175.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.13 -31.9 12.23 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.399 1.48 . . . . 2.2599999999999998 113.659 171.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 59' ' ' LEU . . . . . 0.453 HD22 ' HB2' ' B' ' 75' ' ' PHE . 13.1 mt -76.21 -24.13 54.65 Favored 'General case' 0 N--CA 1.463 0.186 0 O-C-N 120.933 -1.104 . . . . 1.99 111.56 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -94.04 149.05 21.58 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.504 1.122 . . . . 1.98 113.664 168.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -99.78 -11.76 20.53 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.734 1.614 . . . . 3.6800000000000002 113.169 172.439 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.63 -62.79 1.53 Allowed 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.342 0.868 . . . . 1.8200000000000001 113.342 -157.67 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 58.6 m 109.98 12.57 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.116 1 C-N-CA 132.332 4.253 . . . . 2.77 111.667 -157.146 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 48.0 p-10 -83.82 8.18 15.62 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 119.377 -2.077 . . . . 2.71 112.289 -165.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 55.18 2.05 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 130.564 3.546 . . . . 4.1699999999999999 115.923 -166.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -131.88 121.14 23.57 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 125.499 1.52 . . . . 2.8100000000000001 111.342 -168.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 2.8 mp -93.06 103.84 15.1 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.398 1.479 . . . . 1.8500000000000001 107.736 177.074 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.24 160.18 32.65 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.268 1.427 . . . . 3.3599999999999999 111.517 169.51 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -47.69 -46.93 29.89 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.579 1.551 . . . . 2.2599999999999998 112.512 -179.443 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -69.2 -17.45 63.8 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.817 0.847 . . . . 4.8099999999999996 112.776 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -84.44 -51.96 6.53 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.592 1.157 . . . . 1.9199999999999999 109.966 170.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -53.13 -25.81 14.54 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.89 2.476 . . . . 1.75 114.14 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.27 -20.17 65.22 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.776 -1.202 . . . . 2.5099999999999998 111.426 177.53 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.3 p -70.45 -31.32 46.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 O-C-N 120.79 -1.194 . . . . 2.0699999999999998 112.252 172.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.453 ' HB2' HD22 ' B' ' 59' ' ' LEU . 10.7 t80 -63.36 -56.16 18.61 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 108.682 -0.858 . . . . 1.8100000000000001 108.682 174.828 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 96.2 mt -53.88 -39.56 65.81 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.832 1.253 . . . . 1.4099999999999999 112.385 175.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 97.8 m -62.16 -53.58 53.28 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.294 1.038 . . . . 0.94999999999999996 111.862 176.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 19.7 ptp -68.82 -32.87 72.88 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 118.604 0.638 . . . . 1.8500000000000001 112.64 -177.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.451 HD11 HD21 ' B' ' 42' ' ' LEU . 2.0 mm? -65.64 -49.69 67.77 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.043 0.937 . . . . 2.4300000000000002 112.277 170.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 12.8 t -65.45 -32.0 73.38 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.035 0.383 . . . . 1.6599999999999999 112.035 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -45.9 92.84 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.837 0.744 . . . . 2.6000000000000001 112.255 167.034 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.02 -40.73 94.68 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.176 0.898 . . . . 0.80000000000000004 111.89 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -60.95 -24.8 66.35 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.431 1.271 . . . . 2.04 114.431 176.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -70.03 -42.55 72.8 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.636 1.107 . . . . 1.98 111.909 174.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -69.8 -41.3 75.23 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.959 0.904 . . . . 3.02 110.315 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -51.45 -53.09 40.62 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.581 1.552 . . . . 2.3100000000000001 110.9 169.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -61.96 -24.25 66.89 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.54 1.536 . . . . 2.9399999999999999 113.705 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 47.0 mt -79.7 -23.44 42.4 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.529 -1.357 . . . . 1.8600000000000001 112.456 174.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -94.55 -6.69 43.09 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.74 1.385 . . . . 4.04 114.74 170.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -86.38 -37.57 18.28 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 127.35 2.26 . . . . 3.7400000000000002 113.488 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 28.8 m-20 -82.33 49.55 1.45 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.193 1.797 . . . . 3.8399999999999999 113.244 -167.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? . . . . . 0 C--O 1.252 1.219 0 C-N-CA 128.095 2.558 . . . . 7.71 114.334 178.06 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.478 0.958 0 CA-C-O 117.242 -1.361 . . . . 6.8300000000000001 110.226 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 46.62 -120.51 1.04 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.769 2.028 . . . . 3.75 112.821 167.402 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 66.2 p -153.17 162.43 26.47 Favored Pre-proline 0 N--CA 1.472 0.665 0 C-N-CA 124.893 1.277 . . . . 1.8500000000000001 111.61 -161.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -64.5 -11.75 30.06 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 122.426 2.084 . . . . 1.6000000000000001 113.128 166.015 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.91 -38.05 15.94 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.104 1.362 . . . . 2.5800000000000001 111.471 178.29 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -55.44 -50.5 69.67 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 108.961 -0.755 . . . . 4.8499999999999996 108.961 159.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.428 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -59.18 -31.08 68.68 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.665 -0.647 . . . . 3.7599999999999998 112.6 177.063 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.34 -53.69 39.95 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.429 0.692 . . . . 1.21 110.861 172.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 44.8 mt -54.77 -44.75 73.95 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.058 0.943 . . . . 1.95 112.234 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.8 p -69.37 -36.87 77.25 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 117.844 -1.074 . . . . 2.2599999999999998 112.447 176.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.4 m -62.32 -39.92 94.62 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 120.292 1.405 . . . . 1.3500000000000001 111.564 171.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 72.8 mtp -60.59 -51.92 67.37 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.067 0.947 . . . . 3.21 112.173 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.3 p -63.46 -34.37 67.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 CA-C-N 118.692 0.678 . . . . 2.52 111.506 173.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 85.3 m -61.74 -53.71 52.31 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 117.923 -1.037 . . . . 0.81999999999999995 111.067 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.5 p -55.97 -43.29 77.43 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.036 0.835 . . . . 2.23 109.559 172.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -64.64 -54.63 28.84 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.302 0.376 . . . . 1.98 111.51 -169.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.7 -32.65 73.45 Favored 'General case' 0 CA--C 1.548 0.869 0 O-C-N 121.544 -0.723 . . . . 2.5099999999999998 111.831 179.221 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -76.81 -12.87 60.04 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.453 1.279 . . . . 4.1699999999999999 114.453 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -92.43 -33.24 14.61 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 119.527 1.058 . . . . 2.46 112.56 155.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.8 p -42.76 -48.3 5.6 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 117.389 2.366 . . . . 3.7799999999999998 117.389 -163.077 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -88.01 4.82 85.49 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 125.393 1.473 . . . . 1.95 114.319 -173.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 35.3 mtp180 -92.6 50.26 1.57 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.663 1.232 . . . . 5.5 108.957 175.26 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 115.34 151.76 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.877 1 C-N-CA 131.832 4.053 . . . . 4.4000000000000004 111.455 -177.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.86 -159.99 48.51 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 120.752 -1.218 . . . . 2.27 113.391 -179.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.4 t -75.22 161.91 28.93 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.885 -0.773 . . . . 3.77 111.981 172.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.0 mmtp -49.96 -24.92 2.84 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.279 1.432 . . . . 4.7199999999999998 112.404 155.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 18.9 tp -93.47 -13.64 27.65 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 117.35 -1.309 . . . . 3.8500000000000001 114.095 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 53.7 p -128.04 145.04 51.11 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-N 120.714 1.597 . . . . 0.96999999999999997 114.983 -168.012 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.8 mt -101.19 120.44 40.23 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.772 1.629 . . . . 1.5800000000000001 111.876 170.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.4 p -78.37 171.81 14.53 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.961 1.467 . . . . 2.9700000000000002 114.961 -177.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -45.43 -27.6 0.73 Allowed 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 115.021 1.489 . . . . 3.3700000000000001 115.021 167.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.93 -38.97 6.43 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.863 1.265 . . . . 3.8599999999999999 113.148 -178.593 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -67.63 -30.06 69.53 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.062 1.345 . . . . 2.1899999999999999 111.584 175.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.2 tp -75.33 -47.97 25.3 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.097 0.959 . . . . 1.8700000000000001 112.417 173.484 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -15.2 57.59 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.95 1.463 . . . . 4.79 114.95 -172.639 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -94.87 -39.23 10.34 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.951 1.093 . . . . 4.6299999999999999 113.951 175.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 39.6 tp -58.33 -50.78 72.43 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.469 1.031 . . . . 2.3599999999999999 111.558 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.1 mt -52.51 -57.09 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-O 121.628 0.728 . . . . 0.98999999999999999 109.081 175.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.404 ' HE2' ' OE1' ' A' ' 49' ' ' GLU . 25.9 ttpp -67.11 -8.3 29.71 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.254 1.205 . . . . 3.8399999999999999 114.254 -176.298 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.9 mmtm -95.27 -33.43 12.57 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 125.358 1.463 . . . . 3.7999999999999998 112.212 172.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -68.61 -66.96 0.51 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.086 1.754 . . . . 4.9500000000000002 110.045 169.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -70.52 22.54 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 126.667 1.987 . . . . 2.8300000000000001 113.667 176.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 12.9 t -67.36 2.27 1.78 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.708 2.003 . . . . 3.29 113.951 177.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -68.96 -10.99 60.23 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.638 0.775 . . . . 4.79 112.639 167.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 145.38 13.08 0.22 Allowed Glycine 0 CA--C 1.528 0.889 0 CA-C-O 117.909 -1.495 . . . . 3.5699999999999998 116.709 169.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -124.49 -175.13 3.18 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.674 1.737 . . . . 4.71 113.282 -176.116 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 63.35 33.84 13.59 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-O 123.552 1.644 . . . . 2.3300000000000001 113.686 169.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.409 ' H ' ' HD2' ' A' ' 48' ' ' LYS . 2.7 mptt -59.77 151.75 24.61 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 113.359 -1.746 . . . . 5.0999999999999996 110.429 166.414 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.404 ' OE1' ' HE2' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -44.31 -44.12 7.9 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.941 1.46 . . . . 4.3799999999999999 114.941 -165.93 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.0 t -63.73 -15.57 58.89 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 115.061 1.504 . . . . 2.96 115.061 -178.294 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 43.4 m -90.02 -7.8 53.08 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.371 0.987 . . . . 2.1299999999999999 113.091 172.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 45.2 mt -88.25 -35.75 8.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 117.745 -1.122 . . . . 1.5700000000000001 113.326 -166.403 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.87 -25.75 64.78 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.427 1.467 . . . . 2.6699999999999999 113.197 -176.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.55 -44.09 71.61 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.899 0.772 . . . . 3.3999999999999999 111.169 164.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 tp -62.54 -43.49 98.68 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 118.611 -0.709 . . . . 2.1099999999999999 109.922 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.5 tpt -53.93 -53.96 45.49 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 125.914 1.686 . . . . 1.49 110.791 170.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.83 -35.67 64.19 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.008 1.323 . . . . 4.2699999999999996 113.147 176.094 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 61.3 m -86.69 -33.3 20.09 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 126.15 1.78 . . . . 1.99 111.964 -173.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.555 HD11 ' HB2' ' A' ' 75' ' ' PHE . 1.8 mm? -69.57 -42.78 74.07 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 126.776 2.03 . . . . 2.5 112.015 169.45 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -74.72 63.09 1.11 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 123.384 1.564 . . . . 1.51 110.77 -176.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -69.84 -4.95 22.5 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.83 1.252 . . . . 5.5099999999999998 113.427 -164.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -110.5 -5.69 15.08 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.85 2.46 . . . . 2.4900000000000002 113.785 171.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 37.7 t 58.69 64.55 1.41 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.074 1.35 . . . . 2.73 112.797 172.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -115.07 -88.97 0.56 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.384 1.473 . . . . 2.8100000000000001 108.67 176.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -173.19 -26.32 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.746 2.419 . . . . 6.1799999999999997 114.724 -176.076 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -124.78 163.22 22.6 Favored 'General case' 0 C--O 1.243 0.729 0 CA-C-O 123.249 1.5 . . . . 3.1000000000000001 111.944 175.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.6 mm -104.95 100.08 9.8 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.882 2.473 . . . . 1.03 110.401 -178.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -66.16 163.13 18.31 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.538 0.735 . . . . 3.7999999999999998 111.636 167.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -47.13 -42.32 19.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.603 0.761 . . . . 2.1000000000000001 112.882 -178.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 -30.39 67.03 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 120.895 -1.128 . . . . 7.7400000000000002 112.649 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -68.3 -54.36 18.02 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 107.855 -1.165 . . . . 1.96 107.855 171.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -51.2 -37.34 46.13 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.864 2.066 . . . . 2.5499999999999998 114.401 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.0 p -66.17 -14.89 62.6 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 120.307 -1.496 . . . . 1.6399999999999999 114.647 173.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 44.7 t -71.82 -33.02 46.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 CA-C-N 120.441 1.473 . . . . 2.1400000000000001 111.212 171.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.555 ' HB2' HD11 ' A' ' 59' ' ' LEU . 19.4 t80 -56.32 -54.72 42.09 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.466 1.03 . . . . 1.74 110.637 172.276 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 67.0 mt -64.07 -30.49 71.56 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.165 0.986 . . . . 1.8700000000000001 111.864 -178.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 15.3 m -68.13 -50.98 51.22 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.284 0.947 . . . . 0.87 111.942 170.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 65.3 mtp -51.87 -48.01 64.23 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.182 0.901 . . . . 1.8600000000000001 111.088 177.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 99.6 mt -65.45 -48.68 71.88 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.086 0.955 . . . . 1.22 112.599 176.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 34.6 t -64.84 -33.04 75.06 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.352 0.978 . . . . 1.8400000000000001 113.213 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 88.7 mtp -63.39 -46.59 85.73 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 118.687 0.676 . . . . 1.76 110.813 168.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.94 -42.94 97.18 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.626 0.602 . . . . 1.1100000000000001 112.626 -178.324 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -65.39 -25.71 67.68 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.574 -0.704 . . . . 2.7200000000000002 112.346 178.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -69.56 -37.21 76.94 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.103 0.865 . . . . 3.2200000000000002 112.351 173.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -70.65 -47.46 59.88 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.979 1.312 . . . . 2.8100000000000001 110.703 172.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -52.41 -47.42 66.32 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 126.09 1.756 . . . . 2.8999999999999999 110.98 177.408 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -53.53 -33.1 53.32 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.504 1.522 . . . . 2.5600000000000001 113.045 177.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 24.7 mt -81.86 -20.73 38.31 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.99 0.916 . . . . 1.5800000000000001 112.506 -177.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -96.5 -7.85 33.61 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.641 1.348 . . . . 2.9399999999999999 114.641 172.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -108.43 -53.37 2.64 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.89 2.076 . . . . 3.71 112.686 -174.081 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -81.68 55.84 2.82 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 123.222 1.487 . . . . 3.8900000000000001 110.844 174.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt . . . . . 0 C--O 1.251 1.17 0 C-N-CA 127.92 2.488 . . . . 4.2699999999999996 114.807 167.97 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 18.5 ttt . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 108.221 -1.029 . . . . 11.380000000000001 108.221 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -149.13 -12.84 0.31 Allowed 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 116.065 1.876 . . . . 4.7699999999999996 116.065 -153.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' THR . . . . . 0.4 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 1.2 p 66.51 -176.95 0.04 OUTLIER Pre-proline 0 N--CA 1.483 1.213 0 C-N-CA 125.314 1.446 . . . . 1.97 109.769 -173.561 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 4' ' ' PRO . . . . . 0.4 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 92.1 Cg_endo -81.8 -15.04 9.73 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 121.759 1.639 . . . . 1.8200000000000001 113.139 166.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.26 -39.31 68.49 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.604 1.093 . . . . 2.48 111.967 -174.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -50.69 -55.46 16.42 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.604 0.762 . . . . 5.1200000000000001 110.522 167.496 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 43.4 mttm -67.54 -19.23 65.26 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.221 -0.924 . . . . 3.7799999999999998 112.365 -176.004 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.59 -43.17 39.83 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.018 1.327 . . . . 0.87 111.891 171.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 56.7 mt -61.47 -44.62 96.78 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.177 1.391 . . . . 1.51 111.69 169.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 88.2 m -58.26 -48.99 78.7 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.542 1.537 . . . . 1.27 110.445 171.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 23.2 m -54.92 -49.96 70.0 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 119.539 1.063 . . . . 1.3 110.897 175.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 14.9 mmm -50.68 -51.46 49.18 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.684 1.194 . . . . 2.8300000000000001 112.623 174.007 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 4.0 t -59.31 -40.7 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.848 0.859 . . . . 1.78 112.34 175.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 87.9 m -72.28 -44.12 63.25 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.766 1.627 . . . . 0.90000000000000002 111.753 -173.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 19.2 p -67.74 -44.88 76.53 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 108.913 -0.773 . . . . 1.76 108.913 172.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -63.57 -53.65 48.41 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 123.597 0.561 . . . . 2.3599999999999999 110.518 -173.022 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -66.19 -30.01 70.4 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 112.506 0.558 . . . . 2.5899999999999999 112.506 -178.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 19.4 ttmm -70.91 -47.06 61.22 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 120.868 -1.145 . . . . 4.0999999999999996 112.117 176.004 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -73.18 -32.95 65.14 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.351 -0.843 . . . . 2.21 112.486 176.271 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 53.1 p -68.44 -29.02 67.58 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-N 119.666 1.121 . . . . 1.6299999999999999 113.012 176.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.35 -5.91 84.59 Favored Glycine 0 C--N 1.342 0.88 0 C-N-CA 127.625 2.536 . . . . 1.5 114.756 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -64.48 -41.68 96.33 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.896 1.848 . . . . 3.2799999999999998 111.392 175.198 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -147.93 156.02 42.22 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 123.252 1.501 . . . . 3.48 114.799 -173.484 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.43 -126.79 43.21 Favored Glycine 0 C--N 1.34 0.765 0 C-N-CA 127.156 2.313 . . . . 1.8500000000000001 111.123 171.059 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 2.3 m -54.53 116.31 2.6 Favored 'General case' 0 C--O 1.249 1.035 0 CA-C-O 121.207 0.527 . . . . 4.0899999999999999 109.736 162.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -18.81 60.65 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.445 0.906 . . . . 6.4500000000000002 113.445 -176.061 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.476 ' H ' HD23 ' B' ' 27' ' ' LEU . 2.0 pt? -91.27 -13.71 32.2 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.622 1.569 . . . . 4.2599999999999998 113.58 177.662 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -127.86 162.27 27.09 Favored 'General case' 0 C--O 1.249 1.042 0 N-CA-C 114.226 1.195 . . . . 1.54 114.226 -178.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 91.8 mt -107.16 108.51 20.0 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.89 2.476 . . . . 1.72 111.592 -178.055 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 95.9 p -70.72 163.37 27.31 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 121.26 -0.9 . . . . 2.1899999999999999 113.211 164.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -42.28 -38.16 1.72 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 125.642 1.577 . . . . 6.3499999999999996 114.545 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.63 -28.0 25.06 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 116.438 2.014 . . . . 4.0999999999999996 116.438 176.263 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -67.53 -48.64 66.41 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 120.103 1.32 . . . . 1.6699999999999999 109.221 166.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 24.6 tp -58.07 -42.95 86.63 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.679 1.191 . . . . 1.8300000000000001 111.827 177.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -51.37 -40.79 59.91 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.915 0.886 . . . . 3.5699999999999998 111.885 177.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -64.33 -51.98 60.7 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.948 0.499 . . . . 2.9700000000000002 110.364 177.27 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 29.6 tp -57.65 -55.24 37.35 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 117.067 -1.444 . . . . 2.25 111.0 -178.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 30.7 mt -54.46 -51.44 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-N 120.201 1.364 . . . . 0.98999999999999999 110.469 178.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 44.1 tttm -65.89 -18.53 65.4 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.755 1.02 . . . . 4.4299999999999997 113.755 -176.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm -85.78 -59.75 2.22 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.752 1.621 . . . . 3.1600000000000001 110.609 168.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 72.3 tt0 -43.54 -62.52 1.06 Allowed 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 130.97 3.708 . . . . 5.1600000000000001 112.846 -177.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -82.22 -37.65 25.69 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.296 1.038 . . . . 3.4300000000000002 111.939 178.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 8.2 t 70.33 -44.44 0.57 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 127.691 2.396 . . . . 3.2400000000000002 114.998 175.106 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -63.31 -4.24 2.46 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 117.351 2.352 . . . . 3.2799999999999998 117.351 -167.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.48 16.55 77.71 Favored Glycine 0 N--CA 1.474 1.215 0 O-C-N 120.812 -1.18 . . . . 3.9300000000000002 115.105 173.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -46.05 -71.36 0.08 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 127.45 2.3 . . . . 7.9800000000000004 112.204 176.062 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.84 125.46 26.89 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.944 0.878 . . . . 2.7799999999999998 111.431 173.421 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -87.18 173.88 8.96 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.836 -0.54 . . . . 3.5 109.809 166.388 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.01 -37.5 74.41 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 115.062 1.504 . . . . 3.4700000000000002 115.062 -169.37 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 13.1 t -72.59 -11.15 60.53 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 114.148 1.166 . . . . 2.7400000000000002 114.148 172.258 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 1.7 m -94.17 -31.68 14.04 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.992 1.717 . . . . 2.8700000000000001 111.544 172.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 86.6 mt -65.99 -32.96 60.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.293 0.637 . . . . 1.76 110.718 170.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.0 -66.12 0.56 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.232 1.013 . . . . 3.0800000000000001 111.207 176.575 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.61 -24.64 62.78 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 113.885 1.068 . . . . 3.9199999999999999 113.885 -173.25 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.77 -52.96 63.46 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.52 0.728 . . . . 2.21 109.992 164.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -60.89 -49.47 77.34 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.377 1.071 . . . . 1.6499999999999999 111.922 -179.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 24.8 mtpt -57.16 -36.22 70.5 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.44 1.096 . . . . 5.1200000000000001 113.011 173.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 52.1 m -75.07 -30.64 61.02 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 120.956 -1.09 . . . . 2.6400000000000001 113.479 177.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 mp -65.34 -52.8 51.41 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 118.031 -0.985 . . . . 2.8799999999999999 110.504 167.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -73.93 74.91 1.66 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.322 2.249 . . . . 1.45 114.343 -169.192 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 61' ' ' LYS . . . . . 0.496 ' HZ3' HG11 ' B' ' 74' ' ' VAL . 14.8 mptt -53.96 -27.57 32.12 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 115.113 1.523 . . . . 3.4700000000000002 115.113 -176.542 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -88.25 -15.28 36.29 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.723 1.209 . . . . 1.8799999999999999 113.379 177.529 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 29.4 t 58.17 32.05 21.54 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.473 1.109 . . . . 2.1600000000000001 112.552 -176.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -84.47 -0.24 52.19 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.378 1.471 . . . . 2.3500000000000001 112.02 -175.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 82.3 -0.96 1.42 Allowed 'General case' 0 C--O 1.238 0.477 0 C-N-CA 130.36 3.464 . . . . 4.4800000000000004 113.204 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -126.38 135.21 51.16 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 123.045 1.403 . . . . 2.27 113.106 178.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 21.3 mm -74.58 100.0 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-N 115.016 -0.993 . . . . 1.49 109.232 170.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.35 158.31 31.91 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.293 1.037 . . . . 4.9900000000000002 109.846 169.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.57 -35.17 53.36 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 120.517 -1.364 . . . . 2.8599999999999999 113.496 175.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.451 ' HD3' ' H ' ' B' ' 70' ' ' LYS . 1.0 OUTLIER -67.18 -25.96 66.4 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.862 0.865 . . . . 5.2599999999999998 112.48 177.45 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -88.03 -40.74 13.6 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.246 1.418 . . . . 2.2799999999999998 110.35 174.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -54.78 -23.67 19.05 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 120.39 -1.444 . . . . 2.1000000000000001 113.059 173.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 36.1 t -65.8 -30.61 71.28 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.518 1.527 . . . . 2.3300000000000001 112.989 174.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.496 HG11 ' HZ3' ' B' ' 61' ' ' LYS . 0.9 OUTLIER -86.85 -28.57 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.714 0.805 . . . . 2.48 111.544 -176.974 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -58.93 -67.03 0.41 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.945 1.298 . . . . 1.6100000000000001 111.396 179.451 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -59.92 -36.77 77.71 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.452 1.101 . . . . 3.71 112.0 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 31.5 m -51.19 -54.35 26.33 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.664 0.786 . . . . 0.97999999999999998 110.492 173.461 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.4 mtm -58.68 -46.11 87.94 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 118.544 0.611 . . . . 1.5900000000000001 111.593 179.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.08 -45.54 94.32 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.147 0.579 . . . . 1.48 112.436 178.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.4 t -72.68 -29.41 63.38 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.328 -0.857 . . . . 2.0800000000000001 113.1 -178.106 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 91.5 mtp -69.9 -39.45 76.2 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 118.79 -0.624 . . . . 2.0499999999999998 110.948 170.533 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.65 -36.16 81.93 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.493 1.042 . . . . 0.85999999999999999 112.524 173.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -68.26 -35.43 77.89 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.083 1.142 . . . . 2.5699999999999998 114.083 170.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 17.1 t30 -64.72 -42.38 95.28 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.521 1.055 . . . . 1.74 112.607 171.318 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -73.43 -24.7 60.28 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.11 0.964 . . . . 4.0199999999999996 111.186 -177.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -55.98 26.53 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.492 1.517 . . . . 2.7400000000000002 112.104 160.471 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -57.46 -26.62 61.51 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.862 1.665 . . . . 2.3100000000000001 112.3 -179.139 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 55.0 mt -77.05 -7.89 56.48 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.728 1.381 . . . . 2.4399999999999999 114.728 174.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -94.78 -29.78 14.58 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 113.86 1.059 . . . . 4.4699999999999998 113.86 162.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -74.6 -46.91 35.49 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.956 1.302 . . . . 3.6099999999999999 112.464 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -136.77 41.36 2.52 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 127.723 2.409 . . . . 4.4500000000000002 110.874 -165.085 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 36.8 mttm . . . . . 0 C--O 1.253 1.239 0 C-N-CA 130.386 3.475 . . . . 8.5500000000000007 117.047 -175.607 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 109.585 -0.524 . . . . 8.5199999999999996 109.585 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -92.23 -80.04 0.37 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.148 0.499 . . . . 3.4199999999999999 111.421 -144.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 67.3 p -110.49 165.2 13.14 Favored Pre-proline 0 N--CA 1.472 0.645 0 C-N-CA 126.474 1.909 . . . . 1.4299999999999999 110.652 -168.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -69.62 -23.09 31.81 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 121.118 1.212 . . . . 1.4199999999999999 112.26 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.34 -40.39 44.28 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.7 1.137 . . . . 2.7000000000000002 113.63 173.696 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -64.75 -34.44 78.33 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.114 1.325 . . . . 4.0599999999999996 110.625 172.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 59.1 mttt -68.21 -29.02 67.76 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 120.051 -1.656 . . . . 4.5199999999999996 112.255 170.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.13 -50.79 29.76 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.273 1.029 . . . . 1.1000000000000001 111.204 174.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.2 mt -55.9 -43.56 77.41 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.745 1.218 . . . . 1.6899999999999999 111.87 174.084 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 85.4 m -53.49 -54.71 33.16 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.342 1.057 . . . . 1.77 111.366 168.537 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.3 m -58.55 -37.24 75.28 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.489 1.115 . . . . 1.3100000000000001 111.924 -179.216 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 60.0 mtp -61.91 -52.54 63.67 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.032 0.933 . . . . 3.25 111.113 174.427 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 19.2 m -67.77 -28.25 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 CA-C-N 119.803 1.183 . . . . 2.27 113.299 177.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 57.2 m -58.64 -55.85 29.73 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.891 1.276 . . . . 0.91000000000000003 110.851 174.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -74.53 -34.45 63.01 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 119.304 -0.379 . . . . 2.54 110.275 -176.543 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.426 ' CZ ' HD23 ' A' ' 29' ' ' LEU . 21.2 t80 -61.66 -51.59 67.8 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 118.397 -0.811 . . . . 1.8200000000000001 110.999 176.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -66.29 -39.25 89.25 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 120.307 1.412 . . . . 2.5899999999999999 112.23 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -53.71 52.65 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.756 1.222 . . . . 4.9299999999999997 113.097 176.119 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -74.13 -32.2 63.07 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.358 -0.839 . . . . 2.46 112.091 176.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.5 t -58.79 -38.6 78.91 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 120.429 1.468 . . . . 2.1699999999999999 114.145 178.294 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.55 -6.17 83.74 Favored Glycine 0 CA--C 1.528 0.85 0 CA-C-O 117.958 -1.468 . . . . 1.96 115.184 -171.107 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -69.0 -41.56 77.63 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.239 1.519 . . . . 6.79 112.616 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -149.98 143.49 25.24 Favored 'General case' 0 C--O 1.247 0.93 0 C-N-CA 124.217 1.007 . . . . 4.6100000000000003 110.551 -154.14 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.39 -131.8 34.4 Favored Glycine 0 C--N 1.337 0.592 0 CA-C-N 114.522 -1.217 . . . . 1.99 110.973 -178.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.9 m -65.4 155.02 36.72 Favored 'General case' 0 C--O 1.247 0.973 0 C-N-CA 123.896 0.878 . . . . 2.79 112.995 170.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -112.86 10.73 19.1 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 115.037 1.495 . . . . 4.6100000000000003 115.037 170.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.8 mp -93.11 -1.66 56.22 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.339 1.056 . . . . 4.3799999999999999 111.485 167.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -159.7 148.29 17.56 Favored 'General case' 0 C--O 1.247 0.972 0 C-N-CA 126.841 2.056 . . . . 1.8 110.915 -157.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.426 HD23 ' CZ ' ' A' ' 16' ' ' PHE . 3.1 mm? -96.21 103.14 15.02 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 113.859 -1.518 . . . . 2.79 108.354 175.109 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.3 p -70.95 155.93 40.23 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.854 -1.066 . . . . 2.7599999999999998 110.348 171.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.1 ttm-85 -40.56 -50.9 2.98 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.665 1.186 . . . . 3.8399999999999999 113.897 -169.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -74.16 -30.33 62.21 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 115.39 1.626 . . . . 5.96 115.39 -175.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -58.12 -44.93 88.02 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.165 0.586 . . . . 1.96 111.227 166.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.73 -46.48 65.81 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.246 1.018 . . . . 2.9900000000000002 110.854 -175.667 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.1 ttmt -60.31 -44.29 95.56 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.43 -1.419 . . . . 4.1100000000000003 112.702 177.097 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.12 -43.2 87.09 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 114.026 1.121 . . . . 5.1799999999999997 114.026 168.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.9 tp -62.01 -54.01 47.57 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.4 1.08 . . . . 2.1899999999999999 111.149 179.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.7 mt -56.51 -44.52 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 CA-C-N 118.893 0.77 . . . . 0.90000000000000002 109.962 175.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -67.96 -18.98 64.91 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 114.149 1.166 . . . . 3.9300000000000002 114.149 -176.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -91.81 -40.48 11.19 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.57 1.548 . . . . 3.0699999999999998 112.498 -179.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -81.29 -26.38 35.77 Favored 'General case' 0 CA--C 1.552 1.041 0 O-C-N 124.413 1.071 . . . . 4.6600000000000001 111.815 176.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.0 mt -133.62 131.74 39.96 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 123.277 1.513 . . . . 2.71 113.442 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 4.3 t -149.15 7.51 0.71 Allowed 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.508 1.67 . . . . 4.4800000000000004 115.508 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -87.43 170.35 11.45 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.327 1.051 . . . . 3.3799999999999999 111.556 170.009 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.55 -131.08 26.44 Favored Glycine 0 N--CA 1.472 1.079 0 N-CA-C 109.977 -1.249 . . . . 3.73 109.977 -172.102 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -119.89 86.28 2.53 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.666 0.746 . . . . 7.29 109.137 148.493 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.0 tpt -74.65 78.47 2.02 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 120.51 -1.369 . . . . 2.1400000000000001 109.287 169.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.9 tttm -89.44 151.37 22.05 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.799 1.407 . . . . 6.0899999999999999 114.799 -157.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.3 -40.31 81.64 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.589 0.959 . . . . 4.5199999999999996 113.589 174.728 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.7 t -83.84 -41.76 17.15 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.134 0.974 . . . . 2.77 113.458 174.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.9 m -61.92 -24.82 67.21 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.492 1.117 . . . . 2.8799999999999999 112.442 177.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 65.8 mt -69.51 -28.13 36.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 124.265 1.026 . . . . 1.29 113.111 167.654 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.92 -30.19 68.61 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.958 1.708 . . . . 2.7799999999999998 112.123 -176.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -79.68 -35.77 38.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.747 0.819 . . . . 3.1699999999999999 112.401 168.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.9 tp -59.63 -32.42 70.42 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.559 -0.713 . . . . 2.02 111.236 170.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 6.0 tpt -55.16 -46.78 75.75 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.292 1.437 . . . . 1.8700000000000001 111.517 173.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -65.87 -29.28 69.71 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.799 1.24 . . . . 3.1899999999999999 112.524 171.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.9 t -75.35 -31.29 60.49 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.041 0.936 . . . . 2.1400000000000001 112.794 177.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.0 mp -71.38 -55.55 7.75 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.39 1.076 . . . . 2.7999999999999998 111.348 167.103 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -70.78 148.5 47.84 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 113.07 0.767 . . . . 2.1200000000000001 113.07 -168.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm -125.44 7.54 7.69 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.758 1.223 . . . . 3.3700000000000001 113.0 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 18.8 m-20 -122.17 -21.19 5.98 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.587 1.155 . . . . 2.5699999999999998 112.995 176.368 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 7.8 t 74.35 20.89 2.49 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.408 2.283 . . . . 2.2200000000000002 112.584 -171.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 p30 -83.4 -23.75 32.24 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.928 2.091 . . . . 1.97 112.287 -163.202 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 73.59 19.23 3.35 Favored 'General case' 0 CA--C 1.548 0.874 1 C-N-CA 132.1 4.16 . . . . 3.8399999999999999 113.736 -172.804 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -121.85 122.57 39.74 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 128.719 2.808 . . . . 3.71 109.211 169.515 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 18.2 mm -91.47 107.75 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 O-C-N 120.652 -1.28 . . . . 1.1100000000000001 110.441 175.026 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 59.1 t0 -74.85 151.81 38.98 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 127.07 2.148 . . . . 2.7599999999999998 109.66 164.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -46.33 -43.61 16.11 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 115.299 1.592 . . . . 2.25 115.299 -177.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.458 ' H ' ' HD2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -69.98 -21.59 63.22 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 113.831 1.048 . . . . 3.0299999999999998 113.831 178.673 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -74.03 -53.36 10.19 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.718 1.207 . . . . 1.6699999999999999 108.634 165.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -52.9 -30.04 31.89 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 120.304 -1.497 . . . . 2.23 114.401 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 33.1 t -40.76 -45.1 2.36 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.125 1.77 . . . . 3.21 113.284 165.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.3 m -75.05 -27.99 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 CA-C-N 118.925 0.784 . . . . 2.3399999999999999 112.419 -172.381 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -59.25 -58.23 9.53 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 118.724 0.693 . . . . 1.79 110.499 168.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 38.3 mt -65.42 -29.61 70.33 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.517 0.727 . . . . 1.5600000000000001 111.902 -177.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.0 m -65.91 -46.64 77.53 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.331 1.052 . . . . 0.94999999999999996 111.196 174.079 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 59.0 mtm -61.45 -47.79 84.09 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.668 1.122 . . . . 1.5600000000000001 112.116 177.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 96.7 mt -62.21 -44.85 95.65 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.737 0.815 . . . . 1.29 112.002 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 16.3 t -66.49 -35.2 79.68 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 113.012 0.745 . . . . 1.78 113.012 175.018 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.1 -41.3 96.41 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.009 0.744 . . . . 3.1400000000000001 113.009 174.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.54 -38.1 86.41 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 118.53 -0.748 . . . . 1.26 111.468 174.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -63.05 -28.17 69.91 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 120.011 1.278 . . . . 2.73 114.059 176.125 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -60.55 -52.04 66.85 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.869 1.213 . . . . 2.1699999999999999 110.919 170.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -73.11 -30.42 63.62 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.063 1.345 . . . . 3.3900000000000001 112.107 -175.136 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.77 -54.03 51.1 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.7 1.6 . . . . 3.3599999999999999 110.132 168.192 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -55.76 -38.12 69.43 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.29 1.436 . . . . 2.54 112.489 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 85.5 mt -70.66 -16.07 62.78 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.879 1.066 . . . . 1.8600000000000001 113.879 177.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -109.89 2.52 19.88 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.156 1.782 . . . . 3.25 113.621 175.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -118.36 -55.25 2.24 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 126.539 1.936 . . . . 2.9900000000000002 112.311 -174.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -82.49 37.52 0.52 Allowed 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.531 1.533 . . . . 4.0099999999999998 112.422 175.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.9 ptmt . . . . . 0 C--O 1.249 1.042 0 C-N-CA 128.43 2.692 . . . . 4.4199999999999999 115.898 -172.679 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 34.4 mmt . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 107.705 -1.22 . . . . 6.4100000000000001 107.705 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -105.01 -51.85 2.96 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 125.132 1.52 . . . . 5.1799999999999997 112.398 -148.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 3' ' ' THR . . . . . 0.5 HG23 ' H ' ' B' ' 6' ' ' GLU . 3.9 t -173.53 154.79 2.52 Favored Pre-proline 0 N--CA 1.472 0.631 0 C-N-CA 124.912 1.285 . . . . 2.73 110.727 -166.042 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -65.77 -24.52 54.38 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 122.079 1.853 . . . . 1.49 113.065 164.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 14.0 tp -65.69 -63.48 1.08 Allowed 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 121.135 1.788 . . . . 2.7200000000000002 111.451 -176.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 6' ' ' GLU . . . . . 0.5 ' H ' HG23 ' B' ' 3' ' ' THR . 14.2 tp10 -57.99 -37.85 75.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.234 1.016 . . . . 5.3200000000000003 110.646 178.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 7' ' ' LYS . . . . . 0.445 ' HA ' ' HE2' ' B' ' 7' ' ' LYS . 0.2 OUTLIER -63.92 -31.53 72.75 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 120.361 -1.462 . . . . 5.21 112.997 174.994 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -79.38 -27.74 41.9 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.58 1.152 . . . . 1.22 112.862 178.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 56.8 mt -60.31 -32.55 71.33 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 120.864 -1.148 . . . . 1.8600000000000001 111.799 168.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.7 m -60.35 -40.57 91.2 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.074 -1.016 . . . . 1.78 111.722 167.701 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 5.9 m -57.74 -38.82 76.01 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.175 0.898 . . . . 1.45 111.261 177.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 13.7 ttm -59.53 -37.42 78.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.447 0.906 . . . . 3.1099999999999999 113.447 173.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -75.06 -27.26 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 CA-C-N 119.911 1.232 . . . . 2.3399999999999999 112.092 172.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 85.5 m -71.94 -46.75 56.41 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.708 1.603 . . . . 0.84999999999999998 110.24 -171.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 38.1 p -69.9 -39.12 76.42 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 123.538 0.735 . . . . 1.76 109.68 170.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -62.37 -53.63 52.14 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-O 118.455 -0.783 . . . . 2.29 111.966 -175.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -19.44 62.62 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 120.269 1.395 . . . . 2.98 112.328 -178.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -72.63 -49.36 32.43 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.698 -1.251 . . . . 4.5 112.519 168.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -74.54 -39.6 62.24 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.688 -1.258 . . . . 2.2799999999999998 112.886 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 18.2 m -55.96 -42.0 75.58 Favored 'General case' 0 C--O 1.245 0.831 0 C-N-CA 124.299 1.04 . . . . 1.76 112.337 166.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.94 -9.03 86.86 Favored Glycine 0 C--N 1.343 0.928 0 C-N-CA 127.237 2.351 . . . . 1.3400000000000001 113.999 -176.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -56.75 -67.52 0.3 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.184 1.794 . . . . 3.7799999999999998 109.373 174.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -138.01 168.61 19.36 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 124.167 0.987 . . . . 3.5699999999999998 113.025 -168.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.2 -132.18 48.84 Favored Glycine 0 C--N 1.341 0.839 0 C-N-CA 125.785 1.66 . . . . 2.0899999999999999 111.816 176.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -50.51 121.78 6.21 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.176 0.991 . . . . 3.96 110.227 158.391 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -85.17 -16.22 41.12 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 120.657 -1.277 . . . . 7.9000000000000004 114.411 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 60.8 tp -72.72 -36.62 67.83 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.504 1.121 . . . . 2.7400000000000002 112.226 168.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 3.2 p -119.23 166.5 12.91 Favored 'General case' 0 C--O 1.252 1.236 0 C-N-CA 126.283 1.833 . . . . 1.29 114.553 -172.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.81 129.46 47.04 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 113.663 -1.608 . . . . 2.25 113.83 176.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.64 175.51 5.47 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.712 1.605 . . . . 2.2599999999999998 110.698 175.723 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 31' ' ' ARG . . . . . 0.486 HH11 ' HG2' ' B' ' 31' ' ' ARG . 14.9 ttt-85 -44.77 -33.04 1.74 Allowed 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 116.738 2.125 . . . . 5.4500000000000002 116.738 -170.084 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -79.99 -36.49 35.92 Favored 'General case' 0 CA--C 1.549 0.931 0 O-C-N 120.337 -1.477 . . . . 4.0099999999999998 114.076 176.236 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -70.27 -48.2 57.85 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 108.831 -0.803 . . . . 1.8400000000000001 108.831 173.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.43 HD11 ' CG1' ' B' ' 67' ' ' ILE . 15.7 mt -52.09 -45.88 65.0 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.714 1.605 . . . . 3.1499999999999999 113.498 175.406 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -52.77 -41.95 64.54 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.373 0.533 . . . . 3.0 111.518 178.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -71.91 -38.75 69.86 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.498 0.925 . . . . 3.2400000000000002 113.498 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 7.2 tt -57.13 -59.6 4.85 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.473 0.709 . . . . 1.9199999999999999 109.876 173.517 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 41.8 mt -54.84 -54.57 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.957 0.903 . . . . 1.03 109.974 -172.077 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -72.61 -22.64 60.93 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 118.507 -1.277 . . . . 6.4000000000000004 114.135 -171.465 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -83.31 -34.89 25.61 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 117.457 -1.258 . . . . 4.4000000000000004 113.531 173.699 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 80.7 mt-10 -72.43 -58.12 3.64 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.736 1.153 . . . . 3.7400000000000002 111.143 172.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mp -91.97 91.47 7.87 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.72 -0.844 . . . . 3.4399999999999999 108.72 175.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 89.0 m -55.75 -37.61 68.74 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 121.599 -0.688 . . . . 3.46 112.526 174.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.46 -156.93 0.29 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 127.492 2.317 . . . . 3.6400000000000001 114.354 -171.358 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.11 162.07 33.57 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.186 1.85 . . . . 3.8199999999999998 113.547 177.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -79.47 43.81 0.57 Allowed 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 122.498 1.142 . . . . 6.2000000000000002 109.995 165.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 4.2 tpt -80.49 65.55 5.68 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.519 1.527 . . . . 2.04 112.533 -157.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -71.16 164.79 24.93 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.089 1.755 . . . . 3.8500000000000001 111.646 175.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -45.15 -53.53 7.97 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.789 1.636 . . . . 4.7599999999999998 112.581 175.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -66.32 -29.3 69.47 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.2 -0.938 . . . . 2.6499999999999999 113.104 -178.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 24.4 t -76.66 -18.06 58.78 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 118.089 -0.958 . . . . 2.5600000000000001 112.201 175.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 81.2 mt -86.39 -36.5 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 126.451 1.9 . . . . 1.3799999999999999 109.834 173.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -59.01 -58.4 8.82 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.704 2.002 . . . . 4.1399999999999997 111.248 168.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -67.63 -26.42 66.23 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.305 0.957 . . . . 2.9199999999999999 113.58 176.456 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.19 -56.59 19.66 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.209 0.913 . . . . 2.5299999999999998 110.282 165.278 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -69.26 -29.57 67.5 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 117.75 -1.119 . . . . 2.23 112.108 -172.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 18.5 mtpt -64.48 -36.64 84.84 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 120.397 1.453 . . . . 3.7400000000000002 113.076 164.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 22.7 t -69.18 -31.76 70.6 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.868 -1.145 . . . . 2.8599999999999999 112.599 175.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 59' ' ' LEU . . . . . 0.462 ' HB3' HD12 ' B' ' 67' ' ' ILE . 10.4 mp -69.93 -55.62 9.19 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 120.666 -1.271 . . . . 2.75 110.79 167.061 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -79.21 61.59 3.36 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 129.029 2.932 . . . . 1.3600000000000001 113.079 -173.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 22.8 mttp -54.85 -18.75 5.25 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 115.117 1.525 . . . . 3.25 115.117 -172.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -105.79 -3.57 21.86 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.003 1.721 . . . . 2.3700000000000001 115.106 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 15.0 t 68.79 25.36 6.3 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 114.678 1.362 . . . . 2.0800000000000001 114.678 177.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 13.6 p30 -78.27 -14.31 59.48 Favored 'General case' 0 CA--C 1.552 1.022 0 O-C-N 120.682 -1.261 . . . . 2.2999999999999998 112.001 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 75.79 -6.13 2.04 Favored 'General case' 0 CA--C 1.543 0.705 1 C-N-CA 133.243 4.617 . . . . 4.6500000000000004 115.052 177.395 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -97.43 152.86 18.53 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 127.347 2.259 . . . . 2.73 109.304 169.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 67' ' ' ILE . . . . . 0.462 HD12 ' HB3' ' B' ' 59' ' ' LEU . 29.6 mm -115.22 97.07 5.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-O 122.322 1.058 . . . . 1.8899999999999999 109.816 171.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.92 153.4 43.63 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.297 1.839 . . . . 2.8300000000000001 110.771 159.433 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.97 -33.91 39.97 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.298 1.222 . . . . 2.4900000000000002 114.298 -174.312 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -25.83 61.77 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.778 -1.202 . . . . 3.6099999999999999 112.09 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -78.87 -47.58 16.26 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.892 1.277 . . . . 1.6799999999999999 109.342 169.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -52.92 -48.53 67.21 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 127.61 2.364 . . . . 2.8999999999999999 114.228 -174.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 97.2 p -61.17 -25.64 67.16 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.236 -0.915 . . . . 1.71 113.149 -172.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 37.3 t -65.56 -21.74 29.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 123.784 0.834 . . . . 2.4300000000000002 111.964 178.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -57.48 -58.44 8.28 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.487 1.115 . . . . 2.7000000000000002 111.595 168.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 76' ' ' LEU . . . . . 0.4 HD22 ' H ' ' B' ' 76' ' ' LEU . 2.9 mm? -61.62 -40.6 95.41 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.788 0.835 . . . . 3.3599999999999999 111.037 179.054 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 52.3 m -53.39 -52.55 58.96 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 118.191 -0.909 . . . . 1.52 112.358 172.483 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 74.6 mtm -57.74 -49.94 74.9 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 119.808 1.186 . . . . 1.8300000000000001 112.452 177.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 84.5 mt -62.49 -37.93 87.88 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.724 0.41 . . . . 1.5 111.598 -179.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 8.5 t -69.22 -31.64 70.36 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.02 0.928 . . . . 1.96 112.921 175.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 67.3 mtp -61.46 -46.43 90.09 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 119.029 0.831 . . . . 1.9199999999999999 110.73 167.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.31 -45.63 90.42 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 118.728 0.695 . . . . 0.73999999999999999 112.836 177.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -59.12 -27.03 65.23 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.651 -0.656 . . . . 2.4199999999999999 112.759 176.219 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -72.86 -35.55 67.21 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.337 1.426 . . . . 2.0 112.685 176.341 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.79 -39.89 72.89 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.81 0.844 . . . . 2.8399999999999999 110.261 175.127 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.56 -50.87 68.9 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.167 1.387 . . . . 2.0299999999999998 110.812 170.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -58.04 -29.85 65.69 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.175 1.39 . . . . 2.3700000000000001 113.123 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 24.8 mt -73.65 -24.44 60.0 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.324 1.05 . . . . 2.0699999999999998 113.547 177.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -97.74 -32.48 11.72 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 114.388 1.255 . . . . 4.1699999999999999 114.388 175.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -74.33 -27.42 60.69 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.365 1.466 . . . . 4.2800000000000002 113.568 -170.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -88.13 -1.85 58.25 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.898 0.879 . . . . 4.8799999999999999 112.853 176.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.042 0 C-N-CA 126.277 1.831 . . . . 6.1100000000000003 114.25 -159.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.6 mtt . . . . . 0 N--CA 1.479 1.017 0 CA-C-O 117.67 -1.157 . . . . 6.54 110.073 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.4 mp0 56.4 -141.1 0.83 Allowed 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.279 1.832 . . . . 3.2200000000000002 109.145 177.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.4 p -118.27 163.99 22.41 Favored Pre-proline 0 C--O 1.238 0.481 0 C-N-CA 125.059 1.344 . . . . 2.21 108.954 172.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -64.38 -12.75 34.59 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 121.985 1.79 . . . . 1.8799999999999999 113.516 175.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.8 tt -79.7 -35.09 39.53 Favored 'General case' 0 C--N 1.347 0.492 0 CA-C-N 120.238 1.381 . . . . 3.1899999999999999 112.512 170.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -52.69 52.68 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.339 1.427 . . . . 3.8599999999999999 108.7 167.18 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.521 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -57.5 -26.14 60.86 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 113.096 0.776 . . . . 4.2000000000000002 113.096 -179.137 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.64 -53.62 44.68 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-O 118.335 -0.841 . . . . 1.29 111.844 168.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 47.5 mt -54.45 -48.36 71.82 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 120.041 1.292 . . . . 1.71 111.597 177.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.7 p -67.52 -36.31 80.79 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 117.636 -1.174 . . . . 2.8500000000000001 113.289 177.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.42 -29.12 66.77 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 121.149 1.795 . . . . 2.1299999999999999 112.078 170.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.96 -55.97 18.58 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.378 1.071 . . . . 3.77 110.815 -178.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.7 m -62.56 -25.13 37.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 113.021 0.749 . . . . 2.2799999999999998 113.021 177.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.1 m -70.17 -49.22 52.63 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.697 1.599 . . . . 1.3899999999999999 112.512 175.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -48.13 81.22 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.054 0.843 . . . . 2.25 109.68 167.274 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -62.85 -50.96 68.9 Favored 'General case' 0 N--CA 1.465 0.319 0 O-C-N 124.222 0.951 . . . . 2.5299999999999998 111.1 -166.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 24.0 m170 -68.21 -34.81 76.95 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 118.394 -0.812 . . . . 2.79 112.42 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -70.81 -43.02 69.49 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 120.056 1.298 . . . . 4.4800000000000004 113.315 177.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -70.53 -23.16 62.58 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.312 0.96 . . . . 2.0800000000000001 112.045 170.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.0 p -69.88 -36.67 75.66 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.326 -1.484 . . . . 2.7000000000000002 111.181 169.502 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.47 -15.37 75.17 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 125.871 1.7 . . . . 1.6000000000000001 113.516 175.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -64.11 92.94 0.08 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 106.999 -1.482 . . . . 4.6699999999999999 106.999 157.256 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 60.63 178.08 0.1 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.764 2.026 . . . . 6.7800000000000002 115.635 169.28 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.36 -140.3 44.79 Favored Glycine 0 C--N 1.343 0.938 0 C-N-CA 126.294 1.902 . . . . 2.21 112.522 166.494 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.5 t -54.14 132.38 42.92 Favored 'General case' 0 C--O 1.241 0.613 0 O-C-N 121.817 -0.813 . . . . 2.7200000000000002 110.343 156.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.5 ptmm? -86.31 16.79 4.14 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.063 0.945 . . . . 4.0999999999999996 113.546 171.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.2 mt -128.85 -39.6 1.59 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.561 1.144 . . . . 4.3099999999999996 111.475 178.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 12.5 p -101.0 162.33 12.96 Favored 'General case' 0 C--O 1.248 0.995 0 C-N-CA 124.996 1.318 . . . . 1.3700000000000001 111.508 174.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 92.6 mt -90.48 98.17 11.62 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 112.304 -2.225 . . . . 1.72 109.127 172.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.2 t -63.0 166.15 6.11 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 121.59 0.709 . . . . 1.8300000000000001 112.242 170.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.65 -40.61 1.99 Allowed 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 127.008 2.123 . . . . 3.6400000000000001 115.419 -175.547 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -79.71 -36.87 36.82 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.06 1.133 . . . . 6.3899999999999997 114.06 176.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -66.09 -47.72 73.29 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.533 1.533 . . . . 1.54 109.615 -175.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 38.1 tp -53.93 -50.41 66.48 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.569 1.148 . . . . 1.8400000000000001 111.049 175.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -57.46 -44.74 85.04 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 112.958 0.725 . . . . 3.46 112.958 176.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -58.31 -38.8 77.81 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 119.264 0.938 . . . . 3.77 112.488 174.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.7 -57.84 5.08 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.482 1.113 . . . . 2.6600000000000001 110.734 177.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.6 mt -58.27 -49.37 82.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 118.517 0.599 . . . . 0.79000000000000004 110.107 -175.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.62 -8.18 53.99 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 120.818 -1.176 . . . . 4.6699999999999999 111.874 -173.181 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -95.42 -39.03 10.21 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.998 1.319 . . . . 3.3599999999999999 113.455 166.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -72.72 -64.94 0.86 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.761 1.225 . . . . 4.5300000000000002 109.637 177.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -82.33 72.99 9.39 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 123.177 1.465 . . . . 2.3300000000000001 107.399 165.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.9 t -65.58 7.56 0.23 Allowed 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 114.877 1.436 . . . . 2.9900000000000002 114.877 178.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -49.71 157.19 0.59 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 129.452 3.101 . . . . 4.4299999999999997 114.322 -177.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -83.1 -19.64 62.43 Favored Glycine 0 N--CA 1.474 1.222 0 C-N-CA 124.313 0.959 . . . . 3.5499999999999998 112.165 168.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -69.47 -29.45 67.12 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 128.806 2.842 . . . . 5.5 111.34 170.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.7 85.35 2.72 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.578 1.551 . . . . 2.2799999999999998 110.943 173.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.6 mmtp -111.53 170.71 7.94 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.728 2.411 . . . . 4.21 110.081 176.037 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -57.01 -42.11 79.73 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.637 -0.664 . . . . 4.3600000000000003 112.477 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -70.92 -4.2 23.31 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.824 1.416 . . . . 3.3500000000000001 114.824 173.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.4 m -101.56 -39.07 7.67 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.586 1.154 . . . . 2.1299999999999999 110.715 172.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 34.8 mm -71.3 -36.24 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 125.213 1.405 . . . . 2.04 112.242 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -66.55 -33.92 76.76 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.82 1.044 . . . . 4.04 113.82 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -83.57 -34.2 25.24 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 113.201 0.815 . . . . 2.8799999999999999 113.201 176.011 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.9 tt -54.51 -50.96 66.6 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.816 0.846 . . . . 2.23 109.313 169.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.2 ttt -60.34 -40.42 90.62 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.254 1.022 . . . . 1.4399999999999999 113.009 172.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.2 ttmm -58.74 -35.25 72.41 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.206 1.002 . . . . 4.4000000000000004 112.553 176.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 68.1 m -80.44 -23.2 40.45 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.529 1.931 . . . . 1.8600000000000001 113.442 177.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.2 mt -73.66 -54.03 9.05 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.018 -1.051 . . . . 1.8600000000000001 113.5 176.35 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -88.03 143.96 26.79 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.562 1.074 . . . . 1.9299999999999999 113.843 -167.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -115.83 7.08 14.45 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 125.252 1.421 . . . . 2.8500000000000001 113.424 -177.405 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -118.8 -23.44 6.99 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.95 1.3 . . . . 2.8700000000000001 114.224 -170.302 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 54.3 m 58.77 39.55 24.05 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.448 2.299 . . . . 2.8799999999999999 112.577 -157.402 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.6 p30 -87.73 -26.02 23.14 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.018 1.327 . . . . 2.75 112.93 -173.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 75.35 4.4 4.09 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 130.693 3.597 . . . . 3.73 114.346 -170.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -116.38 121.6 42.4 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.386 2.274 . . . . 2.7400000000000002 109.599 -179.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 29.0 mm -78.83 106.4 9.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 115.36 -0.836 . . . . 1.02 109.431 177.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -58.67 147.99 30.81 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.037 1.335 . . . . 4.0999999999999996 109.468 169.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -57.29 -35.39 69.74 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 120.062 -1.649 . . . . 2.8900000000000001 111.726 173.026 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -50.38 -44.15 54.76 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.989 1.716 . . . . 3.9100000000000001 113.142 167.62 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -79.41 -40.96 28.78 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.284 1.834 . . . . 1.7 111.275 -177.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -58.16 -28.21 64.53 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.558 1.143 . . . . 2.0099999999999998 112.625 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 53.2 p -53.34 -33.23 52.72 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 121.025 -1.047 . . . . 2.8799999999999999 113.676 168.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.4 t -67.16 -41.63 87.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.298 1.039 . . . . 1.8999999999999999 109.725 -178.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -55.51 -57.15 13.12 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.648 0.779 . . . . 2.2599999999999998 111.202 171.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.31 -33.91 73.05 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 113.06 0.763 . . . . 1.5700000000000001 113.06 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 63.7 m -70.32 -44.38 68.37 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.554 0.742 . . . . 0.68999999999999995 111.481 -179.274 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 79.5 mtm -55.56 -41.01 72.67 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.482 0.583 . . . . 1.3300000000000001 111.556 172.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.5 mt -73.23 -41.49 63.66 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.777 0.831 . . . . 1.29 113.177 -179.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 3.5 p -67.75 -31.84 72.03 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 119.29 0.95 . . . . 3.1200000000000001 112.643 175.769 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 70.8 mtp -71.57 -37.73 71.03 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.791 -0.568 . . . . 1.6799999999999999 111.919 170.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.88 -36.6 83.87 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.461 1.028 . . . . 0.76000000000000001 113.213 176.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -66.76 -18.1 65.2 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.254 -0.904 . . . . 2.3999999999999999 113.347 170.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 17.7 t30 -74.57 -39.85 62.0 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 119.938 1.245 . . . . 2.1800000000000002 112.915 174.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -58.53 -48.98 79.05 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.115 0.966 . . . . 4.3300000000000001 110.103 171.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.82 -46.09 64.19 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.468 1.507 . . . . 2.1000000000000001 112.876 174.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -67.09 -22.92 65.8 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.994 1.318 . . . . 2.4199999999999999 112.943 -179.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.1 mt -86.45 -24.99 25.45 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.425 1.09 . . . . 1.6299999999999999 112.232 172.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -89.23 -20.8 23.71 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 115.479 1.659 . . . . 2.7599999999999998 115.479 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -79.58 -34.97 40.38 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.55 1.14 . . . . 2.9199999999999999 112.39 167.026 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -91.55 60.21 4.0 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 123.397 1.57 . . . . 2.5499999999999998 112.163 -169.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 50.4 mmtt . . . . . 0 C--O 1.251 1.172 0 C-N-CA 128.286 2.634 . . . . 3.6499999999999999 114.661 172.608 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.443 ' SD ' ' HE2' ' B' ' 7' ' ' LYS . 67.9 mtm . . . . . 0 N--CA 1.476 0.861 0 N-CA-C 108.233 -1.025 . . . . 6.4100000000000001 108.233 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -92.45 -17.86 23.99 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.71 1.204 . . . . 4.5599999999999996 113.639 -148.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 2.6 t -174.47 150.34 1.45 Allowed Pre-proline 0 N--CA 1.47 0.557 0 C-N-CA 127.58 2.352 . . . . 3.1499999999999999 108.022 -172.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -60.39 -11.51 16.83 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.186 1.924 . . . . 1.8 113.677 175.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.21 -33.19 59.26 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 119.356 0.98 . . . . 2.7599999999999998 112.574 171.02 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -58.97 -46.28 88.47 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 121.144 -0.973 . . . . 4.8399999999999999 109.484 167.292 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 7' ' ' LYS . . . . . 0.443 ' HE2' ' SD ' ' B' ' 1' ' ' MET . 8.5 mmtm -65.43 -29.95 70.69 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.134 1.161 . . . . 4.3300000000000001 114.134 175.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.46 -43.99 79.73 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.661 0.784 . . . . 1.0 111.795 170.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 48.8 mt -62.7 -41.63 99.22 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.014 0.926 . . . . 1.6399999999999999 112.057 174.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -55.7 24.34 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 118.814 0.734 . . . . 1.26 109.845 167.313 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 42.0 m -54.91 -38.8 68.08 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.202 1.801 . . . . 1.29 112.623 -174.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 88.4 mtp -53.37 -43.49 67.84 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.973 0.806 . . . . 3.0099999999999998 111.602 175.273 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 19.5 t -71.36 -34.81 55.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.824 1.249 . . . . 2.2799999999999998 111.47 176.254 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.9 m -62.3 -47.37 84.61 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 121.123 -0.986 . . . . 1.05 112.387 174.011 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 p -62.55 -28.53 69.93 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.404 1.082 . . . . 2.0699999999999998 112.065 170.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -63.56 -59.53 4.5 Favored 'General case' 0 C--O 1.225 -0.202 0 O-C-N 124.001 0.813 . . . . 2.4100000000000001 109.63 -178.442 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -74.67 -27.96 60.64 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 117.426 -1.273 . . . . 2.9399999999999999 114.139 -177.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 24.8 mtpt -41.05 -47.75 3.16 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.773 1.229 . . . . 6.6399999999999997 112.322 167.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -108.09 -36.64 6.27 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.786 1.234 . . . . 2.0600000000000001 113.06 -175.269 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 29.2 t -58.47 -26.57 63.52 Favored 'General case' 0 C--O 1.246 0.874 0 O-C-N 120.824 -1.173 . . . . 1.9099999999999999 112.95 173.121 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.7 -7.25 87.3 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 127.61 2.529 . . . . 1.76 115.402 175.401 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 11.7 mmp_? -57.92 -73.33 0.07 Allowed 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 120.118 1.959 . . . . 4.3700000000000001 110.362 168.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -127.06 161.92 27.27 Favored 'General case' 0 C--O 1.246 0.909 0 C-N-CA 126.546 1.938 . . . . 3.7799999999999998 110.65 -156.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.06 -136.26 48.44 Favored Glycine 0 C--N 1.338 0.686 0 C-N-CA 125.709 1.623 . . . . 2.1699999999999999 110.978 174.352 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 46.1 t -63.09 141.21 58.85 Favored 'General case' 0 C--O 1.248 1.011 0 CA-C-O 123.207 1.48 . . . . 3.8799999999999999 110.828 162.022 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 55.4 mttm -85.86 1.29 50.41 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.902 1.281 . . . . 8.1099999999999994 112.695 173.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 76.3 mt -88.96 -33.85 17.08 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.662 1.585 . . . . 4.8700000000000001 112.083 164.606 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 65.5 p -109.2 152.05 25.68 Favored 'General case' 0 C--O 1.249 1.032 0 C-N-CA 125.292 1.437 . . . . 1.73 112.686 -176.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.7 pp -105.47 112.88 26.14 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 114.932 -1.031 . . . . 1.95 111.492 170.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 2.3 p -77.74 171.01 15.6 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.853 1.261 . . . . 2.0099999999999998 112.229 170.098 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 -41.19 -32.69 0.29 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 117.026 2.232 . . . . 3.77 117.026 174.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.65 -41.78 15.99 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 120.161 -1.587 . . . . 4.7199999999999998 112.196 179.263 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -57.85 -38.4 75.62 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.561 1.544 . . . . 1.9099999999999999 109.821 169.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 tt -68.47 -50.66 50.78 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.019 1.728 . . . . 3.0299999999999998 113.129 176.147 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 7.6 ptpt -71.19 -15.57 62.48 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 120.085 1.311 . . . . 3.02 114.27 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -72.99 -56.46 5.1 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.925 0.89 . . . . 3.8999999999999999 110.974 163.108 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.1 tt -52.21 -58.99 4.94 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 126.197 1.799 . . . . 2.1200000000000001 112.598 -175.458 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 33.1 mt -56.55 -50.06 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 N-CA-C 109.084 -0.71 . . . . 0.88 109.084 -172.283 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -71.24 -13.24 61.84 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 124.047 0.939 . . . . 3.96 113.482 -171.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -99.59 -33.28 10.7 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 114.195 1.183 . . . . 4.0599999999999996 114.195 174.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -79.95 -50.04 11.0 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.011 0.823 . . . . 4.8600000000000003 110.29 173.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 39.6 mt -81.07 64.31 5.76 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 122.955 1.359 . . . . 2.4500000000000002 109.606 160.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 8.2 p -65.64 37.19 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.034 2.534 . . . . 3.8799999999999999 112.772 164.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 98.5 mt -121.41 172.38 8.09 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 126.689 1.996 . . . . 4.2999999999999998 111.178 -171.182 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -75.39 22.44 1.67 Allowed Glycine 0 CA--C 1.535 1.312 0 CA-C-O 117.738 -1.59 . . . . 3.5299999999999998 114.666 176.274 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.19 -128.65 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 126.005 1.722 . . . . 9.4299999999999997 112.181 -171.658 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 14.3 ptp -62.85 146.07 53.57 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.813 1.642 . . . . 3.3700000000000001 114.494 -172.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -121.59 161.21 22.82 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.547 1.139 . . . . 4.3200000000000003 109.364 -173.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -66.79 -12.83 60.36 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 117.783 2.512 . . . . 3.2799999999999998 117.783 -155.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 12.9 t -72.75 -12.16 60.9 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 120.617 1.553 . . . . 2.6099999999999999 114.199 167.142 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 7.7 m -103.73 -16.21 15.51 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.055 1.342 . . . . 2.4300000000000002 112.534 175.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 10.7 mm -64.53 -34.28 68.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.793 1.237 . . . . 1.6299999999999999 111.757 177.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.25 -18.97 57.21 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.195 0.998 . . . . 2.9100000000000001 112.646 176.456 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -80.47 -42.63 22.23 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.272 -0.893 . . . . 3.0299999999999998 110.802 166.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -57.25 -46.9 82.59 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.931 1.293 . . . . 2.71 109.967 175.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 6.9 tpt -48.31 -57.73 5.59 Favored 'General case' 0 C--O 1.217 -0.648 0 C-N-CA 125.782 1.633 . . . . 1.75 111.134 167.199 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.04 -25.44 67.83 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.25 1.42 . . . . 4.2000000000000002 114.017 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 15.1 m -82.11 -39.6 23.12 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.44 1.896 . . . . 1.9199999999999999 111.764 -178.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 12.4 mt -57.33 -59.06 5.69 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.116 1.366 . . . . 2.8599999999999999 111.044 158.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -80.77 47.92 1.02 Allowed 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 127.574 2.349 . . . . 1.7 112.103 -173.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -51.57 -24.42 5.34 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.31 1.844 . . . . 5.3799999999999999 112.954 170.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 52.5 p30 -88.74 -6.88 57.13 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 115.616 1.709 . . . . 2.0800000000000001 115.616 172.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 19.1 m 69.42 25.22 5.53 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.258 1.823 . . . . 2.8799999999999999 115.417 163.146 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 p30 -100.71 -2.87 31.39 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.818 1.647 . . . . 2.48 113.048 -177.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 63.99 -7.64 0.2 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 131.154 3.782 . . . . 4.25 115.989 -174.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -92.83 145.78 24.13 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 123.706 0.802 . . . . 3.6200000000000001 108.965 174.005 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 42.6 mm -117.63 113.14 41.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 125.313 1.445 . . . . 1.54 108.875 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.28 173.23 9.31 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.615 1.166 . . . . 2.73 110.571 161.344 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -54.39 -38.4 66.12 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.933 1.086 . . . . 2.9199999999999999 113.933 175.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 18.1 mtpp -71.47 -25.2 62.18 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.492 0.717 . . . . 4.5 112.447 -177.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -75.66 -53.45 8.54 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.073 0.949 . . . . 1.6799999999999999 110.188 161.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -51.58 -37.49 50.05 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.498 1.919 . . . . 2.3300000000000001 114.874 -173.125 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 4.8 m -59.44 -26.49 65.24 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 117.791 -1.1 . . . . 2.2400000000000002 113.848 173.622 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 68.0 t -62.46 -47.12 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 CA-C-N 120.679 1.581 . . . . 1.6399999999999999 110.277 178.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -57.89 -50.75 72.27 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.488 1.115 . . . . 1.6299999999999999 112.219 172.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 82.9 mt -67.85 -29.0 68.03 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 118.693 -0.67 . . . . 1.73 112.31 -176.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 31.5 m -65.16 -50.75 64.77 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.219 1.008 . . . . 0.82999999999999996 110.538 167.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 72.8 mtp -55.78 -41.61 74.32 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.207 1.003 . . . . 1.9399999999999999 113.197 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 39.8 mt -69.16 -50.56 46.56 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 118.531 0.605 . . . . 1.54 112.094 174.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -65.84 -26.7 67.78 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 121.513 -0.742 . . . . 1.6899999999999999 111.984 -177.519 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 60.7 mmm -63.19 -44.49 95.22 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.554 1.142 . . . . 2.27 112.553 165.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.1 -36.92 80.99 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.863 1.21 . . . . 0.90000000000000002 112.455 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -69.96 -23.31 63.16 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.966 1.099 . . . . 2.25 113.966 171.468 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -63.26 -48.59 77.55 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.463 1.029 . . . . 2.4300000000000002 111.452 175.269 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -63.27 -43.71 97.17 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.764 1.225 . . . . 3.1400000000000001 112.214 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -54.36 -50.93 66.33 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.363 1.465 . . . . 2.79 111.649 176.694 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -63.76 -27.44 69.2 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.121 0.968 . . . . 2.5 111.882 -176.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 82.3 mt -81.17 -14.27 57.77 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 117.749 -1.12 . . . . 1.8300000000000001 112.834 177.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -92.96 -21.45 19.78 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.405 1.261 . . . . 4.3499999999999996 114.405 166.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -73.99 -36.5 64.52 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.372 1.469 . . . . 3.9900000000000002 112.816 175.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -99.25 47.06 0.97 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.745 1.218 . . . . 2.7799999999999998 112.655 -167.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt . . . . . 0 C--O 1.249 1.052 0 C-N-CA 127.752 2.421 . . . . 4.9900000000000002 114.797 -174.864 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.548 ' HA ' ' OE2' ' A' ' 6' ' ' GLU . 3.7 mmt . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 117.492 -1.242 . . . . 11.73 109.476 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -145.64 -101.41 0.1 Allowed 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 113.884 1.068 . . . . 6.3499999999999996 113.884 -139.316 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.445 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 9.9 p -107.19 178.19 1.14 Allowed Pre-proline 0 N--CA 1.48 1.069 0 C-N-CA 127.169 2.187 . . . . 1.5900000000000001 113.059 -159.195 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.445 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 56.7 Cg_endo -72.34 -24.9 19.03 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 122.201 1.934 . . . . 1.6499999999999999 113.986 170.196 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.2 tt -75.12 -41.37 58.61 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 119.645 1.112 . . . . 2.9100000000000001 111.173 173.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.548 ' OE2' ' HA ' ' A' ' 1' ' ' MET . 1.6 tm-20 -59.29 -43.8 92.55 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.654 0.782 . . . . 4.4100000000000001 110.772 173.667 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.3 mttp -68.34 -32.86 73.27 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.453 -1.404 . . . . 3.3199999999999998 113.224 173.614 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.538 ' HB1' ' HB1' ' B' ' 8' ' ' ALA . . . -60.96 -50.25 74.17 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.81 0.732 . . . . 1.04 112.016 174.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.5 mt -69.75 -33.49 72.5 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.179 0.9 . . . . 2.3599999999999999 111.873 178.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 88.7 m -57.84 -45.34 86.37 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 118.055 -0.974 . . . . 1.5600000000000001 111.111 169.323 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.4 m -58.16 -40.08 80.5 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.742 1.156 . . . . 1.3300000000000001 111.648 175.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 16.3 mtp -62.67 -52.37 63.59 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 118.65 0.659 . . . . 3.3999999999999999 110.779 174.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.0 t -58.0 -37.24 60.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 121.217 -0.927 . . . . 2.21 112.725 176.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.4 m -67.15 -57.0 7.58 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.587 1.555 . . . . 1.26 110.73 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.4 p -58.79 -41.08 85.86 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.329 0.651 . . . . 1.9199999999999999 109.976 176.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.43 -65.61 0.66 Allowed 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 118.687 -0.673 . . . . 2.2000000000000002 109.241 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -58.07 -36.21 72.48 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 120.078 1.308 . . . . 2.7200000000000002 112.446 -177.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -63.37 -56.11 19.02 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 120.52 -1.363 . . . . 4.9400000000000004 113.348 174.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -70.95 -31.24 67.75 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.188 0.995 . . . . 2.9500000000000002 111.459 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.412 ' HA ' ' OE1' ' A' ' 33' ' ' GLU . 13.0 t -58.23 -37.64 75.26 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 124.908 1.283 . . . . 2.02 111.017 169.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.98 6.88 11.01 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 127.906 2.67 . . . . 1.8 116.379 175.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -94.48 123.25 37.78 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 105.332 -2.099 . . . . 5.1900000000000004 105.332 150.135 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 60.77 169.42 0.09 Allowed 'General case' 0 CA--C 1.559 1.303 0 N-CA-C 116.069 1.877 . . . . 5.7199999999999998 116.069 161.15 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.25 -106.33 1.56 Allowed Glycine 0 N--CA 1.472 1.078 0 N-CA-C 108.39 -1.884 . . . . 2.5699999999999998 108.39 -175.211 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.7 m -129.63 -179.85 5.41 Favored 'General case' 0 C--O 1.24 0.592 0 O-C-N 121.741 -0.858 . . . . 3.48 111.946 141.277 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.2 ttmm -66.87 -9.62 39.72 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 127.973 2.509 . . . . 4.4199999999999999 113.326 174.142 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.9 mt -84.5 -43.62 14.39 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.698 1.599 . . . . 3.7599999999999998 111.302 170.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.7 p -101.51 134.6 44.37 Favored 'General case' 0 C--O 1.243 0.712 0 C-N-CA 125.862 1.665 . . . . 1.55 112.241 -168.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 68.4 mt -88.02 96.04 10.36 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.354 1.462 . . . . 1.6200000000000001 108.848 162.485 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.429 ' H ' ' CD ' ' A' ' 33' ' ' GLU . 2.4 m -66.87 157.62 32.66 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.227 -0.921 . . . . 2.6099999999999999 112.133 171.651 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 45.5 ttt-85 -50.63 -9.88 0.06 Allowed 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 128.115 2.566 . . . . 3.3300000000000001 117.527 -177.461 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.43 -44.0 7.04 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 119.895 -1.753 . . . . 4.8399999999999999 113.259 167.607 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.429 ' CD ' ' H ' ' A' ' 30' ' ' SER . 17.2 mt-10 -54.42 -45.95 73.1 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.084 1.354 . . . . 1.5600000000000001 109.711 170.566 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.3 tp -67.28 -40.41 86.13 Favored 'General case' 0 C--N 1.344 0.368 0 C-N-CA 123.203 0.601 . . . . 2.2000000000000002 112.307 -179.505 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -59.51 -44.54 93.09 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.88 0.764 . . . . 3.27 111.658 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.511 ' HG2' ' HE2' ' A' ' 40' ' ' LYS . 53.3 tt0 -63.92 -52.19 60.98 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-O 119.035 -0.507 . . . . 3.8999999999999999 112.096 173.329 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -61.69 -47.39 85.53 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.843 1.257 . . . . 2.8599999999999999 112.647 -174.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 48.0 mt -49.77 -47.39 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 119.378 0.99 . . . . 1.25 109.291 170.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.3 tptt -74.08 -12.7 60.68 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 112.995 0.739 . . . . 5.5 112.995 -173.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.511 ' HE2' ' HG2' ' A' ' 36' ' ' GLU . 68.1 mmtt -79.69 -40.32 29.26 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.894 1.224 . . . . 2.7799999999999998 112.573 163.57 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -67.06 -71.76 0.19 Allowed 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 108.973 -0.751 . . . . 4.71 108.973 175.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.5 mt -76.45 65.5 2.33 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.956 1.302 . . . . 3.0499999999999998 111.824 172.473 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 14.9 t -79.63 -27.02 40.98 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.885 1.674 . . . . 3.5299999999999998 112.942 174.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -54.7 1.63 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 130.159 3.384 . . . . 4.5599999999999996 120.086 -161.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 104.8 -23.49 30.96 Favored Glycine 0 N--CA 1.473 1.118 0 C-N-CA 125.861 1.696 . . . . 3.7999999999999998 113.465 -175.496 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -80.87 171.36 15.11 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 117.475 0.637 . . . . 5.0899999999999999 112.19 160.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 31.1 tpp 72.6 106.3 0.07 Allowed 'General case' 0 C--O 1.235 0.328 0 C-N-CA 129.165 2.986 . . . . 2.5499999999999998 112.49 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -131.1 157.3 43.48 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.429 1.892 . . . . 5.5099999999999998 111.129 -174.103 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -26.46 -74.88 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 128.34 2.656 . . . . 4.6699999999999999 114.921 -168.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.1 m -65.14 -17.0 64.11 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.543 1.312 . . . . 2.71 114.543 -169.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -76.17 -15.69 60.01 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.246 -0.909 . . . . 2.6299999999999999 112.919 173.065 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 81.0 mt -75.11 -30.15 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.1 0.96 . . . . 1.55 110.482 -178.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.2 -22.09 36.12 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.543 0.942 . . . . 2.6299999999999999 113.543 -179.643 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -68.75 -44.13 74.39 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 121.188 -0.945 . . . . 3.2400000000000002 109.886 157.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 17.1 tp -62.57 -39.03 92.36 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 117.684 -1.15 . . . . 1.78 110.958 -176.366 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.6 mmm -51.95 -56.79 12.01 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 126.022 1.729 . . . . 1.8200000000000001 112.113 167.453 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.4 tmmm? -58.91 -31.34 68.54 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.567 1.547 . . . . 3.2599999999999998 112.874 177.074 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 20.6 m -88.72 -26.86 21.56 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.82 1.648 . . . . 1.8999999999999999 112.775 -175.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.6 mp -66.52 -44.0 83.71 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.099 0.863 . . . . 3.2599999999999998 110.76 160.499 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -58.69 147.07 34.24 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 123.134 1.445 . . . . 2.5699999999999998 113.617 174.245 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.38 15.24 13.87 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.852 1.261 . . . . 2.9199999999999999 111.876 161.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 27.7 p-10 -137.85 -48.63 0.56 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.099 1.759 . . . . 3.3199999999999998 112.851 -177.153 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 2.9 t 95.62 104.18 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 129.163 2.985 . . . . 2.8900000000000001 108.383 -173.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.8 p30 -145.64 -139.31 0.1 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.736 1.215 . . . . 4.1799999999999997 109.349 -178.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -141.38 24.56 2.09 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.085 0.954 . . . . 4.2999999999999998 111.068 164.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -144.89 136.78 25.73 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 126.026 1.73 . . . . 3.2999999999999998 112.683 -173.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 39.8 mm -120.94 124.31 72.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 125.515 1.526 . . . . 1.0900000000000001 110.274 -173.431 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.4 -176.23 3.33 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.967 1.707 . . . . 2.9700000000000002 111.794 168.604 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -57.44 -37.5 72.92 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 116.326 1.973 . . . . 3.2999999999999998 116.326 175.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 43.5 mtmt -74.58 -31.95 62.22 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.835 0.854 . . . . 3.6600000000000001 111.964 -178.5 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.407 ' O ' HG12 ' A' ' 74' ' ' VAL . 77.4 mt-10 -69.76 -65.04 0.77 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.63 0.772 . . . . 2.2200000000000002 109.337 162.796 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -47.34 -36.45 9.49 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.996 2.119 . . . . 2.29 115.224 -174.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.5 m -70.0 -19.38 63.33 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 120.314 -1.491 . . . . 2.1699999999999999 111.97 -177.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.407 HG12 ' O ' ' A' ' 71' ' ' GLU . 0.8 OUTLIER -74.05 -22.29 18.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 O-C-N 121.292 -0.88 . . . . 2.0499999999999998 112.696 173.845 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -65.28 -66.5 0.54 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.449 1.5 . . . . 2.6600000000000001 110.477 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.418 ' H ' HD23 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -53.75 -33.2 55.01 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.316 1.446 . . . . 2.3700000000000001 112.523 170.101 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.6 m -59.57 -44.72 93.2 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.854 1.206 . . . . 0.94999999999999996 112.139 173.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 51.4 mtp -60.23 -42.94 96.28 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.933 0.788 . . . . 1.8700000000000001 111.234 178.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 44.0 mt -66.57 -50.04 64.41 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.332 1.053 . . . . 1.22 110.87 178.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 3.2 t -64.31 -27.26 68.91 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.269 1.428 . . . . 1.4099999999999999 113.051 -177.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 71.8 mtm -72.63 -39.39 67.25 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.051 1.13 . . . . 3.6699999999999999 114.051 165.445 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.6 -44.37 82.29 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.612 1.096 . . . . 1.3999999999999999 112.036 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -60.9 -24.75 66.22 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.669 0.618 . . . . 2.3100000000000001 112.669 173.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -65.93 -51.98 53.83 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 118.978 0.808 . . . . 2.4199999999999999 112.083 175.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -58.8 -51.05 71.63 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.207 1.803 . . . . 2.9199999999999999 111.581 174.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -50.93 -47.14 61.02 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.62 1.568 . . . . 2.8199999999999998 111.439 178.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -64.41 -33.76 76.62 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.913 0.885 . . . . 2.5600000000000001 112.852 -178.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.3 mt -74.61 -18.39 60.57 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.819 0.848 . . . . 2.1200000000000001 112.745 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -96.96 -13.91 22.05 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.742 1.386 . . . . 4.8499999999999996 114.742 172.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -93.37 -52.1 4.68 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.343 1.457 . . . . 3.1499999999999999 112.668 179.415 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -83.46 43.88 0.92 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.066 1.346 . . . . 2.52 112.113 179.068 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.6 mmtm . . . . . 0 C--O 1.251 1.145 0 CA-C-O 114.737 -2.554 . . . . 4.8799999999999999 115.08 171.721 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 108.97 -0.752 . . . . 5.2599999999999998 108.97 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -115.06 -171.5 1.96 Allowed 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 130.907 3.683 . . . . 4.9500000000000002 109.644 -179.449 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 74.1 p -94.16 164.88 18.96 Favored Pre-proline 0 N--CA 1.47 0.552 0 C-N-CA 124.689 1.195 . . . . 1.8899999999999999 110.225 165.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -64.72 -6.62 12.74 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 123.04 2.493 . . . . 1.3899999999999999 114.692 175.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 10.6 mp -76.91 -55.52 5.4 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.907 1.231 . . . . 3.5699999999999998 111.165 174.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -59.62 -29.85 68.29 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-O 122.297 1.046 . . . . 4.3099999999999996 111.82 170.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.74 -37.15 65.17 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 119.411 -2.055 . . . . 4.7999999999999998 113.869 170.495 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.538 ' HB1' ' HB1' ' A' ' 8' ' ' ALA . . . -62.02 -45.46 93.47 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.507 1.123 . . . . 0.97999999999999998 112.467 170.107 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 58.8 mt -58.45 -44.64 89.31 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 124.758 1.223 . . . . 1.55 111.425 173.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 64.7 m -53.48 -56.17 19.2 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 118.272 -0.871 . . . . 1.47 110.711 169.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 94.9 m -58.86 -37.1 75.73 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.144 1.378 . . . . 1.6100000000000001 111.811 -178.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.2 mmm -59.06 -51.81 68.45 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.304 1.042 . . . . 3.23 112.674 171.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 85.6 t -68.79 -31.67 51.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 121.126 -0.984 . . . . 1.8899999999999999 111.909 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 31.8 m -59.02 -59.86 4.8 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.131 1.373 . . . . 1.1899999999999999 110.178 175.179 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.7 -31.48 71.47 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 124.743 1.217 . . . . 2.7799999999999998 110.046 -174.093 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -63.06 -46.73 86.13 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.892 0.701 . . . . 1.8600000000000001 112.892 174.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -61.99 -39.32 91.82 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.996 -1.065 . . . . 2.3500000000000001 112.408 175.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.475 ' HE2' ' CZ ' ' B' ' 19' ' ' TYR . 4.9 tttt -53.65 -33.44 55.24 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 125.501 1.52 . . . . 5.4900000000000002 113.468 171.341 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.475 ' CZ ' ' HE2' ' B' ' 18' ' ' LYS . 67.1 m-85 -96.02 -37.25 10.72 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 115.614 1.709 . . . . 2.1499999999999999 115.614 176.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 62.8 m -66.66 -22.69 66.09 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 116.661 2.097 . . . . 1.9099999999999999 116.661 -172.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.02 -17.18 63.56 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-O 118.43 -1.206 . . . . 2.0600000000000001 113.982 179.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 28.7 ttt-85 -58.07 -26.99 63.23 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.408 2.283 . . . . 3.79 114.107 -175.283 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -151.33 144.41 24.62 Favored 'General case' 0 C--O 1.243 0.76 0 C-N-CA 128.617 2.767 . . . . 3.79 108.382 178.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.18 -12.76 0.58 Allowed Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.318 1.437 . . . . 2.2200000000000002 114.766 -172.075 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 63.72 -159.66 0.3 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.56 1.944 . . . . 5.8300000000000001 110.747 -161.173 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 31.5 mmtm 73.62 -176.28 0.16 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.306 2.242 . . . . 8.8000000000000007 113.193 163.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -72.82 -9.3 58.51 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.79 1.236 . . . . 2.8100000000000001 113.521 168.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 28' ' ' THR . . . . . 0.435 ' HB ' ' HB3' ' B' ' 66' ' ' GLU . 5.9 p -90.43 135.21 33.83 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.974 1.309 . . . . 1.3400000000000001 110.954 -171.484 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -114.93 108.42 16.69 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.42 1.888 . . . . 2.0499999999999998 110.691 -159.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.487 ' HA ' ' HA ' ' B' ' 66' ' ' GLU . 0.9 OUTLIER -76.17 162.29 28.1 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 119.394 -2.066 . . . . 2.6400000000000001 115.364 -171.278 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -44.23 -38.28 3.71 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.728 0.811 . . . . 3.6499999999999999 112.176 169.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.66 -41.51 26.76 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.773 -1.204 . . . . 4.6799999999999997 114.055 177.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -58.31 -40.16 81.3 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.139 0.575 . . . . 1.76 109.978 173.565 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 18.3 tp -65.68 -41.86 91.93 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.818 1.247 . . . . 2.0099999999999998 112.669 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 20.7 mtpt -49.73 -53.06 27.08 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 120.305 1.411 . . . . 3.4399999999999999 111.483 176.171 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -67.14 -41.61 85.79 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 117.959 -1.02 . . . . 3.1200000000000001 113.305 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.6 tt -54.87 -54.21 45.41 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.618 1.099 . . . . 1.9399999999999999 110.471 175.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 29.1 mt -57.88 -48.57 83.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 118.186 -0.911 . . . . 1.3200000000000001 109.856 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -75.65 -8.12 56.01 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 115.205 1.557 . . . . 5.0700000000000003 115.205 -172.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -108.29 -45.24 3.95 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.162 1.385 . . . . 3.6499999999999999 112.353 174.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -80.23 -19.83 46.01 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.122 0.569 . . . . 5.5099999999999998 111.357 -178.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mp -128.66 174.14 9.68 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.351 1.861 . . . . 3.71 108.77 156.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 27.0 p -150.91 4.17 0.47 Allowed 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 116.755 2.132 . . . . 3.1400000000000001 116.755 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.422 ' H ' HD12 ' B' ' 44' ' ' LEU . 4.5 mp -43.16 -32.34 0.72 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 117.405 2.372 . . . . 3.0699999999999998 117.405 -168.24 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.64 -26.98 2.6 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 124.82 1.2 . . . . 2.9300000000000002 113.515 -178.408 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -61.03 -25.82 67.18 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.471 1.135 . . . . 5.7599999999999998 113.007 167.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.92 72.97 0.18 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 122.839 1.304 . . . . 2.7400000000000002 110.622 147.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.1 mppt? -66.13 159.23 26.64 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.05 -0.977 . . . . 4.9199999999999999 108.742 166.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -52.2 -37.66 55.55 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 113.359 0.874 . . . . 4.96 113.359 -177.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 35.2 t -62.37 -16.7 56.18 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 115.021 1.489 . . . . 4.1100000000000003 115.021 174.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 3.3 t -106.33 -3.38 21.22 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.419 1.488 . . . . 3.0800000000000001 112.264 173.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 19.6 mm -80.2 -44.0 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 O-C-N 120.025 -1.672 . . . . 1.8799999999999999 110.839 175.088 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -70.98 -42.58 69.48 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.55 0.574 . . . . 3.3700000000000001 112.55 -178.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.95 -35.08 69.48 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 120.43 -1.419 . . . . 2.4300000000000002 112.483 -177.732 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -54.42 -47.88 72.28 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.324 1.049 . . . . 2.5299999999999998 110.285 164.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.49 -44.33 89.35 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.849 1.26 . . . . 1.7 112.378 177.202 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -69.6 -27.22 64.91 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 120.832 -1.167 . . . . 4.1299999999999999 113.597 176.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 23.0 t -71.71 -36.13 70.44 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 121.125 -0.984 . . . . 2.8599999999999999 111.523 170.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 8.7 mp -62.78 -50.33 71.47 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-O 118.352 -0.833 . . . . 2.71 112.102 168.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -87.57 82.4 7.46 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 122.086 0.946 . . . . 1.6699999999999999 113.293 -169.32 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -21.65 58.74 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.121 1.156 . . . . 3.8100000000000001 114.121 -177.583 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -84.69 -22.89 29.62 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.28 0.945 . . . . 2.3700000000000001 112.101 175.599 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 32.2 t 58.5 38.92 25.44 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.576 1.151 . . . . 2.21 112.138 -167.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -88.54 -119.24 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.478 1.511 . . . . 3.04 107.152 176.405 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -148.6 -3.82 0.46 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 117.447 2.388 . . . . 4.5499999999999998 117.447 166.318 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 66' ' ' GLU . . . . . 0.487 ' HA ' ' HA ' ' B' ' 30' ' ' SER . 16.8 mt-10 -118.5 146.69 44.33 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 123.175 1.464 . . . . 3.25 112.702 166.699 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 67' ' ' ILE . . . . . 0.432 HG22 ' HB2' ' B' ' 72' ' ' TYR . 79.1 mt -103.07 115.62 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 126.958 2.103 . . . . 1.77 109.405 -175.6 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.74 161.73 25.57 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.808 2.043 . . . . 2.6299999999999999 111.2 169.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.2 -31.93 67.79 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 119.982 -1.699 . . . . 2.4300000000000002 114.749 -174.323 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.9 mtmp? -83.11 -16.98 44.7 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.222 1.409 . . . . 3.5099999999999998 113.151 177.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -70.66 -61.85 1.61 Allowed 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 107.389 -1.338 . . . . 1.99 107.389 156.466 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 72' ' ' TYR . . . . . 0.432 ' HB2' HG22 ' B' ' 67' ' ' ILE . 32.0 t80 -58.45 -29.86 66.49 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 127.975 2.51 . . . . 2.48 117.3 -171.117 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 60.2 p -58.29 -24.01 58.15 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 120.777 1.626 . . . . 2.3399999999999999 113.745 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.9 p -67.56 -22.82 28.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 O-C-N 121.529 -0.732 . . . . 2.0099999999999998 112.578 174.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -63.73 -51.15 66.21 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.233 1.013 . . . . 3.0800000000000001 110.397 174.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 39.5 mt -60.74 -44.56 96.52 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 124.183 0.993 . . . . 2.1000000000000001 110.39 176.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 43.4 m -54.69 -54.35 42.94 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.743 0.817 . . . . 1.03 111.423 176.459 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 48.5 mtm -60.32 -45.15 94.43 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.403 0.681 . . . . 1.78 112.124 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 82.4 mt -63.17 -43.71 97.5 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 118.467 0.576 . . . . 2.04 112.354 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 93.3 m -67.76 -33.82 75.6 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 122.742 0.417 . . . . 1.6899999999999999 112.073 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 64.5 mtp -68.56 -38.76 81.04 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 118.777 0.717 . . . . 2.04 112.847 172.477 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.23 -38.19 66.13 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.482 1.037 . . . . 0.89000000000000001 112.351 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -68.31 -25.66 65.24 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.403 1.001 . . . . 2.04 113.362 177.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 17.7 t30 -59.54 -46.09 89.89 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.358 0.981 . . . . 2.27 111.499 169.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.89 -34.69 44.55 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.307 1.443 . . . . 3.1400000000000001 111.973 -175.797 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -53.32 -54.49 35.77 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.331 1.452 . . . . 2.9500000000000002 110.019 166.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -54.11 -36.28 63.05 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.895 1.278 . . . . 2.7400000000000002 112.757 177.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 55.1 mt -74.16 -19.16 60.65 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.916 1.08 . . . . 2.1800000000000002 113.916 178.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -101.83 -14.94 17.07 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.567 1.321 . . . . 3.5699999999999998 114.567 171.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -96.47 -48.45 5.56 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.312 1.845 . . . . 4.7599999999999998 112.548 -176.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -87.83 46.75 1.41 Allowed 'General case' 0 CA--C 1.548 0.866 0 CA-C-O 122.903 1.335 . . . . 4.2699999999999996 111.316 173.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm . . . . . 0 C--O 1.25 1.107 0 CA-C-O 114.903 -2.475 . . . . 5.5700000000000003 114.894 168.874 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.6 tpt . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 107.244 -1.391 . . . . 6.9299999999999997 107.244 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -110.88 -64.87 1.22 Allowed 'General case' 0 C--N 1.327 -0.38 0 O-C-N 124.505 1.128 . . . . 3.8300000000000001 108.648 -153.554 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.407 HG21 ' O ' ' B' ' 41' ' ' GLU . 7.9 t 174.13 150.76 0.25 Allowed Pre-proline 0 C--O 1.236 0.386 0 C-N-CA 127.331 2.253 . . . . 2.3999999999999999 107.612 -163.498 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -73.51 -24.25 16.38 Favored 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 121.925 1.75 . . . . 1.6399999999999999 112.437 175.564 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -69.54 -43.05 73.79 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.141 -0.933 . . . . 3.48 112.584 -171.557 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -53.08 -34.52 56.96 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 122.137 0.97 . . . . 4.2400000000000002 112.563 171.262 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 46.9 mttt -80.68 -25.52 38.16 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.67 -1.269 . . . . 4.2000000000000002 111.455 -179.037 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.47 -42.23 62.16 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.027 0.931 . . . . 1.05 111.198 169.461 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 83.7 mt -64.3 -43.02 96.04 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.185 0.994 . . . . 1.4099999999999999 111.224 171.741 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 87.2 m -55.35 -42.84 74.41 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.136 -0.977 . . . . 1.53 111.664 167.912 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.5 m -61.63 -38.34 87.3 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 119.763 1.165 . . . . 1.3700000000000001 111.387 178.73 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 33.1 ttm -56.34 -53.88 52.06 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 118.473 0.579 . . . . 3.0 111.388 169.924 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 93.2 t -62.39 -37.07 77.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-N 118.798 0.727 . . . . 1.8999999999999999 112.498 178.685 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 76.0 m -57.43 -59.17 5.55 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.907 1.283 . . . . 0.79000000000000004 110.408 177.315 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.21 -34.28 70.7 Favored 'General case' 0 CA--C 1.521 -0.167 0 C-N-CA 123.789 0.836 . . . . 2.5800000000000001 110.599 -170.109 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -57.59 -40.35 78.84 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.344 0.658 . . . . 2.2999999999999998 110.976 174.612 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 36.6 m170 -78.81 -28.17 44.45 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.931 1.086 . . . . 2.5299999999999998 113.931 176.972 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.1 mtmp? -60.27 -55.72 30.33 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.366 1.439 . . . . 4.6200000000000001 111.438 166.553 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -71.24 -32.28 68.57 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.516 -0.74 . . . . 2.1299999999999999 111.96 -177.485 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.0 t -73.04 -6.43 45.49 Favored 'General case' 0 C--O 1.247 0.948 0 N-CA-C 116.465 2.024 . . . . 2.4300000000000002 116.465 -178.389 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.7 -12.62 74.34 Favored Glycine 0 CA--C 1.539 1.551 0 CA-C-O 119.061 -0.855 . . . . 2.2400000000000002 113.02 166.338 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -60.98 -31.35 70.94 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.507 1.523 . . . . 6.7999999999999998 113.652 -177.315 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 173.13 -149.95 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 129.662 3.185 . . . . 4.2199999999999998 111.706 164.337 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.04 -149.44 21.8 Favored Glycine 0 N--CA 1.476 1.352 0 O-C-N 120.351 -1.468 . . . . 2.2200000000000002 111.973 -175.229 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.7 m -78.48 -177.49 5.31 Favored 'General case' 0 CA--C 1.55 0.975 0 O-C-N 121.007 -1.29 . . . . 2.2799999999999998 112.072 158.351 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.48 ' HZ2' ' C ' ' B' ' 92' ' ' LYS . 38.1 ttmt -84.54 -32.99 23.58 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.191 1.397 . . . . 4.4299999999999997 111.726 169.579 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.424 ' H ' HD23 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -82.07 6.84 14.99 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.923 1.689 . . . . 3.1800000000000002 114.711 178.022 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 24.1 p -146.95 150.9 36.09 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.843 1.657 . . . . 1.1499999999999999 110.554 -170.141 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 79.1 mt -116.82 109.36 16.99 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.248 1.019 . . . . 1.5 112.331 174.603 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.0 t -77.46 151.93 34.47 Favored 'General case' 0 CA--C 1.549 0.924 0 O-C-N 121.325 -0.859 . . . . 2.1499999999999999 111.886 173.316 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.42 -46.19 4.63 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 126.087 1.755 . . . . 5.5899999999999999 115.604 -172.169 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.38 -18.06 61.21 Favored 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 115.051 1.5 . . . . 4.8700000000000001 115.051 178.996 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -90.73 -45.57 8.77 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 128.77 2.828 . . . . 2.1299999999999999 109.837 175.276 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.19 -31.04 72.01 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.281 1.033 . . . . 2.7999999999999998 112.906 175.318 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.95 -17.72 65.05 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.754 1.39 . . . . 5.4000000000000004 114.754 177.097 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.22 -58.2 3.42 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.38 1.072 . . . . 3.6899999999999999 108.894 171.529 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.9 tt -50.03 -56.02 12.44 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.729 1.611 . . . . 1.8799999999999999 112.121 -179.145 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.5 mt -53.69 -60.19 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 CA-C-N 118.85 0.75 . . . . 0.82999999999999996 109.937 -175.142 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.4 tptt -72.39 -9.64 58.77 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 113.264 0.839 . . . . 5.8200000000000003 113.264 -174.794 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 46.0 mmtt -91.69 -35.91 13.91 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.82 1.648 . . . . 3.4300000000000002 114.988 173.702 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -104.25 -44.38 4.98 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.652 0.781 . . . . 5.1399999999999997 112.094 -175.04 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -104.47 61.4 0.72 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.434 1.894 . . . . 3.0099999999999998 107.92 175.131 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 59.1 m -45.8 -64.94 0.62 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.537 1.535 . . . . 3.6400000000000001 113.066 -166.955 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 95.9 mt 65.19 152.17 0.05 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 127.862 2.465 . . . . 4.5099999999999998 115.974 168.426 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.57 -25.29 63.35 Favored Glycine 0 N--CA 1.474 1.199 0 O-C-N 121.378 -0.826 . . . . 2.9300000000000002 111.336 171.513 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.48 -160.2 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 129.484 3.114 . . . . 6.7000000000000002 110.894 173.312 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 17.8 mmt 43.5 93.38 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.22 1.808 . . . . 2.9100000000000001 115.187 -179.729 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.53 126.96 50.99 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.131 -1.062 . . . . 4.2199999999999998 108.131 164.076 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -12.73 -83.7 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 127.705 2.402 . . . . 4.9299999999999997 114.951 -157.652 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.5 t -60.08 -11.44 5.98 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.884 1.809 . . . . 4.3600000000000003 115.884 -172.009 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.9 t -61.53 -13.88 24.97 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 120.749 -1.219 . . . . 1.96 113.513 164.684 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 88.9 mt -77.03 -21.35 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 126.585 1.954 . . . . 1.3500000000000001 111.828 171.156 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -70.66 -53.53 15.41 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.858 0.754 . . . . 3.0099999999999998 111.3 -169.462 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -67.47 -34.01 76.29 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 121.51 -0.744 . . . . 3.2999999999999998 111.889 172.467 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.6 tp -54.73 -59.37 4.8 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 118.52 -0.752 . . . . 1.9399999999999999 110.186 174.11 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -67.4 -33.02 74.32 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.465 0.575 . . . . 1.8100000000000001 112.161 -179.323 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.5 tmtm? -65.78 -22.25 66.56 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 120.782 -1.198 . . . . 6.1600000000000001 112.885 169.455 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.2 t -86.89 -28.33 22.88 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.352 1.861 . . . . 1.9099999999999999 112.637 170.054 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.7 mt -65.83 -33.71 76.48 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.436 -0.79 . . . . 1.97 111.335 167.444 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -68.32 99.14 0.89 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 122.636 1.208 . . . . 2.3999999999999999 111.818 176.925 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -67.42 -23.6 65.56 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.691 1.196 . . . . 5.0999999999999996 113.697 -176.764 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -83.9 -29.81 26.86 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.322 1.449 . . . . 2.98 112.079 167.81 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.7 t 72.25 41.67 0.61 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 128.707 2.803 . . . . 3.3700000000000001 112.143 -167.569 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -94.9 -117.82 0.1 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.736 1.615 . . . . 3.8599999999999999 106.775 -179.656 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -153.04 -9.12 0.17 Allowed 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 116.394 1.998 . . . . 4.4500000000000002 116.394 173.808 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -101.41 128.97 47.37 Favored 'General case' 0 C--O 1.242 0.665 0 N-CA-C 106.857 -1.534 . . . . 2.6000000000000001 106.857 171.788 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.413 HG22 ' HB2' ' A' ' 72' ' ' TYR . 20.1 mm -96.54 89.74 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 124.451 1.1 . . . . 1.25 109.586 174.086 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -56.68 151.95 13.02 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.698 1.199 . . . . 2.98 111.3 165.106 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -46.95 -39.92 13.31 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.356 1.243 . . . . 2.2999999999999998 114.356 -175.831 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.58 -10.04 58.53 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.708 1.203 . . . . 3.4100000000000001 113.906 -179.544 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -73.1 -63.2 1.23 Allowed 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 106.633 -1.617 . . . . 2.04 106.633 155.599 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.413 ' HB2' HG22 ' A' ' 67' ' ' ILE . 24.0 t80 -49.04 -30.84 6.75 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 128.375 2.67 . . . . 2.0800000000000001 115.74 -173.931 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.5 m -53.45 -30.54 41.15 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.597 -1.314 . . . . 1.9099999999999999 113.229 173.158 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.0 m -68.98 -27.01 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 CA-C-N 119.903 1.229 . . . . 2.6699999999999999 112.935 179.816 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -59.47 -55.09 39.06 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.11 0.964 . . . . 1.75 109.968 173.416 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 52.3 mt -71.12 -25.91 62.79 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.015 -0.993 . . . . 2.3799999999999999 111.481 -179.599 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 41.5 m -64.48 -51.53 62.56 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.154 0.888 . . . . 0.93999999999999995 111.33 169.582 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 29.3 mtm -58.1 -45.57 87.02 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.455 1.025 . . . . 1.6499999999999999 111.909 179.121 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 72.6 mt -67.15 -38.18 85.08 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.905 -0.497 . . . . 1.28 112.085 178.563 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 33.5 t -63.28 -31.6 72.8 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.248 0.619 . . . . 1.8400000000000001 112.387 172.541 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 71.1 mtp -68.39 -40.19 81.46 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 119.701 1.137 . . . . 1.6599999999999999 112.324 167.448 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.15 -42.52 99.47 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.762 0.71 . . . . 0.77000000000000002 112.654 -179.112 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -60.69 -26.68 67.3 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.876 1.065 . . . . 3.0699999999999998 113.876 173.354 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -69.96 -37.7 75.88 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.466 1.03 . . . . 1.9199999999999999 112.796 176.402 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -73.04 -38.5 66.48 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.687 0.795 . . . . 3.2000000000000002 111.253 176.866 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -53.16 -51.47 61.9 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.131 1.372 . . . . 2.3900000000000001 110.959 172.198 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -55.54 -27.35 48.38 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.387 1.475 . . . . 2.3399999999999999 113.156 178.2 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 44.3 mt -84.03 -12.21 55.55 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.589 1.156 . . . . 1.73 113.496 178.776 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.422 ' CD ' ' HZ3' ' A' ' 92' ' ' LYS . 82.0 mm-40 -90.88 -38.34 12.99 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.266 1.026 . . . . 2.79 113.147 165.882 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -62.71 -34.57 77.43 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.975 2.11 . . . . 3.4300000000000002 114.637 -178.245 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -99.11 22.21 10.7 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.061 1.134 . . . . 2.8100000000000001 114.061 -168.498 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.422 ' HZ3' ' CD ' ' A' ' 89' ' ' GLU . 52.8 mttp . . . . . 0 C--O 1.248 0.993 0 N-CA-C 115.623 1.712 . . . . 4.79 115.623 176.801 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 71.8 mtm . . . . . 0 N--CA 1.483 1.191 0 N-CA-C 108.777 -0.824 . . . . 5.6100000000000003 108.777 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -150.24 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 125.755 1.622 . . . . 5.0700000000000003 109.962 131.869 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 64.2 p -145.39 159.84 47.18 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 125.327 1.451 . . . . 2.1699999999999999 112.626 -168.681 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -67.32 -21.25 47.82 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.899 2.4 . . . . 1.79 112.855 172.404 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -63.49 -45.79 89.14 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-N 118.877 0.762 . . . . 2.4100000000000001 110.487 166.219 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.51 -48.19 82.18 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 118.594 0.634 . . . . 3.7599999999999998 110.579 173.233 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 7' ' ' LYS . . . . . 0.499 ' HE3' ' HA ' ' B' ' 7' ' ' LYS . 0.0 OUTLIER -58.09 -25.17 60.98 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 120.576 -1.327 . . . . 4.29 114.508 175.026 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.57 -41.69 99.09 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.498 0.59 . . . . 1.3999999999999999 110.924 176.262 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 29.2 mt -57.78 -48.62 79.15 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.251 1.02 . . . . 1.8100000000000001 111.324 172.963 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.1 -48.27 79.03 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.919 0.888 . . . . 1.1599999999999999 111.018 177.622 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -72.54 -32.54 66.17 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.163 -0.922 . . . . 2.3399999999999999 111.932 -177.817 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 7.6 mtp -64.42 -41.5 96.57 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.486 1.114 . . . . 2.9399999999999999 112.328 171.796 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.78 -36.89 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 119.629 1.104 . . . . 1.8600000000000001 111.422 169.328 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 88.7 m -63.77 -54.77 30.04 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 118.069 -0.967 . . . . 0.90000000000000002 110.89 -176.524 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.7 p -63.7 -44.64 93.09 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.056 0.942 . . . . 1.74 110.03 176.949 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -65.17 -47.12 78.1 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.484 -0.486 . . . . 2.3999999999999999 110.886 -174.472 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -67.51 -44.81 77.53 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 120.796 -1.19 . . . . 2.5699999999999998 111.968 177.719 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -65.34 -20.81 66.56 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 120.78 -1.2 . . . . 4.5300000000000002 113.839 178.727 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -98.73 -1.18 41.18 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.625 0.972 . . . . 2.3599999999999999 113.625 164.814 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 41.8 m -87.26 -48.93 7.61 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 120.702 1.592 . . . . 1.6799999999999999 113.173 175.535 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.28 13.0 57.06 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.376 1.941 . . . . 1.78 112.693 174.478 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 8.8 ttm-85 -65.11 -59.33 4.23 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.033 1.333 . . . . 2.9900000000000002 109.507 169.451 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -156.35 -172.43 4.08 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 126.263 1.825 . . . . 3.6600000000000001 110.461 -169.506 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.59 -135.69 47.24 Favored Glycine 0 N--CA 1.472 1.092 0 O-C-N 120.962 -1.086 . . . . 2.5499999999999998 110.667 -178.972 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 6.6 t -82.19 158.89 23.41 Favored 'General case' 0 C--O 1.247 0.931 0 CA-C-O 123.329 1.538 . . . . 3.5 111.2 154.723 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -84.52 155.75 22.0 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.993 1.317 . . . . 7.54 110.33 170.899 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.5 tt 71.42 -21.59 0.21 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.516 1.927 . . . . 3.21 112.868 -166.45 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.3 p -107.2 150.58 26.47 Favored 'General case' 0 C--O 1.253 1.237 0 C-N-CA 126.223 1.809 . . . . 1.01 115.099 174.337 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -98.48 108.51 21.22 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 129.784 3.233 . . . . 2.1099999999999999 111.712 173.045 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 9.5 t -85.51 161.94 19.14 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.282 1.033 . . . . 2.0699999999999998 113.279 174.773 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 33.5 ttt85 -50.2 -19.53 0.8 Allowed 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 117.293 2.331 . . . . 3.6099999999999999 117.293 -174.964 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.21 -25.35 12.02 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.286 1.217 . . . . 4.4900000000000002 114.286 170.702 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -62.12 -51.91 66.0 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 108.362 -0.977 . . . . 2.0499999999999998 108.362 169.485 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 8.1 tp -60.31 -38.79 84.77 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 125.172 1.389 . . . . 1.9199999999999999 112.651 179.173 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -55.74 -41.75 74.37 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 122.098 -0.376 . . . . 3.0600000000000001 110.851 175.972 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -65.34 -49.52 69.08 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 117.834 -1.079 . . . . 3.4100000000000001 113.293 169.631 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 tt -53.25 -48.9 67.85 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 120.155 1.343 . . . . 2.1200000000000001 111.671 -179.259 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 5.8 mt -65.35 -40.18 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 120.087 1.312 . . . . 0.91000000000000003 110.583 178.915 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -65.2 0.17 1.48 Allowed 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 114.572 1.323 . . . . 5.1900000000000004 114.572 171.566 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -119.78 -45.93 2.47 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.662 1.585 . . . . 3.5 112.971 177.79 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 41' ' ' GLU . . . . . 0.407 ' O ' HG21 ' A' ' 3' ' ' THR . 28.5 mt-10 -72.72 -29.34 63.27 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-O 117.418 -1.277 . . . . 4.29 112.785 175.367 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -125.24 -81.7 0.63 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.909 1.684 . . . . 2.5299999999999998 110.469 -175.978 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.5 t 64.07 -44.24 0.27 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 129.01 2.924 . . . . 4.79 115.745 -175.555 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 4.3 pp -61.92 -15.39 42.67 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 127.771 2.429 . . . . 3.3399999999999999 115.941 -167.707 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -79.92 13.17 26.32 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 124.346 0.974 . . . . 3.3799999999999999 114.148 171.757 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 61.43 56.07 2.69 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.205 2.202 . . . . 7.1799999999999997 111.811 -176.965 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.77 74.41 0.59 Allowed 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 115.624 1.712 . . . . 3.3100000000000001 115.624 -161.639 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -88.38 168.88 12.29 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 127.367 2.267 . . . . 5.2599999999999998 112.443 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -48.1 -53.61 15.96 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.789 1.236 . . . . 4.6200000000000001 113.146 -178.83 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 21.5 t -66.13 5.11 0.56 Allowed 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 115.652 1.723 . . . . 3.3500000000000001 115.652 -179.605 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 43.0 t -119.41 -40.63 2.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.17 1.388 . . . . 2.2200000000000002 111.765 166.732 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 26.0 mm -59.67 -33.93 53.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.612 1.565 . . . . 1.3200000000000001 112.507 174.307 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -70.67 -42.09 71.2 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.998 1.319 . . . . 4.1500000000000004 112.339 179.729 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -74.36 -42.23 59.69 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 124.362 1.065 . . . . 2.98 111.61 177.49 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 49.2 tp -58.73 -46.62 86.97 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.05 0.94 . . . . 2.3199999999999998 110.513 171.465 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 17.4 tpp -54.26 -49.18 70.13 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.059 0.943 . . . . 2.1000000000000001 110.773 174.334 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.65 -22.49 45.97 Favored 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 114.307 1.225 . . . . 4.1100000000000003 114.307 175.605 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.8 t -92.85 -28.25 16.64 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 120.744 -1.223 . . . . 2.6299999999999999 113.427 171.477 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.81 -42.44 27.75 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 127.924 2.49 . . . . 2.0 112.724 -179.127 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -99.34 128.4 45.45 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 124.776 1.231 . . . . 1.9299999999999999 110.24 166.546 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -95.27 -11.34 28.09 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.741 -0.599 . . . . 3.6699999999999999 112.606 173.794 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 62' ' ' ASN . . . . . 0.555 ' HB2' ' H ' ' B' ' 64' ' ' ASP . 5.2 m120 -94.32 -32.98 13.38 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.515 1.302 . . . . 1.8100000000000001 114.515 -169.502 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 9.2 t 72.91 15.87 4.57 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.161 1.384 . . . . 2.9300000000000002 112.462 -156.048 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 64' ' ' ASP . . . . . 0.555 ' H ' ' HB2' ' B' ' 62' ' ' ASN . 53.9 p-10 -71.94 -18.45 62.01 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.382 1.073 . . . . 2.1000000000000001 109.802 169.741 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 61.08 21.23 11.64 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 128.98 2.912 . . . . 4.4199999999999999 111.853 -178.758 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -126.23 144.9 50.61 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 128.375 2.67 . . . . 2.1200000000000001 109.657 171.811 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 16.0 mt -128.3 130.26 69.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 125.791 1.637 . . . . 1.3200000000000001 109.428 -171.325 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.34 173.01 6.49 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.915 1.686 . . . . 2.9700000000000002 111.516 168.868 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -47.25 -40.77 17.26 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.235 1.414 . . . . 3.1899999999999999 114.811 176.881 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 24.2 mtmm -70.28 -43.93 69.42 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.526 -0.734 . . . . 3.4300000000000002 110.986 -176.651 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -61.34 -47.22 86.89 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.185 0.994 . . . . 2.2400000000000002 110.642 173.773 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -58.89 -22.0 58.59 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 128.499 2.719 . . . . 2.5899999999999999 113.647 177.448 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 9.4 t -53.31 -35.26 59.95 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 120.982 -1.074 . . . . 2.6099999999999999 111.714 168.491 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 65.0 t -66.14 -31.89 55.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 O-C-N 121.248 -0.907 . . . . 1.6799999999999999 112.15 -179.868 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.434 ' CE1' HD11 ' B' ' 79' ' ' LEU . 36.0 t80 -67.53 -56.98 7.34 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.431 1.092 . . . . 2.6800000000000002 111.849 173.522 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 77.8 mt -55.43 -39.82 70.74 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.046 1.338 . . . . 1.71 111.397 179.309 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 58.6 m -65.39 -52.19 55.16 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.141 1.376 . . . . 0.96999999999999997 111.815 176.538 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 16.7 ptp -65.63 -38.0 88.16 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.426 1.012 . . . . 2.3900000000000001 112.677 -177.412 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.434 HD11 ' CE1' ' B' ' 75' ' ' PHE . 92.3 mt -65.78 -47.01 76.58 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.269 0.628 . . . . 1.53 111.101 175.73 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 94.0 m -65.61 -32.58 74.23 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.462 -0.774 . . . . 1.71 112.611 176.864 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 52.9 mtm -65.85 -37.04 85.12 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.923 1.238 . . . . 3.1899999999999999 112.715 172.238 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.28 -42.42 98.61 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.602 1.092 . . . . 0.96999999999999997 112.593 173.313 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -69.67 -32.9 71.8 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.533 0.938 . . . . 2.79 113.533 172.682 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -58.8 -48.97 79.43 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.175 0.898 . . . . 2.6499999999999999 112.062 172.282 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -59.26 -48.66 80.79 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.163 1.385 . . . . 3.1800000000000002 111.44 177.78 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.09 -45.44 68.2 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.448 1.499 . . . . 2.6099999999999999 112.326 175.242 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -71.21 -28.18 64.03 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.31 1.444 . . . . 2.2400000000000002 112.861 -177.665 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 78.9 mt -77.74 -8.95 58.69 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.883 1.068 . . . . 2.3399999999999999 113.883 177.677 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -92.69 -3.38 54.96 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 119.298 0.954 . . . . 5.1200000000000001 113.333 167.564 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -99.7 -74.84 0.58 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.237 1.415 . . . . 4.96 110.203 166.926 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.32 -7.78 54.9 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 116.311 1.967 . . . . 5.1100000000000003 116.311 -167.159 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 92' ' ' LYS . . . . . 0.48 ' C ' ' HZ2' ' A' ' 26' ' ' LYS 0.26 4.0 tttp . . . . . 0 C--O 1.248 0.976 1 C-N-CA 131.827 4.051 . . . . 9.0399999999999991 116.897 -158.704 . . . . . . . . 3 2 . 1 . 021 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.3 ttp . . . . . 0 N--CA 1.479 0.996 0 N-CA-C 107.277 -1.379 . . . . 7.1299999999999999 107.277 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 -115.9 -61.21 1.77 Allowed 'General case' 0 C--N 1.327 -0.372 0 O-C-N 124.862 1.351 . . . . 3.3100000000000001 107.711 -159.435 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 66.4 p -135.96 162.39 57.03 Favored Pre-proline 0 C--O 1.238 0.474 0 C-N-CA 124.96 1.304 . . . . 1.55 109.846 160.914 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -64.31 -22.78 66.22 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 121.826 1.684 . . . . 1.3400000000000001 112.091 166.551 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -69.68 -52.01 29.55 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.532 1.133 . . . . 3.5600000000000001 111.649 177.071 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -52.28 -44.22 64.86 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.563 1.145 . . . . 4.0599999999999996 111.041 175.196 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.537 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -77.35 -34.35 55.18 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 115.317 1.599 . . . . 5.8799999999999999 115.317 -178.936 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.39 -42.17 77.47 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 123.441 0.697 . . . . 1.23 112.001 165.039 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 74.0 mt -70.39 -34.19 72.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.264 0.938 . . . . 1.8400000000000001 112.37 173.911 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 5.1 m -60.56 -46.51 89.94 Favored 'General case' 0 N--CA 1.479 0.981 0 O-C-N 121.063 -1.023 . . . . 1.5800000000000001 110.937 167.463 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.5 m -57.86 -41.36 82.28 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.868 1.667 . . . . 1.6200000000000001 111.221 -179.003 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 19.0 tpp -52.93 -56.78 13.41 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 117.953 -1.023 . . . . 3.75 111.852 168.702 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -62.35 -32.8 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 CA-C-N 120.983 1.719 . . . . 2.3100000000000001 113.106 -176.425 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.4 m -60.83 -58.93 6.39 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.631 1.172 . . . . 1.1299999999999999 111.069 173.787 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 t -73.54 -30.03 62.82 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 117.332 -1.318 . . . . 3.1299999999999999 110.399 -171.141 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -53.82 -53.03 58.16 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 125.677 1.591 . . . . 2.4300000000000002 110.01 170.708 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -59.15 -29.04 67.13 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.123 1.157 . . . . 2.2799999999999998 114.123 175.141 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.9 tttp -64.67 -31.72 73.07 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 120.724 -1.235 . . . . 4.1699999999999999 112.57 176.258 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -94.84 -38.7 10.62 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.729 1.212 . . . . 2.1299999999999999 112.778 177.452 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.3 p -70.05 -25.97 63.8 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.109 1.322 . . . . 2.2599999999999998 113.343 174.304 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.24 40.74 2.94 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 126.807 2.146 . . . . 2.4100000000000001 113.871 171.729 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -96.27 -26.34 15.44 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 118.941 1.371 . . . . 5.0499999999999998 112.349 166.059 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.02 153.38 42.16 Favored 'General case' 0 C--O 1.245 0.856 0 C-N-CA 128.722 2.809 . . . . 5.4400000000000004 110.24 177.984 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 46.46 -108.52 0.27 Allowed Glycine 0 C--N 1.345 1.038 0 C-N-CA 127.255 2.36 . . . . 3.0 114.996 147.396 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 m -59.9 102.82 0.17 Allowed 'General case' 0 C--O 1.241 0.635 0 N-CA-C 108.77 -0.826 . . . . 2.7400000000000002 108.77 166.669 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.7 -15.47 56.41 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.04 0.755 . . . . 5.0 113.04 -176.381 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 10.7 mp -83.96 -49.23 9.17 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 126.012 1.725 . . . . 4.6299999999999999 110.986 177.098 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.4 p -111.31 170.36 8.17 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.939 2.096 . . . . 2.0800000000000001 113.331 -168.748 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 46.7 mt -116.55 103.73 10.7 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.456 1.502 . . . . 1.48 113.04 -162.796 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.94 172.47 10.87 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 121.18 -0.95 . . . . 2.1600000000000001 112.114 165.804 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.53 -48.64 2.86 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.593 1.957 . . . . 3.9500000000000002 114.594 -177.667 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -41.53 74.55 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.657 -0.652 . . . . 6.5199999999999996 112.239 -178.616 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 87.8 mt-10 -67.55 -44.38 78.41 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.369 -0.604 . . . . 1.96 109.369 -178.06 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.83 -52.31 66.0 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.728 1.211 . . . . 2.1499999999999999 112.156 177.264 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 15.5 ptmt -63.75 -25.81 68.36 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 120.288 1.404 . . . . 3.52 114.217 -176.204 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -81.84 -50.94 8.63 Favored 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 124.927 1.291 . . . . 3.27 110.634 -177.726 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.1 tt -46.68 -55.22 8.09 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 125.407 1.483 . . . . 2.1400000000000001 110.209 177.245 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.0 mt -51.59 -55.55 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 118.701 0.682 . . . . 1.3 110.689 -178.903 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -68.8 -23.45 64.29 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.984 0.735 . . . . 3.9700000000000002 112.984 -172.768 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.78 -14.99 22.85 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 126.81 2.044 . . . . 5.9500000000000002 113.258 -179.22 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -79.42 -54.82 5.55 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.977 1.311 . . . . 4.4800000000000004 109.487 161.374 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.0 mt -119.3 91.31 3.52 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.85 1.66 . . . . 3.2200000000000002 110.729 -179.167 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 4.6 t -84.74 71.18 10.86 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.282 -0.886 . . . . 3.0600000000000001 109.756 168.121 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 pp -171.41 -179.39 2.59 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 128.067 2.547 . . . . 3.8700000000000001 110.112 -172.222 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 65.12 13.4 57.59 Favored Glycine 0 N--CA 1.477 1.404 0 O-C-N 121.707 -0.621 . . . . 4.5700000000000003 112.339 -173.796 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 44.5 53.03 7.27 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 129.568 3.147 . . . . 6.0499999999999998 109.878 178.934 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.1 tpp -67.36 80.69 0.15 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.344 1.858 . . . . 1.95 113.962 -157.425 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -74.11 129.67 38.29 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.956 2.503 . . . . 5.2199999999999998 109.467 178.602 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -64.87 -10.29 27.46 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 116.348 1.981 . . . . 3.9199999999999999 116.348 -159.757 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.8 t -60.21 -28.81 68.29 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.245 -1.535 . . . . 4.2300000000000004 113.555 166.329 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.0 p -90.53 1.12 57.01 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.929 1.241 . . . . 2.5299999999999998 113.194 172.251 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 19.8 mm -82.18 -40.45 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 119.121 0.873 . . . . 2.0899999999999999 110.924 167.534 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -67.73 -52.47 37.26 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 118.649 0.658 . . . . 4.9699999999999998 112.751 -171.024 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -72.69 -26.47 61.63 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.929 -0.482 . . . . 3.2200000000000002 112.025 -179.173 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.32 -51.27 70.22 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 117.669 -1.158 . . . . 2.3700000000000001 109.551 165.771 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ttt -52.76 -46.26 67.42 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 119.932 1.242 . . . . 1.4299999999999999 111.838 174.132 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -68.69 -26.24 65.19 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 120.952 1.705 . . . . 3.52 113.442 177.651 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.1 t -71.69 -28.68 63.87 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 120.953 -1.092 . . . . 2.9399999999999999 111.741 172.239 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 11.8 mt -72.88 -58.82 3.05 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.915 -1.115 . . . . 1.8799999999999999 109.855 165.559 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -84.25 61.3 6.46 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.542 1.937 . . . . 1.5600000000000001 111.665 -177.253 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.0 mttp -52.01 -20.7 2.55 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 127.561 2.344 . . . . 3.1099999999999999 114.472 -171.253 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 35.1 p-10 -111.27 -0.85 16.28 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 129.074 2.95 . . . . 2.5099999999999998 114.125 -175.499 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.6 t 67.42 30.59 6.81 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.775 1.23 . . . . 2.2599999999999998 114.268 168.134 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -90.17 -9.13 49.32 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.42 1.488 . . . . 2.7400000000000002 112.826 -176.408 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.28 -9.64 1.43 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 129.69 3.196 . . . . 4.3200000000000003 116.9 178.088 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -106.51 142.0 36.89 Favored 'General case' 0 C--O 1.247 0.971 0 C-N-CA 125.701 1.6 . . . . 2.8300000000000001 112.205 173.738 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.5 mt -120.37 101.06 10.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-O 122.854 1.312 . . . . 1.5 111.867 -167.852 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.45 ' OD1' ' HE3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -74.27 158.45 34.04 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 129.053 2.941 . . . . 3.27 111.998 171.527 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.79 -25.8 67.41 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 120.636 -1.29 . . . . 2.5600000000000001 114.09 -174.425 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.455 ' HE2' ' SD ' ' B' ' 81' ' ' MET . 2.5 mtmt -81.55 -33.47 31.68 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 120.548 1.522 . . . . 3.3399999999999999 111.872 173.535 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -54.94 -53.59 53.67 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.027 0.831 . . . . 2.1699999999999999 109.003 165.27 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -66.01 -33.73 76.47 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 127.196 2.199 . . . . 2.1000000000000001 114.751 -175.943 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.33 -21.37 61.98 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 120.443 -1.411 . . . . 1.97 113.304 -175.348 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 p -60.13 -26.98 38.03 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 O-C-N 121.315 -0.865 . . . . 2.3300000000000001 112.477 171.697 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -68.0 -51.59 45.41 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 126.679 1.992 . . . . 2.4199999999999999 111.361 178.971 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.75 -46.85 67.65 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.178 0.991 . . . . 2.23 109.841 169.786 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 20.6 m -61.42 -55.53 30.33 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.974 0.909 . . . . 0.94999999999999996 111.238 -176.675 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 21.1 ptm -66.53 -36.33 82.43 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.814 0.672 . . . . 1.95 112.814 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.4 mt -66.54 -41.56 88.51 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.177 -0.916 . . . . 1.26 111.43 173.437 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.5 m -64.25 -36.73 85.05 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 120.051 1.296 . . . . 1.4099999999999999 112.731 175.57 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 38.1 mmm -61.17 -44.82 96.71 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.054 0.542 . . . . 2.0600000000000001 111.202 174.063 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.27 -38.5 81.8 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.772 0.829 . . . . 0.95999999999999996 112.236 -178.608 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -65.93 -27.46 68.2 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.319 0.859 . . . . 2.3700000000000001 113.319 175.036 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -70.14 -36.66 74.93 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 119.254 0.934 . . . . 2.5699999999999998 112.15 173.809 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -67.14 -43.58 82.0 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.885 0.874 . . . . 3.4500000000000002 110.847 175.926 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -52.6 -44.73 66.18 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.719 1.608 . . . . 2.9100000000000001 112.358 173.361 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -62.61 -27.23 69.06 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.069 1.748 . . . . 2.6800000000000002 112.541 178.892 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 45.3 mt -83.07 -18.6 39.06 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.403 1.081 . . . . 2.5699999999999998 112.84 177.156 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.42 ' CD ' ' HZ1' ' A' ' 92' ' ' LYS . 69.4 mm-40 -90.26 -10.32 44.68 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.718 1.377 . . . . 3.2200000000000002 114.718 171.854 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -84.16 -46.02 12.35 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.034 1.734 . . . . 3.0600000000000001 112.591 169.011 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -79.1 51.03 1.11 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.973 2.109 . . . . 3.48 113.204 -168.295 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.42 ' HZ1' ' CD ' ' A' ' 89' ' ' GLU . 46.6 mmtt . . . . . 0 C--O 1.251 1.169 0 C-N-CA 128.064 2.546 . . . . 4.7800000000000002 115.422 176.397 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.0 mmt . . . . . 0 N--CA 1.482 1.139 0 CA-C-O 117.359 -1.305 . . . . 7.2599999999999998 108.621 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.09 -177.59 4.02 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 124.062 0.851 . . . . 8.0600000000000005 110.929 163.633 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 9.6 t -45.32 143.16 2.8 Favored Pre-proline 0 CA--C 1.535 0.395 0 C-N-CA 128.105 2.562 . . . . 3.9500000000000002 112.256 174.48 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -66.95 -9.11 23.74 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.181 1.921 . . . . 2.4199999999999999 113.081 172.691 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.404 ' O ' HD13 ' B' ' 5' ' ' LEU . 0.3 OUTLIER -69.56 -37.7 77.11 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 117.098 -1.43 . . . . 2.8199999999999998 112.6 176.931 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 13.4 tm-20 -54.34 -42.04 69.78 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 121.427 1.921 . . . . 5.0 110.137 179.118 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 38.5 mtmt -55.05 -23.72 21.4 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.603 0.964 . . . . 7.3899999999999997 113.603 175.961 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.82 -49.03 61.87 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 120.731 -1.231 . . . . 0.94999999999999996 111.007 176.274 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -57.42 -48.91 77.88 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 119.393 0.997 . . . . 2.8900000000000001 109.886 178.858 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 13.9 p -64.15 -44.22 92.79 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.394 1.078 . . . . 2.0899999999999999 112.684 177.937 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 26.9 m -70.2 -32.16 69.94 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.64 1.109 . . . . 1.53 110.813 178.853 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -70.78 -50.26 37.7 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.12 0.968 . . . . 3.5699999999999998 111.045 176.682 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 6.3 p -59.83 -27.3 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-N 120.509 1.504 . . . . 2.2999999999999998 112.104 175.122 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 60.7 m -64.81 -57.8 7.93 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 116.921 -1.514 . . . . 0.92000000000000004 111.593 175.159 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.9 p -61.61 -41.48 97.53 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.147 1.34 . . . . 1.6100000000000001 109.07 175.317 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -64.45 -49.56 70.95 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 120.515 -0.474 . . . . 2.1299999999999999 111.604 -170.369 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 12.0 t60 -69.23 -44.69 71.5 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.774 -0.579 . . . . 2.4199999999999999 111.225 178.532 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -66.78 -39.47 87.83 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.015 -1.053 . . . . 4.2800000000000002 112.91 -175.289 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -80.18 -27.31 38.96 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.62 0.768 . . . . 2.29 112.424 173.016 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 57.0 m -68.91 -22.92 64.13 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.169 1.349 . . . . 2.4900000000000002 112.716 168.292 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.08 11.33 72.48 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 125.656 1.598 . . . . 1.77 115.45 178.127 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.478 HH11 ' HG3' ' B' ' 22' ' ' ARG . 7.9 mmt85 -80.77 -23.38 39.38 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.196 1.398 . . . . 4.29 114.181 177.994 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -164.01 149.64 10.86 Favored 'General case' 0 C--O 1.25 1.088 0 C-N-CA 126.481 1.913 . . . . 3.2400000000000002 108.738 -171.215 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.78 -142.32 16.6 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-O 121.702 0.612 . . . . 2.3100000000000001 111.855 -174.301 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 58.9 m -75.17 151.51 38.51 Favored 'General case' 0 C--O 1.242 0.661 0 O-C-N 121.331 -1.099 . . . . 3.8599999999999999 112.55 178.714 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -71.84 56.55 0.3 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.759 2.024 . . . . 5.9100000000000001 111.915 167.038 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 59.5 tp -160.2 -42.81 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.116 1.366 . . . . 4.0 110.0 -170.556 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.4 p -101.45 140.25 35.99 Favored 'General case' 0 C--O 1.251 1.15 0 C-N-CA 125.066 1.346 . . . . 1.77 110.297 173.842 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.45 ' H ' HD23 ' B' ' 29' ' ' LEU 0.263 1.8 pt? -98.58 94.72 6.83 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 122.334 1.064 . . . . 3.27 109.493 158.042 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 5.6 m -65.33 165.24 12.07 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 126.729 2.012 . . . . 3.0899999999999999 112.532 -176.004 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 31' ' ' ARG . . . . . 0.5 HH22 ' CG ' ' B' ' 53' ' ' ASP . 0.9 OUTLIER -30.07 -39.07 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 128.394 2.678 . . . . 5.25 117.14 -178.191 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.4 -37.9 11.22 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.793 1.405 . . . . 4.3300000000000001 114.793 174.115 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -53.44 -41.54 66.2 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.71 1.204 . . . . 2.0699999999999998 109.579 174.305 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.453 HD23 ' HB2' ' B' ' 56' ' ' MET . 24.7 tp -71.41 -40.89 70.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.108 0.963 . . . . 1.8200000000000001 113.473 179.7 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 24.1 ttmt -62.84 -45.09 94.21 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 120.837 -1.165 . . . . 3.1099999999999999 111.949 176.003 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -52.81 -56.83 12.86 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.378 1.471 . . . . 3.2200000000000002 111.993 167.006 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -60.05 -47.82 84.28 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.707 1.603 . . . . 2.5800000000000001 112.846 -174.71 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.8 mt -59.24 -48.27 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 CA-C-N 120.254 1.388 . . . . 1.05 109.547 175.485 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -62.53 -22.86 66.62 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.107 0.78 . . . . 4.0499999999999998 113.107 -179.489 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -82.06 -53.62 5.96 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 117.353 -1.308 . . . . 3.6899999999999999 113.383 168.806 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -67.45 -35.97 80.27 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.632 1.173 . . . . 4.2300000000000004 112.527 -172.961 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -92.03 -73.89 0.53 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.924 1.29 . . . . 3.1600000000000001 110.263 174.178 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 11.9 t 66.13 -40.76 0.35 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 127.908 2.483 . . . . 3.8399999999999999 113.616 -168.858 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 pp -62.5 174.31 1.02 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 128.063 2.545 . . . . 3.4900000000000002 113.787 172.087 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.04 -142.04 23.88 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 115.456 -0.793 . . . . 3.0699999999999998 111.836 167.131 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -119.32 57.47 0.89 Allowed 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 122.399 1.095 . . . . 5.1900000000000004 109.564 178.206 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.76 47.53 1.4 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 124.234 1.969 . . . . 2.5899999999999999 113.401 -175.059 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 37.5 mttp -81.42 152.56 27.35 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.121 2.168 . . . . 4.1299999999999999 112.169 172.192 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -47.44 -54.04 12.45 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.49 1.293 . . . . 3.3399999999999999 114.49 -163.155 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 9.0 t -61.25 -23.7 65.84 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 120.184 1.356 . . . . 3.1699999999999999 113.945 -176.292 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 9.8 t -86.71 -9.37 56.08 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.978 0.808 . . . . 2.1600000000000001 112.94 174.95 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 22.3 mt -97.52 -40.05 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 125.9 1.68 . . . . 1.3400000000000001 110.833 172.32 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.5 ' CG ' HH22 ' B' ' 31' ' ' ARG . 0.9 OUTLIER -67.52 -39.2 85.08 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 126.076 1.75 . . . . 4.0099999999999998 110.08 176.567 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -69.8 -44.92 69.07 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 118.559 0.618 . . . . 2.96 112.337 166.102 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 7.4 tt -57.85 -44.37 86.48 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.466 1.03 . . . . 2.2799999999999998 111.186 -177.893 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 56' ' ' MET . . . . . 0.453 ' HB2' HD23 ' B' ' 34' ' ' LEU . 1.9 ppp? -67.06 -38.8 86.43 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.453 1.024 . . . . 2.1699999999999999 111.959 176.972 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 1.4 tmpt? -62.74 -23.39 67.16 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.905 1.282 . . . . 3.9700000000000002 112.812 169.317 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 22.1 m -92.31 -22.45 19.72 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.639 1.576 . . . . 2.6299999999999999 112.95 178.218 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 19.2 mt -67.09 -47.67 70.51 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 118.643 0.656 . . . . 1.9199999999999999 109.731 163.403 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -78.08 141.66 38.66 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.949 1.3 . . . . 2.5899999999999999 113.832 -173.266 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -115.5 3.31 14.04 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.018 1.327 . . . . 3.3999999999999999 112.2 178.523 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -117.37 -28.94 5.99 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.612 1.565 . . . . 2.7799999999999998 112.933 -162.378 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 46.0 m 67.83 29.37 6.74 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 129.227 3.011 . . . . 2.79 112.52 -161.983 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 37.2 p30 -85.31 -14.32 46.88 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 120.695 -1.253 . . . . 2.4700000000000002 112.383 -170.92 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 58.99 4.63 0.43 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 129.901 3.28 . . . . 4.7999999999999998 115.236 -168.2 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -105.22 122.34 45.73 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 127.472 2.309 . . . . 2.8399999999999999 110.589 176.535 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 32.1 mm -101.87 107.03 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 114.646 -1.161 . . . . 1.8100000000000001 109.823 175.391 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.48 158.29 32.22 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.829 2.051 . . . . 4.1900000000000004 112.516 173.243 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -50.39 -25.57 4.03 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.278 1.431 . . . . 3.1200000000000001 113.219 163.114 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm -91.72 -16.96 26.15 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 115.623 1.712 . . . . 5.1299999999999999 115.623 176.283 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -89.89 -44.18 10.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.586 1.154 . . . . 1.8899999999999999 109.725 172.703 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -54.42 -22.12 11.64 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.518 1.927 . . . . 1.8500000000000001 114.297 179.17 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 41.0 p -55.76 -29.57 59.82 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 119.869 -1.769 . . . . 2.2000000000000002 113.068 168.393 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 88.2 t -61.12 -34.83 61.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 CA-C-N 119.412 1.005 . . . . 1.7 111.034 173.497 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -66.56 -54.63 21.52 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.038 0.835 . . . . 2.4300000000000002 110.968 177.476 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 76.2 mt -56.86 -36.33 69.92 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.329 0.652 . . . . 1.4099999999999999 112.269 177.463 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 60.8 m -61.63 -46.63 88.99 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.185 0.994 . . . . 0.98999999999999999 111.072 177.087 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.2 mtm -61.26 -43.53 98.72 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 118.845 0.748 . . . . 1.74 112.252 178.32 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -57.6 -54.59 45.16 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 118.714 0.688 . . . . 2.6899999999999999 110.883 173.733 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 89.7 m -66.85 -30.43 70.61 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.298 1.221 . . . . 1.54 114.298 -176.676 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 81' ' ' MET . . . . . 0.455 ' SD ' ' HE2' ' A' ' 70' ' ' LYS . 14.3 mtp -75.09 -33.56 61.65 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.777 1.171 . . . . 2.23 112.562 171.514 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.21 -50.21 66.73 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 119.333 0.97 . . . . 0.91000000000000003 111.376 172.158 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -60.67 -24.45 65.6 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.403 0.89 . . . . 3.0499999999999998 113.403 175.917 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -66.64 -46.92 74.23 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 117.955 -1.022 . . . . 2.7599999999999998 112.484 170.394 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -65.14 -30.16 71.07 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 120.429 1.468 . . . . 3.2799999999999998 112.108 177.626 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.443 ' HA ' ' HG2' ' B' ' 89' ' ' GLU . 0.5 OUTLIER -63.94 -46.64 83.82 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 127.407 2.283 . . . . 3.2000000000000002 111.953 175.15 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -81.13 4.24 20.71 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 119.704 -1.873 . . . . 2.3599999999999999 113.253 171.092 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 81.8 mt -109.57 -0.9 18.51 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 114.376 1.25 . . . . 2.0499999999999998 114.376 165.696 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.443 ' HG2' ' HA ' ' B' ' 86' ' ' PHE . 21.4 pt-20 -97.23 -27.3 14.59 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.59 1.541 . . . . 5.6200000000000001 113.601 170.869 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -46.33 -42.51 14.87 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.519 1.128 . . . . 5.9299999999999997 111.273 149.015 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -85.14 -0.95 56.21 Favored 'General case' 0 CA--C 1.559 1.306 0 N-CA-C 116.258 1.947 . . . . 5.3300000000000001 116.258 177.303 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 19.0 mttp . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 116.279 -1.82 . . . . 5.96 115.468 -172.301 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 31.0 mtt . . . . . 0 N--CA 1.478 0.956 0 N-CA-C 107.206 -1.405 . . . . 5.9500000000000002 107.206 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.3 mp0 -128.5 143.03 50.91 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 124.29 0.994 . . . . 4.04 108.758 -165.403 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -55.24 157.05 6.85 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 127.583 2.353 . . . . 2.54 112.852 172.454 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -65.21 -28.96 55.75 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.41 2.073 . . . . 2.0899999999999999 113.5 -168.174 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 27.9 tp -66.57 -47.79 71.67 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 120.042 1.292 . . . . 4.0199999999999996 110.974 174.321 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -60.15 -34.13 73.14 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.794 -0.566 . . . . 4.9400000000000004 110.819 174.192 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.514 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 5.4 mmpt? -72.84 -33.16 65.98 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 120.152 -1.592 . . . . 4.3399999999999999 113.988 173.478 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.64 -45.73 85.54 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 118.808 0.731 . . . . 1.3700000000000001 110.729 170.432 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 55.8 mt -67.02 -35.19 79.38 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.945 -1.097 . . . . 1.71 112.872 174.328 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 84.8 m -55.54 -46.75 77.05 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.479 1.112 . . . . 1.72 110.709 169.165 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 81.6 m -57.24 -48.53 78.6 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.746 0.818 . . . . 1.76 109.678 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.1 tpp -51.3 -55.66 17.11 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.09 0.956 . . . . 3.1499999999999999 113.563 179.554 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.76 -29.15 46.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 123.689 0.795 . . . . 2.52 112.489 -177.599 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.5 m -72.75 -46.28 54.3 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.184 1.394 . . . . 1.02 110.578 -179.372 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.44 -37.27 77.7 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 118.634 -0.698 . . . . 2.1699999999999999 111.084 165.371 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -66.81 -60.19 2.88 Favored 'General case' 0 C--O 1.222 -0.343 0 O-C-N 123.532 0.52 . . . . 2.1000000000000001 110.845 -170.116 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.9 m170 -72.12 -1.94 16.76 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.892 1.441 . . . . 2.2999999999999998 114.892 -178.322 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -88.56 -62.58 1.46 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.413 1.085 . . . . 4.3099999999999996 112.535 164.957 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -72.64 -39.3 67.31 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.795 1.18 . . . . 2.5899999999999999 113.261 -179.215 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.0 t -62.29 -22.74 66.26 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.498 -0.751 . . . . 2.25 111.818 -176.035 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -157.03 106.8 0.3 Allowed Glycine 0 C--N 1.343 0.924 0 N-CA-C 116.181 1.232 . . . . 2.3100000000000001 116.181 164.479 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -79.86 -13.55 59.31 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 114.736 -0.732 . . . . 5.0800000000000001 111.777 132.307 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -165.14 -167.94 1.3 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.0 2.12 . . . . 3.8500000000000001 109.022 -161.879 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 39.2 53.94 2.62 Favored Glycine 0 N--CA 1.474 1.184 0 C-N-CA 125.936 1.732 . . . . 3.4300000000000002 113.84 160.96 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.2 t 56.11 138.55 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.686 1.994 . . . . 2.96 114.186 -167.424 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.0 mmmt -70.32 -18.61 63.1 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 120.864 -1.147 . . . . 5.6900000000000004 113.983 172.751 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.5 mt -102.16 -6.61 23.04 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.518 1.127 . . . . 3.6000000000000001 113.076 -171.338 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.2 p -136.98 139.45 41.47 Favored 'General case' 0 C--O 1.247 0.962 0 C-N-CA 126.231 1.812 . . . . 1.03 109.771 -174.478 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -94.61 103.31 15.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.064 0.946 . . . . 1.8300000000000001 110.136 170.408 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -74.15 161.31 30.12 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 119.973 -1.704 . . . . 2.2599999999999998 111.113 165.7 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -39.57 -46.77 1.82 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.285 1.834 . . . . 4.2999999999999998 114.481 -167.605 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.478 ' H ' ' HD3' ' A' ' 32' ' ' LYS . 0.6 OUTLIER -69.36 -42.27 75.46 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.927 1.084 . . . . 4.3399999999999999 113.927 -179.108 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -60.56 -48.7 80.6 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.846 1.658 . . . . 1.5900000000000001 108.641 176.426 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.1 tp -61.4 -43.39 98.95 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.654 0.782 . . . . 1.8899999999999999 111.502 178.253 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -66.48 -37.91 86.15 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 118.363 -0.827 . . . . 3.6600000000000001 112.732 -173.049 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -56.86 -54.44 46.46 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 117.792 -1.099 . . . . 3.9100000000000001 112.543 166.376 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.6 tt -53.42 -60.81 2.82 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.907 0.883 . . . . 1.99 110.514 -179.214 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.9 mt -56.96 -51.65 65.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 N-CA-C 108.831 -0.803 . . . . 0.81999999999999995 108.831 -175.801 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -61.96 -35.79 79.5 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.172 0.896 . . . . 4.0 113.115 -175.328 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 60.8 mttm -66.28 -34.87 78.97 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.503 1.047 . . . . 2.96 112.956 172.116 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -72.47 -51.61 19.42 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.454 1.102 . . . . 4.6600000000000001 111.793 179.521 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -82.12 25.82 0.56 Allowed 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 126.45 1.9 . . . . 2.6899999999999999 113.025 -176.453 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.0 m -60.87 6.6 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 126.544 1.938 . . . . 3.1099999999999999 115.766 177.866 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.597 HD12 ' H ' ' A' ' 44' ' ' LEU . 5.0 mp -60.67 -21.51 62.9 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.417 1.887 . . . . 4.0199999999999996 112.8 162.333 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 119.26 14.87 5.75 Favored Glycine 0 N--CA 1.473 1.163 0 C-N-CA 126.335 1.921 . . . . 2.9100000000000001 114.552 175.929 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -88.06 -174.28 4.61 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.291 0.848 . . . . 5.54 113.291 -174.069 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 77.07 -8.05 1.75 Allowed 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.994 1.85 . . . . 3.1000000000000001 115.994 154.575 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.2 mptt -8.82 114.51 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 130.075 3.35 . . . . 6.0199999999999996 114.92 178.405 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -9.91 -56.12 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 130.656 3.582 . . . . 4.4500000000000002 119.891 -149.007 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.1 t -77.57 -17.35 57.95 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.855 1.057 . . . . 2.9399999999999999 113.855 -178.036 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.9 t -75.41 -10.65 59.64 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.0 1.273 . . . . 2.1600000000000001 112.08 173.554 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 70.3 mt -73.98 -27.41 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.693 1.197 . . . . 1.3700000000000001 111.483 161.095 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -91.98 -30.29 16.17 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.672 0.789 . . . . 3.6800000000000002 112.339 -174.384 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -68.44 -37.82 80.59 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.436 -0.79 . . . . 2.29 111.507 161.739 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 58.8 tp -57.49 -46.72 83.41 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 116.747 -1.596 . . . . 1.6899999999999999 110.574 168.706 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.8 mtp -51.35 -48.5 62.45 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 121.239 1.836 . . . . 1.8200000000000001 112.248 173.596 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.68 -21.26 62.64 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.413 1.485 . . . . 3.9199999999999999 113.005 175.975 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -82.22 -39.14 23.51 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 120.51 -1.369 . . . . 1.8200000000000001 113.476 167.326 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 84.4 mt -83.77 -37.43 22.63 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.4 1.48 . . . . 2.0899999999999999 114.771 -172.808 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.428 ' C ' ' HE2' ' A' ' 61' ' ' LYS . 7.2 t70 -79.1 129.04 34.03 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.605 0.717 . . . . 2.54 110.419 177.568 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.428 ' HE2' ' C ' ' A' ' 60' ' ' ASP . 0.8 OUTLIER -101.69 -17.52 16.26 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.6 0.76 . . . . 3.3799999999999999 112.741 178.125 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.7 m120 -95.27 -26.03 16.1 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 115.097 1.518 . . . . 2.3700000000000001 115.097 -170.745 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.6 m 61.61 36.42 16.73 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.735 1.614 . . . . 2.3599999999999999 111.48 -163.334 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 48.4 p30 -92.34 -11.93 33.73 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 127.134 2.174 . . . . 2.4100000000000001 111.828 178.039 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 65.4 18.46 11.33 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 128.758 2.823 . . . . 5.3899999999999997 113.053 -177.153 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -139.18 139.43 37.55 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 122.703 1.239 . . . . 3.0600000000000001 112.377 170.26 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 1.9 mt -98.19 97.82 6.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 124.074 0.95 . . . . 1.8 109.644 -171.531 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -47.64 143.56 3.74 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 127.814 2.445 . . . . 2.3900000000000001 110.665 162.393 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -47.08 -36.99 8.88 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 122.196 0.998 . . . . 2.5299999999999998 112.337 172.619 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -69.79 -29.59 66.93 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.088 1.755 . . . . 3.0800000000000001 114.346 175.965 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.416 ' O ' HG12 ' A' ' 74' ' ' VAL . 51.2 mt-10 -74.13 -54.73 7.19 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 108.324 -0.991 . . . . 1.8999999999999999 108.324 166.418 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -53.99 -25.61 21.86 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 127.063 2.145 . . . . 1.96 114.627 -178.552 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.3 t -62.07 -31.9 72.38 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.767 -1.208 . . . . 1.6299999999999999 111.714 173.027 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.416 HG12 ' O ' ' A' ' 71' ' ' GLU . 2.0 p -74.61 -23.83 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-N 119.635 1.107 . . . . 2.0499999999999998 112.123 -177.483 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -63.65 -50.74 68.08 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.131 0.972 . . . . 2.04 110.115 169.466 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 44.7 mt -59.38 -41.47 89.44 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.394 1.078 . . . . 1.8500000000000001 111.161 177.24 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 88.0 m -58.96 -52.51 65.47 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.314 1.046 . . . . 0.90000000000000002 111.72 171.726 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 36.1 mtp -56.53 -45.94 80.88 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.839 0.855 . . . . 1.8600000000000001 112.281 179.275 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 92.7 mt -62.63 -47.07 85.34 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 123.338 0.655 . . . . 1.3700000000000001 111.488 177.179 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 79.1 m -64.45 -34.88 79.22 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.543 0.942 . . . . 1.76 113.543 178.564 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.5 mmm -65.67 -42.51 91.24 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 118.009 0.368 . . . . 2.3700000000000001 111.065 174.598 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.24 -35.8 78.48 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.761 -0.638 . . . . 1.1599999999999999 112.308 179.769 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -76.98 -30.23 55.86 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.187 1.18 . . . . 2.5099999999999998 114.187 177.683 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -58.55 -49.44 77.42 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.987 0.812 . . . . 2.1200000000000001 110.926 167.936 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.44 -33.13 75.02 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.107 1.363 . . . . 4.5999999999999996 111.84 178.292 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -59.98 -45.51 92.47 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.86 1.264 . . . . 2.48 112.625 174.468 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -63.26 -34.13 77.0 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.867 1.267 . . . . 2.6600000000000001 111.922 177.058 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 71.2 mt -74.68 -7.84 54.51 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.222 1.409 . . . . 2.5699999999999998 113.477 178.166 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -101.38 -1.09 34.22 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.217 1.407 . . . . 3.5699999999999998 114.139 170.518 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -121.03 -65.02 1.18 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.844 1.658 . . . . 3.5699999999999998 111.977 179.13 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -79.72 48.12 0.91 Allowed 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 126.768 2.027 . . . . 3.6499999999999999 111.047 172.316 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.6 ptmt . . . . . 0 C--O 1.249 1.035 0 C-N-CA 128.402 2.681 . . . . 6.1600000000000001 115.237 -170.279 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mmt . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 107.813 -1.18 . . . . 6.1900000000000004 107.813 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 20.3 mp0 -115.69 -90.63 0.54 Allowed 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 107.57 -1.27 . . . . 4.8200000000000003 107.57 -153.875 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 3' ' ' THR . . . . . 0.552 HG23 ' H ' ' B' ' 6' ' ' GLU . 4.7 t -163.17 152.98 13.08 Favored Pre-proline 0 C--O 1.236 0.362 0 C-N-CA 126.732 2.013 . . . . 3.2400000000000002 108.01 -179.68 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -63.74 -16.68 56.18 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 121.726 1.618 . . . . 1.7 112.22 167.58 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 24.8 tp -68.38 -50.65 51.48 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.64 1.109 . . . . 2.8999999999999999 112.204 -177.111 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 6' ' ' GLU . . . . . 0.552 ' H ' HG23 ' B' ' 3' ' ' THR . 2.6 tm-20 -47.95 -54.58 12.33 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.055 1.342 . . . . 4.0300000000000002 110.63 167.303 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -70.34 -26.33 63.7 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.496 -0.752 . . . . 4.8499999999999996 112.278 -171.969 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.61 -38.93 74.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.894 1.278 . . . . 0.93000000000000005 111.933 170.623 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.93 -44.24 81.18 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.897 1.226 . . . . 1.8899999999999999 110.388 171.906 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 59.1 m -55.6 -43.46 76.05 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.616 1.566 . . . . 1.8799999999999999 111.991 172.232 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.15 -32.12 58.93 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 121.036 -1.04 . . . . 1.77 113.17 175.949 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -55.98 -49.07 74.62 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.959 1.254 . . . . 3.2799999999999998 110.218 167.755 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 29.9 t -59.21 -30.6 44.26 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 C-N-CA 124.938 1.295 . . . . 2.25 112.906 172.152 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 29.8 m -71.39 -45.49 62.66 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 120.881 -1.137 . . . . 0.82999999999999996 111.785 175.483 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.22 -32.29 64.29 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.923 0.783 . . . . 1.8899999999999999 110.248 167.604 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -64.06 -58.24 7.25 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 118.473 -0.775 . . . . 2.0499999999999998 110.563 179.632 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 47.2 m-70 -57.23 -43.94 83.35 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 120.589 1.54 . . . . 4.5499999999999998 112.184 178.494 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -56.71 -36.8 70.08 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.086 1.354 . . . . 5.21 113.961 -177.794 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -108.87 -34.11 6.75 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.725 1.009 . . . . 2.3100000000000001 113.725 -179.308 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -67.96 -27.5 66.65 Favored 'General case' 0 C--O 1.249 1.067 0 C-N-CA 125.251 1.42 . . . . 1.75 111.774 175.463 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.81 4.51 60.8 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 128.119 2.771 . . . . 1.8100000000000001 115.222 177.551 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 17.9 mtp180 -78.83 -113.1 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.117 1.459 . . . . 4.1600000000000001 110.575 172.496 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.51 -178.16 1.7 Allowed 'General case' 0 C--O 1.248 0.979 0 C-N-CA 124.954 1.302 . . . . 3.9199999999999999 113.018 178.144 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 62.97 -145.73 50.17 Favored Glycine 0 C--N 1.34 0.783 0 C-N-CA 125.036 1.303 . . . . 2.1600000000000001 111.531 171.412 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.6 m -66.51 153.37 43.09 Favored 'General case' 0 C--O 1.248 0.984 0 CA-C-O 123.723 1.725 . . . . 3.6600000000000001 110.31 155.28 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -82.71 -4.05 57.29 Favored 'General case' 0 CA--C 1.552 1.048 0 O-C-N 120.364 -1.46 . . . . 6.9100000000000001 113.555 175.593 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 4.9 mp -103.04 0.39 31.97 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 128.175 2.59 . . . . 3.5499999999999998 112.592 171.924 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 81.9 p -132.13 157.57 43.89 Favored 'General case' 0 C--O 1.245 0.846 0 C-N-CA 125.356 1.462 . . . . 1.1299999999999999 112.0 -178.562 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -95.29 128.45 42.14 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.395 1.478 . . . . 2.1299999999999999 110.552 167.229 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 23.0 t -101.1 171.99 7.28 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.27 1.428 . . . . 2.0 112.062 162.754 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 48.6 ttm-85 -58.87 -20.29 49.85 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.986 1.714 . . . . 3.8500000000000001 114.96 -165.143 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -95.74 -39.8 9.68 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.46 1.482 . . . . 5.7999999999999998 113.791 169.704 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -46.48 -44.87 17.92 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.224 1.01 . . . . 1.73 111.806 168.679 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 8.6 tp -77.67 -44.65 27.38 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 119.44 -0.314 . . . . 2.1200000000000001 111.687 -175.922 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 35' ' ' LYS . . . . . 0.465 ' HG2' HG21 ' B' ' 52' ' ' ILE . 52.3 mttm -54.87 -46.38 74.71 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 118.858 0.754 . . . . 3.1299999999999999 111.662 172.837 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -56.54 -53.92 51.95 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 123.852 0.72 . . . . 2.9300000000000002 111.469 174.379 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 64.0 tp -56.6 -57.67 11.36 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 125.26 1.424 . . . . 2.2999999999999998 112.375 -177.109 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 34.5 mt -56.95 -39.24 64.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.87 0.868 . . . . 1.53 110.268 179.225 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -68.62 -9.25 48.68 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 120.689 -1.257 . . . . 4.0700000000000003 113.768 -176.387 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -104.8 -60.72 1.56 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.067 0.947 . . . . 3.7799999999999998 109.219 164.107 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -82.6 67.3 8.6 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 127.473 2.309 . . . . 5.6600000000000001 110.543 -176.578 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -173.73 29.58 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 127.861 2.465 . . . . 2.6899999999999999 111.075 166.878 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 33.5 t -50.96 -16.25 0.41 Allowed 'General case' 0 CA--C 1.557 1.246 0 N-CA-C 117.71 2.485 . . . . 3.46 117.71 -159.688 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.482 HD23 ' H ' ' B' ' 44' ' ' LEU . 1.9 pt? -96.93 -7.4 33.32 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 116.226 1.936 . . . . 3.4700000000000002 116.226 174.459 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -110.35 105.96 2.04 Favored Glycine 0 N--CA 1.469 0.882 0 C-N-CA 125.148 1.356 . . . . 3.71 112.547 -175.751 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -75.4 84.95 2.53 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-O 122.247 1.023 . . . . 6.0099999999999998 111.218 179.17 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 8.0 mmt -84.93 117.87 24.19 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 126.378 1.871 . . . . 3.2799999999999998 113.093 -178.289 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -70.71 140.94 51.55 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.892 1.277 . . . . 3.1600000000000001 110.126 171.431 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -53.21 -47.94 68.54 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 114.333 1.235 . . . . 3.8700000000000001 114.333 -168.147 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 15.4 t -70.83 -19.31 62.67 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.025 1.12 . . . . 4.2400000000000002 114.025 178.835 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 38.0 m -76.12 -18.92 58.93 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 120.884 -1.135 . . . . 3.9399999999999999 111.884 172.35 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 52' ' ' ILE . . . . . 0.465 HG21 ' HG2' ' B' ' 35' ' ' LYS . 11.9 mm -66.28 -34.22 68.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 118.828 0.74 . . . . 1.75 110.908 167.531 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -78.31 -21.88 48.99 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.044 0.838 . . . . 3.75 113.13 -177.83 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.636 ' HA ' ' HE3' ' B' ' 57' ' ' LYS . 9.8 t70 -77.78 -41.19 38.28 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 118.438 0.563 . . . . 2.71 111.357 166.23 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 50.7 tp -59.98 -48.31 82.21 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-O 118.411 -0.804 . . . . 2.3599999999999999 111.227 173.143 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 2.5 ppp? -59.93 -40.46 89.0 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.203 0.91 . . . . 2.1600000000000001 110.187 -179.493 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 57' ' ' LYS . . . . . 0.636 ' HE3' ' HA ' ' B' ' 54' ' ' ASP . 11.7 ttpp -61.51 -36.06 79.47 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.099 1.76 . . . . 3.3599999999999999 113.227 172.6 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 5.6 t -75.16 -34.06 61.55 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.844 -1.16 . . . . 1.97 111.581 176.417 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 70.9 mt -69.09 -34.26 74.83 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 117.437 -1.268 . . . . 1.8500000000000001 111.389 170.568 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -96.8 90.34 5.22 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.474 1.51 . . . . 1.99 113.919 -179.339 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 61' ' ' LYS . . . . . 0.412 ' H ' ' HD2' ' B' ' 61' ' ' LYS . 3.8 mptt -67.18 -19.8 65.63 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.904 1.281 . . . . 3.6600000000000001 113.28 -178.732 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 62' ' ' ASN . . . . . 0.4 ' HB2' ' H ' ' B' ' 64' ' ' ASP . 1.7 m120 -78.7 -31.76 46.67 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.161 0.892 . . . . 2.3100000000000001 112.886 173.065 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 12.5 t 63.51 24.03 13.89 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.951 1.3 . . . . 2.8900000000000001 113.637 -159.29 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 64' ' ' ASP . . . . . 0.4 ' H ' ' HB2' ' B' ' 62' ' ' ASN . 54.3 p-10 -81.57 -18.43 44.89 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.496 1.518 . . . . 2.5899999999999999 112.52 176.477 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 76.88 1.53 3.23 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 131.504 3.921 . . . . 4.3600000000000003 113.186 179.066 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -92.77 112.8 24.88 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 125.465 1.506 . . . . 2.4199999999999999 107.109 164.503 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 2.7 mt -97.65 107.46 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 O-C-N 121.045 -1.035 . . . . 1.5 109.816 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -56.71 154.04 9.64 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.487 1.115 . . . . 3.7400000000000002 110.272 173.691 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -49.4 -46.11 47.0 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 120.727 -1.233 . . . . 2.4199999999999999 110.842 163.176 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -53.28 -31.18 42.54 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 127.958 2.503 . . . . 4.0599999999999996 115.319 173.054 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -87.19 -53.69 4.71 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.476 1.511 . . . . 1.75 109.371 176.84 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -58.42 -31.28 67.57 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 129.12 2.968 . . . . 2.3399999999999999 113.982 -177.54 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 23.3 t -56.74 -23.16 40.72 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 120.703 1.592 . . . . 2.3900000000000001 112.837 178.786 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 78.2 t -64.79 -25.71 38.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 124.051 0.94 . . . . 1.47 112.011 176.423 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -57.2 -53.16 61.29 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.489 1.516 . . . . 2.3999999999999999 110.803 169.206 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 25.7 mt -57.93 -43.48 86.32 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.18 1.392 . . . . 1.3500000000000001 109.985 179.387 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 65.3 m -58.26 -53.08 62.36 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 117.807 -1.092 . . . . 0.84999999999999998 111.478 176.654 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.6 mtm -57.1 -47.76 80.28 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.602 1.092 . . . . 1.6000000000000001 112.019 -179.536 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 84.0 mt -68.68 -39.45 80.58 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.786 0.834 . . . . 1.6200000000000001 112.677 -178.174 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.8 t -73.16 -31.83 64.49 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.645 -0.659 . . . . 1.6499999999999999 111.877 177.66 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 47.6 mtt -63.77 -43.74 95.48 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.787 0.721 . . . . 2.8399999999999999 110.994 169.637 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.2 -37.53 85.68 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.412 0.523 . . . . 0.68999999999999995 112.412 176.349 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -70.07 -35.77 74.47 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.612 0.967 . . . . 2.3100000000000001 113.612 172.645 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -65.88 -37.4 86.03 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 119.306 0.957 . . . . 2.6200000000000001 112.28 175.199 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -68.19 -42.37 80.01 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.337 1.055 . . . . 2.6499999999999999 111.983 173.028 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -52.51 -43.97 65.42 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.912 1.285 . . . . 2.3500000000000001 112.185 175.758 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -63.08 -25.74 68.51 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.809 1.643 . . . . 2.4300000000000002 112.438 179.023 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 39.4 mt -85.3 -12.33 52.6 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.638 1.175 . . . . 2.1499999999999999 113.072 178.158 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.485 ' CD ' ' HZ2' ' B' ' 92' ' ' LYS . 14.3 mm-40 -93.19 -8.11 43.35 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.277 1.831 . . . . 3.6000000000000001 114.234 169.307 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -89.44 -46.93 8.34 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.836 2.055 . . . . 4.1299999999999999 111.425 169.801 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -71.17 0.27 8.17 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.433 1.493 . . . . 3.8100000000000001 114.848 -172.003 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 92' ' ' LYS . . . . . 0.485 ' HZ2' ' CD ' ' B' ' 89' ' ' GLU . 16.7 pttm . . . . . 0 C--O 1.249 1.033 0 N-CA-C 117.186 2.291 . . . . 5.2000000000000002 117.186 -168.464 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.6 mtm . . . . . 0 N--CA 1.475 0.789 0 N-CA-C 107.829 -1.175 . . . . 6.1699999999999999 107.829 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -110.1 -98.34 0.4 Allowed 'General case' 0 CA--C 1.536 0.415 0 O-C-N 125.467 1.729 . . . . 3.52 109.541 -153.218 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.455 HG21 ' HA ' ' B' ' 41' ' ' GLU . 67.1 p -133.96 157.86 76.74 Favored Pre-proline 0 N--CA 1.471 0.619 0 C-N-CA 124.463 1.105 . . . . 1.49 111.1 -169.571 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.99 -21.54 32.27 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 122.305 2.004 . . . . 1.4199999999999999 112.216 176.7 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.24 -44.56 52.56 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.479 1.111 . . . . 2.2999999999999998 110.886 176.45 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -67.15 -33.63 75.84 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.451 -0.781 . . . . 4.0 111.7 170.134 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -62.97 -35.9 81.72 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 119.957 -1.714 . . . . 5.9400000000000004 112.037 168.765 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.59 -56.17 17.98 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 120.405 1.457 . . . . 1.1299999999999999 110.954 176.451 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 70.2 mt -57.58 -39.97 77.97 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.567 1.147 . . . . 1.48 112.847 -178.384 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 19.7 p -67.3 -39.17 85.9 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 117.83 -1.081 . . . . 2.4300000000000002 112.097 174.089 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.0 m -65.48 -32.51 74.17 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.375 0.989 . . . . 1.5 111.562 179.921 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -55.34 -57.12 13.13 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 118.227 0.467 . . . . 3.5499999999999998 110.016 168.91 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 74.9 t -60.93 -37.79 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.024 0.53 . . . . 1.9299999999999999 111.797 -176.573 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.7 m -56.26 -57.92 10.18 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.216 1.006 . . . . 1.0700000000000001 111.424 175.974 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.74 -28.45 55.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 118.688 -0.672 . . . . 2.9700000000000002 110.885 -170.749 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -63.05 -41.55 99.52 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.855 1.662 . . . . 1.8500000000000001 112.596 173.892 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 18.7 m170 -66.14 -20.93 66.3 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.756 1.021 . . . . 2.2200000000000002 113.756 175.873 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -65.34 -36.76 85.0 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.77 1.168 . . . . 5.1600000000000001 111.906 172.545 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -102.81 -38.46 7.41 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 114.176 1.176 . . . . 2.1899999999999999 114.176 -170.292 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.3 t -59.02 -32.87 70.12 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 120.106 1.321 . . . . 1.95 112.686 179.61 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -93.56 34.16 4.76 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 126.845 2.164 . . . . 1.3200000000000001 113.95 179.705 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.41 52.76 0.28 Allowed 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.202 1.501 . . . . 4.0899999999999999 110.089 162.912 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . 0.254 6.3 tp10 -6.53 -92.99 0.0 OUTLIER 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.854 1.057 . . . . 9.5399999999999991 113.854 -114.911 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 43.24 63.47 2.06 Favored Glycine 0 C--N 1.34 0.798 0 C-N-CA 124.71 1.148 . . . . 3.71 110.979 172.255 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.9 t 66.25 141.08 0.03 OUTLIER 'General case' 0 C--O 1.25 1.125 0 C-N-CA 125.745 1.618 . . . . 2.96 113.361 -175.309 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.4 tttp -127.59 117.5 22.15 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.133 1.373 . . . . 4.5599999999999996 110.608 -154.556 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 97.45 -17.27 0.06 Allowed 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 130.419 3.488 . . . . 4.1299999999999999 110.513 -163.27 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 47.3 p -109.74 156.63 20.06 Favored 'General case' 0 C--O 1.245 0.86 0 C-N-CA 125.939 1.695 . . . . 1.28 112.348 176.564 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -109.58 105.42 14.72 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 125.764 1.625 . . . . 2.4199999999999999 109.651 169.85 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.4 t -64.77 159.59 22.03 Favored 'General case' 0 C--N 1.318 -0.763 0 O-C-N 121.955 -0.465 . . . . 2.2999999999999998 111.304 168.749 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.4 ttp85 -45.34 -40.09 7.46 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.56 1.544 . . . . 4.0700000000000003 115.014 -175.305 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 24.6 tptp -52.7 -57.92 8.54 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 119.203 -2.186 . . . . 5.0800000000000001 115.217 163.791 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -61.76 -41.33 97.54 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.558 1.543 . . . . 1.8300000000000001 109.715 -167.906 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.37 -43.03 95.79 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.717 1.207 . . . . 2.54 111.668 177.443 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -63.57 -44.33 94.42 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.539 -1.351 . . . . 4.9400000000000004 111.61 176.989 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -59.17 -44.5 92.15 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.668 0.787 . . . . 4.3899999999999997 112.504 176.352 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.3 tt -58.16 -54.31 48.44 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.226 1.41 . . . . 1.8400000000000001 111.324 176.566 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 27.6 mt -58.78 -46.17 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 119.0 0.818 . . . . 1.21 109.87 -175.45 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -72.93 -3.33 25.16 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.987 1.106 . . . . 4.0300000000000002 113.987 -174.975 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 56.6 mmtt -99.22 -49.89 4.32 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.346 1.858 . . . . 3.1800000000000002 111.534 168.392 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.505 ' HA ' HG21 ' B' ' 3' ' ' THR . 1.1 mp0 -75.04 -48.44 23.99 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.162 0.985 . . . . 5.4500000000000002 112.244 -173.89 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -89.59 -48.46 7.28 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.966 1.306 . . . . 2.8100000000000001 110.202 176.329 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 9.7 t 75.66 -40.59 0.42 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 128.1 2.56 . . . . 4.4500000000000002 113.673 -175.314 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -38.97 135.19 0.92 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.183 1.793 . . . . 5.3099999999999996 114.598 -169.71 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -81.85 -23.04 58.54 Favored Glycine 0 N--CA 1.477 1.384 0 C-N-CA 125.273 1.416 . . . . 4.54 111.514 169.432 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -57.04 -16.65 7.64 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 127.923 2.489 . . . . 6.1200000000000001 112.563 169.041 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 9.9 tpt -66.57 -28.04 68.21 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.642 1.577 . . . . 4.96 113.377 169.683 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.42 109.51 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 130.078 3.351 . . . . 8.3499999999999996 112.382 -171.139 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -50.04 -52.32 35.28 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.985 1.714 . . . . 5.3099999999999996 114.147 -170.948 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.9 t -73.11 -15.35 61.48 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 120.098 -1.626 . . . . 3.46 114.005 177.643 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 20.1 t -75.5 -10.48 59.49 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.661 1.118 . . . . 3.27 112.393 169.391 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 82.2 mt -70.92 -29.49 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-N 119.103 0.865 . . . . 1.4099999999999999 111.278 172.795 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.25 -32.51 70.06 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 118.775 0.716 . . . . 3.2000000000000002 111.38 174.537 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -81.38 -40.07 24.05 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.862 1.265 . . . . 2.6099999999999999 112.862 176.366 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.4 tt -66.26 -42.57 88.3 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 117.767 -1.111 . . . . 2.0099999999999998 111.503 176.493 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ppp? -65.04 -40.42 94.77 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.592 1.087 . . . . 2.04 110.084 177.013 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.48 -38.97 82.21 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.068 0.947 . . . . 3.52 112.375 172.173 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.3 t -57.98 -27.09 63.15 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.773 1.17 . . . . 2.4100000000000001 113.963 176.139 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 12.5 mt -74.27 -24.84 59.33 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.339 -0.85 . . . . 2.0 112.372 178.584 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -102.31 115.64 30.98 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.58 1.552 . . . . 2.3700000000000001 111.685 -154.702 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -81.5 -14.04 57.42 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.133 1.16 . . . . 3.8900000000000001 114.133 -169.585 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 36.9 p-10 -124.49 -10.56 7.4 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.519 1.528 . . . . 1.95 113.963 -178.097 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.3 m 58.57 42.27 21.01 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.516 1.527 . . . . 3.2000000000000002 111.861 -173.577 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.4 p30 -72.98 -29.24 62.9 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.073 1.749 . . . . 2.3599999999999999 111.347 -175.896 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 114.76 -6.2 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.456 1 C-N-CA 135.225 5.41 . . . . 4.4000000000000004 113.431 175.795 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -132.54 129.36 38.96 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.021 1.728 . . . . 4.1299999999999999 110.812 -168.506 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 10.6 mm -92.46 99.9 10.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 126.076 1.75 . . . . 1.0700000000000001 108.979 -173.02 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.92 161.91 6.07 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.727 2.011 . . . . 3.1600000000000001 111.467 165.624 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.404 ' CE1' ' HB3' ' B' ' 80' ' ' CYS . 0.3 OUTLIER -55.78 -43.0 76.35 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.658 -1.276 . . . . 2.2599999999999998 113.318 -177.537 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.558 ' HE2' ' SD ' ' B' ' 81' ' ' MET . 3.4 mtmt -73.3 -19.23 61.09 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 120.502 -1.374 . . . . 3.1000000000000001 112.964 176.415 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -69.25 -56.46 7.51 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 107.85 -1.167 . . . . 2.1000000000000001 107.85 166.074 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -58.03 -28.94 64.93 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 127.915 2.486 . . . . 2.1099999999999999 114.844 -177.976 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 53.1 m -53.04 -30.15 33.97 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 120.456 -1.402 . . . . 1.6799999999999999 113.048 168.122 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 97.8 t -65.58 -31.89 55.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 CA-C-N 120.251 1.387 . . . . 2.04 111.559 179.094 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -67.28 -51.56 51.4 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.122 0.969 . . . . 1.8300000000000001 109.473 176.396 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 59.9 mt -57.62 -37.1 72.7 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.859 1.264 . . . . 1.6200000000000001 111.647 174.253 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 28.0 m -66.48 -48.83 68.62 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.758 0.823 . . . . 0.87 111.023 176.082 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 19.4 ttp -62.93 -47.08 84.78 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.969 0.907 . . . . 2.4900000000000002 111.656 -177.038 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 97.4 mt -65.73 -43.41 89.13 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.318 0.647 . . . . 1.3200000000000001 112.203 177.385 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 7.7 t -65.21 -32.83 74.7 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 119.689 1.131 . . . . 1.8700000000000001 112.691 177.158 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 27.5 mtp -68.18 -34.62 76.63 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 118.689 -0.672 . . . . 1.78 112.546 170.864 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.63 -40.65 88.85 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.627 1.103 . . . . 0.94999999999999996 112.42 173.244 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -61.78 -24.6 66.94 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 113.56 0.948 . . . . 2.0099999999999998 113.56 172.002 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -72.95 -41.21 64.68 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.537 1.062 . . . . 2.0899999999999999 112.682 172.3 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -66.66 -37.57 85.07 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 118.569 0.622 . . . . 2.79 111.084 179.23 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.96 -55.43 23.55 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.968 1.307 . . . . 2.23 111.322 167.8 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -58.02 -26.73 62.8 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.263 1.425 . . . . 2.3500000000000001 113.127 -176.898 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 76.0 mt -75.64 -20.56 58.42 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.625 1.17 . . . . 1.51 113.657 175.454 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -91.52 -37.14 13.32 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.967 0.907 . . . . 3.52 113.359 169.067 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -62.75 -28.82 70.23 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.278 1.431 . . . . 3.5099999999999998 114.197 -175.845 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -88.91 -3.53 58.71 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.366 1.066 . . . . 2.9100000000000001 113.469 -176.596 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . 0.285 0.0 OUTLIER . . . . . 0 C--O 1.246 0.899 0 CA-C-O 116.055 -1.926 . . . . 3.9199999999999999 112.171 -155.709 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.911 0 N-CA-C 108.332 -0.988 . . . . 5.5899999999999999 108.332 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -138.61 148.15 43.76 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 126.957 2.103 . . . . 4.21 106.008 -164.735 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 3' ' ' THR . . . . . 0.505 HG21 ' HA ' ' A' ' 41' ' ' GLU . 72.4 p -59.04 162.92 6.4 Favored Pre-proline 0 N--CA 1.474 0.738 0 C-N-CA 123.708 0.803 . . . . 2.29 111.999 170.889 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -71.69 -17.18 29.77 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 121.944 1.762 . . . . 1.4399999999999999 113.371 -178.43 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tt -65.02 -39.04 92.81 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.402 1.001 . . . . 3.1099999999999999 111.57 176.081 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -60.24 -42.73 95.87 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.694 0.759 . . . . 4.9199999999999999 111.424 174.178 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -67.15 -29.88 69.71 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.065 -1.022 . . . . 4.4000000000000004 112.626 175.631 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.33 -42.99 82.67 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.734 1.214 . . . . 0.81999999999999995 110.744 171.837 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.83 -38.45 90.8 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.267 -0.895 . . . . 1.4399999999999999 112.026 173.92 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.15 -43.46 95.72 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.075 -1.016 . . . . 1.3100000000000001 111.286 171.187 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 93.8 m -57.62 -38.78 75.55 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.783 1.233 . . . . 1.23 111.425 -178.702 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -59.75 -38.83 82.86 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.758 1.022 . . . . 3.7200000000000002 113.758 172.87 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 21.1 t -69.88 -31.81 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 CA-C-N 119.627 1.103 . . . . 2.23 111.259 175.559 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 44.6 m -77.85 -30.28 50.9 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 126.947 2.099 . . . . 1.29 113.327 -174.807 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 12.7 p -78.13 -29.58 48.92 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.164 0.893 . . . . 1.6699999999999999 110.612 162.502 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.77 -57.29 13.3 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 118.261 0.482 . . . . 2.0600000000000001 110.59 -175.872 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 14.0 m80 -68.7 -8.62 44.3 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.673 1.36 . . . . 2.25 114.673 174.986 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -75.42 -49.97 17.28 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 120.903 -1.123 . . . . 4.1900000000000004 111.332 169.55 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -93.77 -23.99 17.97 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.185 0.994 . . . . 2.0 113.67 -174.104 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 97.6 p -65.59 -11.65 46.13 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 115.865 1.802 . . . . 2.8799999999999999 115.865 -175.578 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.79 -0.2 83.98 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-O 117.457 -1.746 . . . . 2.7999999999999998 114.344 171.769 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -62.43 -31.36 72.05 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 120.496 2.148 . . . . 3.3300000000000001 112.66 178.733 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -177.51 -148.84 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 128.71 2.804 . . . . 3.2200000000000002 108.939 165.385 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 26.29 87.43 0.01 OUTLIER Glycine 0 N--CA 1.477 1.376 0 C-N-CA 128.459 2.933 . . . . 4.3499999999999996 113.551 167.464 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 6.0 m 43.58 150.17 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 129.331 3.052 . . . . 3.4399999999999999 117.104 -172.001 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 71.8 tttt -80.32 -12.38 59.61 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 119.503 -1.998 . . . . 6.9299999999999997 113.579 179.53 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 62.7 tp -71.85 -54.56 9.71 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 119.265 0.939 . . . . 3.2200000000000002 109.828 164.058 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 35.8 p -93.94 162.43 13.9 Favored 'General case' 0 C--O 1.254 1.301 0 C-N-CA 125.503 1.521 . . . . 1.3200000000000001 114.832 -159.059 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 24.6 mt -105.87 86.59 2.41 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.422 2.289 . . . . 1.76 111.024 173.401 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 7.9 t -71.72 -178.41 2.25 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 119.768 -1.832 . . . . 2.9300000000000002 112.288 170.353 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -41.06 -60.2 1.28 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.634 1.574 . . . . 4.6900000000000004 114.758 -163.794 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.69 -32.7 58.06 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 120.12 1.327 . . . . 4.46 112.147 -174.398 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -52.5 -52.2 55.65 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.558 1.543 . . . . 1.8600000000000001 111.539 172.458 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.65 -48.21 80.32 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.919 1.288 . . . . 2.3999999999999999 111.748 -178.663 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -57.25 -46.14 83.3 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 121.018 -1.051 . . . . 4.5300000000000002 112.892 177.842 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -57.41 -47.57 81.38 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 118.074 -0.965 . . . . 3.0699999999999998 113.03 175.287 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.47 -53.09 40.86 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.619 1.168 . . . . 1.79 111.654 175.227 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 38.6 mt -55.78 -52.49 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 CA-C-N 118.949 0.795 . . . . 1.0700000000000001 109.18 177.581 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -66.94 -10.57 50.49 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 114.043 1.127 . . . . 4.8399999999999999 114.043 -174.917 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 34.6 mmtm -95.68 -39.22 10.0 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.584 1.954 . . . . 3.7200000000000002 113.392 176.649 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 41' ' ' GLU . . . . . 0.455 ' HA ' HG21 ' A' ' 3' ' ' THR . 20.7 mt-10 -118.71 -35.2 3.76 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 118.163 -0.922 . . . . 5.5099999999999998 113.066 -166.34 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -109.19 57.76 0.61 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.528 1.931 . . . . 2.6000000000000001 108.975 171.243 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 76.8 m -54.59 -56.46 18.7 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.061 -0.971 . . . . 4.1299999999999999 113.523 -167.169 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 95.7 mt 59.09 -23.89 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 129.256 3.023 . . . . 4.9199999999999999 118.973 164.437 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.44 -55.92 4.67 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 125.679 1.609 . . . . 3.8500000000000001 112.28 177.914 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -66.83 1.04 2.04 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.989 1.107 . . . . 5.6799999999999997 113.989 171.984 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.08 57.02 1.72 Allowed 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 125.008 2.337 . . . . 2.46 112.593 172.248 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -87.39 162.62 17.22 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 129.997 3.319 . . . . 4.1900000000000004 110.652 174.895 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -56.94 -36.46 70.27 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 120.761 -1.212 . . . . 4.0999999999999996 113.5 -173.389 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 7.0 m -72.08 -5.56 36.14 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 116.245 1.943 . . . . 2.9700000000000002 116.245 175.958 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 62.0 p -107.8 -39.69 5.49 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 120.426 1.466 . . . . 2.0299999999999998 111.516 165.982 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 11.8 mm -56.88 -49.3 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 126.678 1.991 . . . . 1.5600000000000001 113.245 176.759 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -76.31 -22.96 54.35 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.282 0.845 . . . . 3.1800000000000002 113.282 -166.891 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -77.77 -39.66 43.38 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.124 0.569 . . . . 3.7999999999999998 111.494 167.285 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.92 -42.83 90.63 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 122.994 0.518 . . . . 2.3900000000000001 110.537 174.707 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 7.2 tpt -57.77 -53.01 63.06 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.76 2.424 . . . . 1.97 112.137 169.171 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -54.76 -43.81 73.08 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 120.675 -1.266 . . . . 4.7699999999999996 112.646 174.444 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 73.4 m -82.46 -24.63 34.17 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.923 1.289 . . . . 2.1200000000000001 112.35 -171.067 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 mt -60.77 -57.79 11.21 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 126.445 1.898 . . . . 2.7000000000000002 110.942 157.192 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -89.92 65.75 6.73 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.645 1.578 . . . . 1.53 111.508 -168.721 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 61' ' ' LYS . . . . . 0.465 ' HE2' HG21 ' B' ' 74' ' ' VAL . 55.7 mttm -58.08 -31.91 67.54 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 115.177 1.547 . . . . 3.1499999999999999 115.177 -160.772 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -88.86 -5.49 57.99 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.288 1.218 . . . . 2.04 114.288 176.394 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 11.2 t 61.22 25.64 15.6 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.544 1.938 . . . . 2.29 114.065 178.838 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 55.7 p-10 -72.48 -16.15 61.8 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.838 1.255 . . . . 2.98 111.572 178.675 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 63.97 7.53 3.39 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 130.904 3.682 . . . . 4.4900000000000002 114.815 -177.485 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -89.92 127.73 36.07 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 107.053 -1.462 . . . . 3.0600000000000001 107.053 158.454 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 97.5 mt -111.81 110.35 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 N-CA-C 108.8 -0.815 . . . . 1.3300000000000001 108.8 169.68 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -87.58 164.31 16.16 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 128.577 2.751 . . . . 4.1799999999999997 110.54 166.514 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -43.73 -38.81 3.36 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.704 1.601 . . . . 2.4700000000000002 114.746 171.076 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 tpmt? -65.91 -28.42 68.92 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.04 0.936 . . . . 6.1600000000000001 112.938 179.834 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -85.27 -53.13 5.43 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.83 1.252 . . . . 2.02 109.858 167.517 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -47.63 -38.26 14.34 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 126.802 2.041 . . . . 2.5 114.603 -175.487 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 1.1 t -62.27 -17.13 57.7 Favored 'General case' 0 CA--C 1.549 0.904 0 O-C-N 120.342 -1.474 . . . . 3.1499999999999999 114.345 176.824 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.465 HG21 ' HE2' ' B' ' 61' ' ' LYS . 76.0 t -59.33 -45.1 93.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 O-C-N 120.269 -1.519 . . . . 1.5 110.991 169.75 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -60.29 -51.45 69.49 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.551 0.74 . . . . 1.71 110.249 175.893 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 31.9 mt -55.96 -39.28 71.52 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.745 0.818 . . . . 1.3700000000000001 112.383 176.576 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 95.0 m -60.61 -53.53 56.37 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.759 1.223 . . . . 0.89000000000000001 111.87 176.715 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 33.1 mtm -63.78 -36.33 83.52 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 118.727 0.694 . . . . 1.73 112.399 -177.134 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 82.1 mt -67.77 -45.82 73.81 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.91 0.884 . . . . 1.4199999999999999 111.947 176.814 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 80' ' ' CYS . . . . . 0.404 ' HB3' ' CE1' ' A' ' 69' ' ' PHE . 61.7 m -59.79 -37.63 79.67 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 118.083 -0.96 . . . . 1.5 112.719 173.744 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 81' ' ' MET . . . . . 0.558 ' SD ' ' HE2' ' A' ' 70' ' ' LYS . 21.9 mtp -66.44 -36.25 82.33 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.476 1.034 . . . . 2.5299999999999998 113.204 174.817 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.04 -47.65 73.67 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.856 0.753 . . . . 1.02 111.635 173.999 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -65.01 -30.46 71.44 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.429 0.9 . . . . 2.8100000000000001 113.429 176.354 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 26.5 t30 -61.84 -52.59 63.54 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 118.983 0.811 . . . . 3.0899999999999999 112.268 174.322 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -61.74 -47.22 86.21 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.229 1.411 . . . . 3.0 111.935 -179.774 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.27 -46.97 69.49 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.517 1.527 . . . . 3.4399999999999999 111.717 177.346 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -61.57 -29.93 70.33 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.347 1.059 . . . . 2.79 112.931 178.133 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 68.4 mt -77.19 -11.88 59.88 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.043 0.937 . . . . 2.3199999999999998 113.24 179.657 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.454 ' O ' ' HE2' ' B' ' 92' ' ' LYS . 24.4 mm-40 -106.13 0.84 25.75 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.54 1.536 . . . . 5.1500000000000004 114.72 170.992 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -110.64 -50.91 2.91 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.235 1.814 . . . . 2.9700000000000002 112.46 -178.406 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -90.38 14.74 12.1 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 125.358 1.463 . . . . 3.8999999999999999 113.623 -177.136 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 92' ' ' LYS . . . . . 0.454 ' HE2' ' O ' ' B' ' 89' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 115.814 -2.041 . . . . 5.0 115.974 -177.246 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.16 0 CA-C-O 117.606 -1.188 . . . . 8.5399999999999991 109.213 . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.67 171.68 14.31 Favored 'General case' 0 C--O 1.239 0.525 0 O-C-N 124.031 0.832 . . . . 5.9400000000000004 109.332 156.365 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.765 HG23 ' H ' ' A' ' 6' ' ' GLU . 3.5 t -55.58 146.91 42.39 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.425 1.49 . . . . 2.2999999999999998 112.751 178.465 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -62.35 -14.75 40.65 Favored 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 122.084 1.856 . . . . 1.72 112.69 169.345 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.401 HD12 HG21 ' B' ' 15' ' ' THR . 1.1 tt -76.99 -34.64 57.52 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.387 0.994 . . . . 2.3500000000000001 111.705 173.313 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.765 ' H ' HG23 ' A' ' 3' ' ' THR . 2.8 tm-20 -59.77 -47.08 87.13 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.618 1.099 . . . . 4.7999999999999998 108.835 166.375 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.42 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -59.03 -27.26 65.3 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.916 -1.115 . . . . 4.0099999999999998 112.685 175.176 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -75.1 -48.56 23.21 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.798 1.239 . . . . 1.1299999999999999 112.589 172.992 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.4 mt -57.99 -42.67 85.62 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.693 1.133 . . . . 1.6200000000000001 111.538 172.479 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 8.2 m -57.36 -51.54 69.0 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.346 1.858 . . . . 1.8600000000000001 111.137 170.555 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.7 m -58.78 -44.22 90.64 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.272 1.396 . . . . 1.51 111.731 178.112 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 5.8 tmm? -55.95 -58.82 6.29 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.615 0.766 . . . . 3.6800000000000002 110.538 172.609 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.1 p -66.78 -26.6 37.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 CA-C-N 119.769 1.168 . . . . 2.1699999999999999 112.931 -177.75 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 98.7 m -60.86 -61.27 2.7 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.399 1.079 . . . . 0.89000000000000001 109.71 175.878 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.78 -31.87 65.19 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-O 118.383 -0.817 . . . . 2.9199999999999999 109.954 -173.746 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -65.11 -50.43 66.12 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.115 0.87 . . . . 2.27 112.547 171.854 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -68.28 -19.69 64.72 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.061 0.846 . . . . 1.98 111.887 -178.05 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.8 mtpp -68.93 -53.47 20.73 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 120.822 -1.174 . . . . 3.5499999999999998 111.928 163.48 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -73.53 -32.75 64.38 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.689 1.366 . . . . 2.5 114.689 -175.981 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.5 p -67.41 -22.37 65.54 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 121.298 1.863 . . . . 2.4100000000000001 112.439 172.736 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.53 -2.68 82.05 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.169 1.366 . . . . 1.7 114.959 171.425 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.415 ' HE ' ' CD ' ' A' ' 36' ' ' GLU . 49.6 tpt85 -64.0 -19.17 64.98 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.53 1.665 . . . . 4.3499999999999996 114.943 -172.222 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -155.68 -178.71 7.48 Favored 'General case' 0 C--O 1.247 0.938 0 C-N-CA 129.701 3.2 . . . . 3.8100000000000001 107.808 165.673 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 24.96 99.41 0.01 OUTLIER Glycine 0 C--N 1.346 1.133 0 C-N-CA 126.946 2.212 . . . . 2.8500000000000001 114.651 149.364 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t 60.28 136.78 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.822 1.649 . . . . 2.71 112.819 -176.931 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -80.5 -9.72 59.76 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.933 1.086 . . . . 5.1500000000000004 113.933 171.244 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 73.9 mt -79.91 -40.0 29.17 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 118.986 0.812 . . . . 3.77 110.597 174.523 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.7 p -121.94 150.18 42.37 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-O 122.877 1.322 . . . . 1.4299999999999999 112.545 -161.645 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.51 120.85 43.05 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 114.041 -1.436 . . . . 2.6299999999999999 111.706 176.888 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.5 p -68.85 169.43 11.5 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.911 1.285 . . . . 2.9199999999999999 113.202 167.636 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 46.2 ttt85 -50.35 -26.77 5.27 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 115.549 1.685 . . . . 4.3799999999999999 115.549 176.656 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.86 -28.71 14.59 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.575 1.324 . . . . 4.3499999999999996 114.575 174.455 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -58.37 -52.44 65.59 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.563 1.074 . . . . 1.6100000000000001 109.021 163.615 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.9 tt -57.01 -45.89 82.73 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 128.142 2.577 . . . . 3.8500000000000001 112.168 175.573 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.3 ttmt -70.38 -38.19 74.67 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 118.692 0.678 . . . . 3.79 111.63 -178.871 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.415 ' CD ' ' HE ' ' A' ' 22' ' ' ARG . 25.2 tt0 -60.1 -47.63 85.09 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 118.265 -0.874 . . . . 4.7800000000000002 111.729 169.097 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 tt -56.17 -59.87 4.31 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.46 1.104 . . . . 2.4399999999999999 110.652 179.289 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.7 mt -63.63 -54.37 33.15 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.523 0 CA-C-O 118.626 -0.702 . . . . 1.55 109.408 -177.843 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.1 ttpp -72.0 -8.24 53.4 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 120.978 1.717 . . . . 4.1900000000000004 114.097 -172.691 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -90.77 -54.28 4.04 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 120.288 1.404 . . . . 4.5599999999999996 112.874 165.365 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -71.91 -33.24 68.14 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.82 1.191 . . . . 5.1100000000000003 111.511 -177.362 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.4 mt -111.53 65.32 0.62 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.81 1.644 . . . . 2.8100000000000001 109.42 163.401 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 15.2 t -75.33 36.12 0.12 Allowed 'General case' 0 CA--C 1.55 0.975 0 O-C-N 120.68 -1.263 . . . . 4.5700000000000003 112.798 172.619 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 31.3 mt -96.23 169.88 9.63 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.488 1.515 . . . . 4.8600000000000003 111.466 -175.398 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.43 -25.44 74.8 Favored Glycine 0 N--CA 1.475 1.278 0 C-N-CA 123.929 0.776 . . . . 3.73 112.502 -179.481 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -59.09 -34.51 72.08 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.752 2.021 . . . . 5.2999999999999998 111.402 173.58 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.53 66.34 2.77 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 124.511 2.101 . . . . 2.6499999999999999 112.878 -172.376 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 ptpp? -72.78 161.95 30.09 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 112.315 -2.22 . . . . 4.6100000000000003 110.692 156.39 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -49.38 -44.91 45.32 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 118.916 0.78 . . . . 5.4000000000000004 112.518 -179.253 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.2 m -61.33 -19.31 61.66 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.797 1.406 . . . . 3.04 114.797 178.558 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.8 m -83.85 -27.18 28.89 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.555 1.071 . . . . 2.6400000000000001 112.675 170.219 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 88.4 mt -80.91 -32.94 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 126.195 1.798 . . . . 2.1099999999999999 111.113 -178.88 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -61.93 -55.84 25.4 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.555 1.142 . . . . 3.8100000000000001 112.028 176.875 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -66.67 -26.16 66.91 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.764 0.653 . . . . 3.3599999999999999 112.764 177.163 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.1 tt -69.95 -38.92 76.28 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.354 -0.841 . . . . 2.9399999999999999 110.657 172.261 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.4 ttt -59.72 -49.59 77.14 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-O 117.85 -1.071 . . . . 2.3799999999999999 111.83 165.515 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -66.08 -22.97 66.43 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 121.171 1.805 . . . . 5.1900000000000004 113.124 179.041 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 29.0 t -81.15 -38.9 26.41 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.035 1.334 . . . . 2.23 112.043 176.545 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 84.3 mt -81.8 -44.98 16.23 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 119.065 0.848 . . . . 1.8100000000000001 112.153 175.593 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -77.51 63.72 2.71 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.96 1.304 . . . . 2.73 111.327 -177.379 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -58.73 -22.31 57.33 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 125.813 1.645 . . . . 4.5800000000000001 113.936 -172.923 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -106.87 0.83 24.22 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 114.703 1.371 . . . . 2.4100000000000001 114.703 173.569 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.5 t 62.0 27.61 16.73 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.868 1.432 . . . . 3.2799999999999998 114.868 169.201 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.3 p-10 -86.69 2.6 48.01 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.171 1.788 . . . . 2.2400000000000002 111.914 -174.742 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.69 1.34 3.96 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 129.813 3.245 . . . . 4.3399999999999999 113.565 -173.802 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -119.59 131.99 55.62 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 123.691 1.71 . . . . 3.25 111.251 -179.392 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 3.6 mp -110.01 106.55 20.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 N-CA-C 107.653 -1.24 . . . . 2.3199999999999998 107.653 171.536 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -79.75 166.06 22.16 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.404 1.481 . . . . 3.4500000000000002 110.923 168.471 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -45.29 -38.26 5.49 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.556 1.142 . . . . 2.1499999999999999 112.817 171.77 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.87 -26.98 68.56 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 115.287 1.588 . . . . 5.29 115.287 177.012 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -90.74 -47.06 7.86 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.488 1.915 . . . . 2.5600000000000001 109.414 170.789 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -57.97 -34.35 69.86 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 126.825 2.05 . . . . 2.5600000000000001 114.399 -173.84 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.6 t -59.21 -18.74 39.43 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.878 1.217 . . . . 1.8799999999999999 112.884 -178.163 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 84.9 t -65.49 -25.35 36.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.804 0.841 . . . . 2.0099999999999998 112.024 172.135 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -63.21 -52.66 61.35 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.071 1.348 . . . . 2.6200000000000001 110.226 173.093 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.1 mt -58.28 -39.7 79.94 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.423 1.089 . . . . 2.2200000000000002 110.06 177.34 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.6 m -62.82 -52.44 63.14 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 117.707 -1.14 . . . . 1.2 112.045 174.254 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 70.2 mtm -55.66 -45.43 77.71 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.876 1.216 . . . . 1.97 111.754 -179.553 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 47.4 mt -76.68 -40.57 48.44 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.806 0.842 . . . . 1.49 112.444 -177.098 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 42.4 t -62.54 -36.66 83.33 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.53 1.059 . . . . 2.04 111.943 171.469 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 83.2 mtp -64.27 -39.46 93.98 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.223 0.92 . . . . 2.1000000000000001 112.149 170.408 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.11 -45.98 82.9 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 119.293 0.951 . . . . 1.0600000000000001 112.164 177.351 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -64.52 -36.12 83.18 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.248 0.833 . . . . 2.48 113.248 175.136 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.83 -46.33 89.94 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.016 0.825 . . . . 2.4900000000000002 112.079 174.542 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -67.33 -37.32 83.12 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.953 -0.467 . . . . 2.8500000000000001 111.163 -177.943 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.93 -54.98 26.96 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.027 1.331 . . . . 2.04 111.053 169.727 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -60.84 -30.66 70.24 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.318 1.047 . . . . 2.3999999999999999 112.612 -175.852 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 69.6 mt -74.56 -15.36 60.85 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.042 0.937 . . . . 2.0800000000000001 113.243 176.052 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -97.8 -23.99 15.64 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.295 1.221 . . . . 3.29 114.295 167.633 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -72.47 -30.54 64.64 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.446 1.499 . . . . 4.0099999999999998 113.79 179.966 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -100.65 34.51 2.41 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.89 1.276 . . . . 2.8599999999999999 113.212 -169.559 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt . . . . . 0 C--O 1.252 1.23 0 C-N-CA 127.815 2.446 . . . . 3.3599999999999999 115.809 -173.366 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 15.1 mmt . . . . . 0 N--CA 1.476 0.847 0 N-CA-C 109.042 -0.725 . . . . 8.1999999999999993 109.042 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -90.68 158.54 16.85 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 127.45 2.3 . . . . 6.5800000000000001 109.876 179.975 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.07 154.75 13.95 Favored Pre-proline 0 N--CA 1.471 0.617 0 C-N-CA 129.445 3.098 . . . . 3.0699999999999998 111.559 166.156 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -69.39 -31.59 21.85 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.489 2.126 . . . . 2.8799999999999999 115.237 -156.337 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 8.5 tt -68.67 -54.38 16.61 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 120.351 1.432 . . . . 3.9399999999999999 111.378 171.856 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -57.66 -43.6 85.08 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.718 0.807 . . . . 6.1799999999999997 111.241 -178.545 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.36 -38.03 40.2 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 125.449 1.5 . . . . 4.3300000000000001 112.926 175.371 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.08 -43.58 61.64 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.604 0.761 . . . . 1.1899999999999999 110.409 179.981 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 73.2 mt -60.54 -36.39 78.34 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 123.513 0.725 . . . . 2.0499999999999998 112.088 174.051 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.4 m -55.19 -45.31 75.82 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 118.61 0.641 . . . . 1.48 112.074 170.338 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.4 t -72.35 -29.82 64.16 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.084 -0.96 . . . . 2.04 112.612 179.352 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 43.3 mtp -61.32 -51.61 68.12 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 118.151 -0.928 . . . . 3.0699999999999998 111.529 176.02 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 26.3 m -62.65 -33.28 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 CA-C-N 119.037 0.835 . . . . 2.52 112.15 176.592 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 54.0 m -67.93 -37.94 82.24 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.19 1.396 . . . . 1.03 113.049 -178.224 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 15' ' ' THR . . . . . 0.401 HG21 HD12 ' A' ' 5' ' ' LEU . 0.8 OUTLIER -70.59 -38.35 74.0 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 118.798 0.726 . . . . 1.6200000000000001 111.277 165.408 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -65.88 -49.68 67.21 Favored 'General case' 0 N--CA 1.462 0.139 0 O-C-N 123.929 0.768 . . . . 2.0600000000000001 111.439 -167.422 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -64.73 -23.49 67.27 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.903 0.774 . . . . 3.71 112.44 -179.095 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -78.81 -52.04 8.91 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.659 -0.651 . . . . 4.6200000000000001 111.45 178.187 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -66.86 -43.0 84.74 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.069 -1.019 . . . . 2.1200000000000001 112.137 178.181 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 83.8 p -74.9 -16.7 60.65 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.137 1.162 . . . . 1.4099999999999999 114.137 176.491 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.65 -23.56 49.74 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-O 117.683 -1.621 . . . . 1.54 113.748 170.881 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.92 -19.18 60.77 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 119.939 1.87 . . . . 4.6100000000000003 114.037 -165.442 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -124.49 122.67 38.26 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 119.096 0.862 . . . . 3.77 108.875 169.805 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.11 -1.23 2.87 Favored Glycine 0 N--CA 1.477 1.428 0 C-N-CA 127.968 2.699 . . . . 3.1899999999999999 117.793 -144.718 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 52.8 p -56.66 75.74 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.973 0 CA-C-O 121.463 0.649 . . . . 5.5999999999999996 109.885 141.986 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -75.87 118.98 19.23 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 119.657 -1.902 . . . . 6.2999999999999998 111.208 -173.0 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 86.3 mt 96.37 -8.2 0.08 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 130.376 3.47 . . . . 4.5800000000000001 112.751 -179.361 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 45.2 p -108.19 144.09 36.1 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 124.904 1.282 . . . . 1.8899999999999999 111.635 168.047 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 29.1 mt -97.73 114.21 26.16 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.388 1.875 . . . . 1.72 112.527 177.361 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 20.3 p -68.86 167.86 14.72 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.533 1.533 . . . . 3.5600000000000001 113.798 165.292 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -58.58 -0.62 0.11 Allowed 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 115.958 1.836 . . . . 4.0899999999999999 115.958 172.554 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.0 -44.79 3.24 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.577 1.551 . . . . 3.8700000000000001 112.819 169.693 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -54.08 -44.97 71.63 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.478 1.036 . . . . 1.9299999999999999 109.538 171.819 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 56.1 tp -67.6 -44.08 78.95 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.599 1.559 . . . . 2.4100000000000001 112.448 179.449 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -55.39 -43.7 75.44 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.856 -0.592 . . . . 3.3300000000000001 111.147 172.537 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -60.73 -52.92 63.07 Favored 'General case' 0 C--O 1.224 -0.279 0 O-C-N 123.824 0.702 . . . . 2.8399999999999999 110.761 178.085 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.6 tt -59.14 -58.89 6.65 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.668 1.187 . . . . 2.1600000000000001 110.565 -178.534 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 25.7 mt -54.56 -46.47 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 119.304 0.956 . . . . 1.05 110.073 179.159 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -74.32 -17.91 60.78 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 115.111 1.522 . . . . 6.1500000000000004 115.111 -177.354 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -93.15 -14.32 27.34 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.358 1.863 . . . . 3.4199999999999999 112.66 171.811 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -96.54 -37.09 10.53 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.13 1.772 . . . . 5.21 111.537 176.497 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -127.33 120.86 29.52 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.637 1.575 . . . . 2.04 109.446 174.152 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 4.7 t -131.58 -9.42 3.62 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 115.255 1.576 . . . . 3.4500000000000002 115.255 174.088 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -47.46 -16.19 0.06 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 128.654 2.782 . . . . 3.5499999999999998 118.432 175.878 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.88 169.05 12.62 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-N 120.106 1.321 . . . . 3.5699999999999998 114.711 178.295 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 26.0 tp10 62.98 -22.19 0.05 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 129.775 3.23 . . . . 5.5300000000000002 117.203 172.776 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 32.9 tpp -75.74 82.11 2.7 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.459 -1.401 . . . . 2.4700000000000002 111.332 -179.621 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 41.9 mttt -89.45 173.98 8.04 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.668 2.387 . . . . 3.7599999999999998 110.771 179.753 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 44.8 tp10 -48.79 -52.72 22.44 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.856 0.862 . . . . 3.8700000000000001 111.202 171.574 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 2.8 m -64.67 -27.61 69.04 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.372 1.249 . . . . 3.1699999999999999 114.372 177.417 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 3.8 m -74.0 -31.72 63.07 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.399 -0.813 . . . . 2.9399999999999999 111.479 176.828 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 28.9 mm -68.72 -38.47 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.66 0.784 . . . . 1.46 111.11 171.575 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -70.55 -43.68 69.03 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.654 0.983 . . . . 3.3599999999999999 113.654 -167.542 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.99 -27.43 26.45 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 113.474 0.916 . . . . 3.7799999999999998 113.474 175.748 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 60.6 tp -56.22 -48.42 76.49 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 118.661 -0.685 . . . . 2.0 110.199 167.82 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.9 ppp? -62.03 -32.17 72.64 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.605 1.093 . . . . 2.79 113.681 -177.154 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 44.9 mttp -65.59 -25.25 67.32 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.041 0.837 . . . . 5.8499999999999996 112.685 174.494 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.1 t -92.17 -32.29 15.15 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.928 1.291 . . . . 1.96 113.896 177.007 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 69.3 mt -74.43 -25.44 59.45 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.947 0.899 . . . . 2.1699999999999999 112.81 175.143 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -80.81 121.5 26.02 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 122.457 1.122 . . . . 1.3799999999999999 111.013 174.32 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -85.57 -13.77 47.83 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.059 1.133 . . . . 5.8799999999999999 114.059 -156.533 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 45.5 p-10 -141.95 -6.46 0.97 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.385 2.274 . . . . 2.52 115.324 -169.566 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 68.73 43.59 1.26 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.927 1.291 . . . . 2.27 113.098 -175.086 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 40.0 p30 -87.96 -16.86 32.62 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.941 1.297 . . . . 2.1899999999999999 112.004 165.027 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 70.47 14.78 7.33 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 130.258 3.423 . . . . 6.6900000000000004 114.819 179.099 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -124.26 143.79 50.34 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.362 1.065 . . . . 3.6099999999999999 110.665 161.36 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 6.3 mm -97.34 105.38 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 O-C-N 121.33 -0.856 . . . . 1.4299999999999999 110.143 179.135 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.02 155.69 39.93 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.998 1.319 . . . . 2.8999999999999999 111.437 166.355 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -46.44 -47.2 19.1 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.711 1.374 . . . . 3.4399999999999999 114.711 177.224 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . 0.301 0.3 OUTLIER -85.38 -1.15 56.7 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 120.329 -1.482 . . . . 4.6500000000000004 114.598 177.688 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -77.03 -53.85 7.29 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 108.866 -0.79 . . . . 2.2400000000000002 108.866 152.15 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -52.82 -29.84 30.0 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 127.579 2.352 . . . . 2.29 115.272 -173.827 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 26.8 t -57.14 -21.63 34.04 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 120.588 -1.32 . . . . 1.74 113.679 170.589 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 87.5 t -66.83 -45.88 86.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 120.109 1.322 . . . . 2.23 110.666 174.991 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.454 ' CZ ' HD11 ' B' ' 79' ' ' LEU . 30.1 t80 -56.38 -46.39 80.12 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.146 0.978 . . . . 1.7 111.512 172.532 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 33.7 mt -61.19 -41.88 97.59 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.426 -0.797 . . . . 1.79 111.533 178.231 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 93.7 m -56.53 -49.9 73.41 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.307 0.958 . . . . 1.3300000000000001 111.883 171.333 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 76.7 mtp -60.35 -46.4 90.05 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.838 0.744 . . . . 2.2999999999999998 111.922 -177.895 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.454 HD11 ' CZ ' ' B' ' 75' ' ' PHE . 82.3 mt -62.35 -50.67 70.65 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.064 0.546 . . . . 1.98 110.884 175.172 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 88.2 m -59.11 -33.02 70.36 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.151 0.887 . . . . 2.5499999999999998 113.279 179.942 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 63.8 mtt -74.45 -34.67 63.23 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.043 0.937 . . . . 3.9900000000000002 113.468 172.78 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.79 -41.35 71.76 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.737 1.153 . . . . 1.3200000000000001 111.662 176.446 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -57.52 -23.22 49.0 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.781 1.232 . . . . 2.8900000000000001 112.636 172.912 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -67.75 -42.72 81.36 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.178 -0.952 . . . . 2.0699999999999998 111.782 173.629 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -80.94 -32.63 34.51 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.291 1.036 . . . . 2.6400000000000001 111.563 -177.816 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -54.91 -37.28 66.16 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.255 1.822 . . . . 2.8900000000000001 111.644 166.56 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -74.27 -16.68 60.94 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.838 1.255 . . . . 2.0800000000000001 113.042 174.946 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 6.7 mp -79.29 -25.94 42.36 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 120.489 -1.382 . . . . 3.0 113.107 168.906 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -62.55 -22.03 66.03 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 113.187 0.81 . . . . 7.3300000000000001 113.187 169.87 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -85.33 -56.6 3.45 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.174 1.79 . . . . 4.1399999999999997 111.285 171.575 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.15 -8.24 29.58 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 115.472 1.656 . . . . 3.6099999999999999 115.472 -173.002 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.971 0 C-N-CA 126.608 1.963 . . . . 5.5899999999999999 115.691 -179.43 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.2 mmt . . . . . 0 N--CA 1.475 0.818 0 N-CA-C 109.732 -0.47 . . . . 6.1200000000000001 109.732 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -154.59 155.11 34.16 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 129.077 2.951 . . . . 6.0700000000000003 103.958 -166.233 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.41 162.71 13.57 Favored Pre-proline 0 N--CA 1.475 0.823 0 O-C-N 121.68 -0.638 . . . . 1.47 110.345 169.376 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.75 -21.22 21.88 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 121.447 1.431 . . . . 1.3300000000000001 111.569 173.731 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -77.08 -43.27 34.95 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.903 1.681 . . . . 3.1899999999999999 112.386 176.442 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -51.05 -49.36 60.72 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.887 0.875 . . . . 3.7400000000000002 109.249 168.015 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -64.44 -38.1 89.84 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 120.889 -1.132 . . . . 3.9100000000000001 113.781 174.952 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.04 -52.19 64.93 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.605 1.093 . . . . 0.96999999999999997 112.306 178.986 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.0 mt -66.64 -31.98 73.01 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.156 0.582 . . . . 2.0600000000000001 111.895 176.873 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.2 m -58.71 -52.05 67.36 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 117.899 -1.048 . . . . 1.6200000000000001 111.378 166.969 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 49.9 m -55.84 -41.27 74.05 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.918 1.235 . . . . 1.24 111.632 179.868 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 75.4 mmm -58.09 -54.43 47.08 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 122.951 0.501 . . . . 3.6800000000000002 111.495 174.521 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.4 t -63.96 -31.97 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 CA-C-N 119.019 0.827 . . . . 2.1699999999999999 112.083 179.03 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.7 m -64.0 -57.67 9.0 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.358 1.463 . . . . 0.75 111.244 -179.395 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 t -67.07 -36.1 81.26 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 118.854 -0.593 . . . . 2.9900000000000002 109.601 178.363 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -56.39 -48.07 77.64 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-O 117.746 -1.121 . . . . 1.8100000000000001 110.935 175.632 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.1 m80 -60.99 -43.65 98.56 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 120.816 1.643 . . . . 2.1800000000000002 112.584 173.283 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -62.69 -23.1 66.96 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.145 1.378 . . . . 4.1699999999999999 114.311 -176.069 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -95.38 -47.73 6.17 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.537 1.062 . . . . 2.7400000000000002 111.191 161.891 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.408 ' HA ' ' OE1' ' A' ' 33' ' ' GLU . 15.7 t -54.38 -39.25 67.03 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.461 1.904 . . . . 1.8500000000000001 115.286 -168.689 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.86 7.37 42.95 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 125.43 1.491 . . . . 2.48 115.472 179.747 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 -118.57 96.66 5.38 Favored 'General case' 0 C--O 1.221 -0.424 0 N-CA-C 106.854 -1.535 . . . . 4.21 106.854 174.994 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 88.26 148.67 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 127.897 2.479 . . . . 3.6499999999999999 111.623 -168.896 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.9 -145.44 49.76 Favored Glycine 0 CA--C 1.526 0.741 0 C-N-CA 124.182 0.896 . . . . 2.6499999999999999 112.168 177.155 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.4 m -88.35 164.53 15.5 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 122.085 -0.656 . . . . 3.0099999999999998 112.466 170.199 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -16.13 63.24 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 114.499 1.296 . . . . 7.9699999999999998 114.499 179.42 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.446 ' H ' HD23 ' A' ' 27' ' ' LEU . 2.5 pt? -117.13 10.95 14.02 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.496 1.919 . . . . 3.46 112.497 179.209 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.2 p -122.53 134.43 54.55 Favored 'General case' 0 C--O 1.249 1.043 0 N-CA-C 114.421 1.267 . . . . 1.0900000000000001 114.421 171.97 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 69.8 mt -95.62 104.27 16.18 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.413 1.085 . . . . 1.7 109.821 167.488 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.0 t -58.71 150.49 23.38 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.421 -0.799 . . . . 1.8500000000000001 109.965 161.284 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 34.3 ttp85 -45.47 -30.31 1.37 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 115.831 1.789 . . . . 3.1299999999999999 115.831 -172.56 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -36.9 38.87 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.029 1.122 . . . . 3.9500000000000002 114.029 176.012 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.408 ' OE1' ' HA ' ' A' ' 20' ' ' SER . 20.1 mt-10 -59.34 -50.63 73.22 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.827 0.851 . . . . 1.54 109.351 169.685 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.3 tp -57.84 -46.61 84.51 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.405 1.082 . . . . 1.8600000000000001 111.902 178.032 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -49.34 -50.88 37.76 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.395 1.078 . . . . 3.9900000000000002 112.92 -178.373 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -89.6 -11.96 41.12 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 115.25 1.574 . . . . 4.54 115.25 -178.678 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.4 tt -63.81 -60.93 2.67 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 120.063 1.301 . . . . 1.96 109.432 160.285 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.3 mt -58.03 -43.18 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 N-CA-C 110.215 -0.291 . . . . 0.95999999999999996 110.215 -175.353 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.8 mtpt -64.25 -12.15 38.37 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 114.15 1.166 . . . . 4.7000000000000002 114.15 -179.492 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -109.15 -24.02 11.35 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.186 1.794 . . . . 4.3899999999999997 112.335 -178.392 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 72.4 mt-10 -65.93 -48.07 72.63 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.793 1.178 . . . . 3.9900000000000002 111.372 163.056 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 77.3 mt -124.68 149.74 46.86 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.629 1.572 . . . . 2.4100000000000001 111.419 -163.516 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 1.7 t -156.01 11.86 0.3 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.149 1.38 . . . . 3.8300000000000001 112.713 179.184 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.97 28.79 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 126.382 1.873 . . . . 3.8700000000000001 116.005 178.034 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.5 -49.86 3.69 Favored Glycine 0 N--CA 1.474 1.201 0 C-N-CA 125.924 1.726 . . . . 2.9100000000000001 115.033 170.17 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.59 -35.3 80.56 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.841 1.257 . . . . 7.6600000000000001 112.7 -177.62 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 45.2 tpp -83.86 68.82 10.1 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 123.053 1.406 . . . . 2.3199999999999998 112.597 -179.025 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -66.14 163.27 17.98 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.227 1.411 . . . . 5.4299999999999997 112.726 174.59 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.59 -46.64 14.43 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.832 0.853 . . . . 4.7599999999999998 111.452 160.768 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.1 t -70.45 -37.71 74.38 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 114.852 1.427 . . . . 2.4100000000000001 114.852 175.077 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.0 m -62.91 -32.53 73.83 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 121.148 1.794 . . . . 1.9299999999999999 111.636 176.871 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.3 mt -63.85 -30.53 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 124.795 1.238 . . . . 1.6799999999999999 113.765 179.917 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -81.08 -24.45 37.77 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.813 1.188 . . . . 3.3900000000000001 112.64 -179.739 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -73.84 -42.15 61.25 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.406 -0.809 . . . . 3.0699999999999998 111.0 168.165 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 43.3 tp -57.75 -45.37 85.97 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.886 1.274 . . . . 2.0699999999999998 110.758 168.581 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -56.75 -47.2 80.59 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 125.543 1.537 . . . . 2.1200000000000001 110.886 175.315 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -26.34 64.75 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 121.205 -0.934 . . . . 3.9700000000000002 113.405 174.113 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 t -88.68 -32.8 17.81 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 120.714 -1.242 . . . . 2.23 113.468 176.917 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.441 ' CD2' ' HA ' ' A' ' 72' ' ' TYR . 7.1 mt -58.42 -50.59 73.16 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.815 1.246 . . . . 2.6400000000000001 110.938 165.06 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -102.57 76.47 1.53 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.375 1.87 . . . . 1.8899999999999999 112.791 -161.78 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -60.42 -21.33 62.12 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 113.67 0.989 . . . . 3.04 113.67 -167.689 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 51.6 p30 -100.5 -8.29 23.28 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.662 1.585 . . . . 2.2000000000000002 114.351 177.657 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 73.4 m 54.89 33.64 20.38 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.201 1.4 . . . . 2.5499999999999998 114.069 -174.687 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.4 p30 -71.02 -15.54 62.56 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.547 1.539 . . . . 2.1400000000000001 111.872 176.35 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 66.04 4.53 3.1 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 131.558 3.943 . . . . 4.0300000000000002 116.131 -174.9 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -103.99 126.86 51.43 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 127.193 2.197 . . . . 2.52 109.056 167.527 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 1.6 mm -104.3 100.74 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 O-C-N 120.953 -1.092 . . . . 1.05 111.024 -175.041 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -75.28 156.86 35.2 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 127.421 2.289 . . . . 2.54 111.275 170.561 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -45.41 -41.36 9.14 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.125 1.528 . . . . 3.5499999999999998 115.125 -179.994 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.6 pttm -80.14 -10.22 59.75 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 113.912 1.078 . . . . 3.23 113.912 -178.595 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -80.93 -53.67 6.24 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 108.043 -1.095 . . . . 1.79 108.043 158.278 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.441 ' HA ' ' CD2' ' A' ' 59' ' ' LEU . 30.9 t80 -54.48 -36.38 64.07 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.343 2.257 . . . . 2.79 116.178 -170.891 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.6 p -67.69 -23.12 65.26 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 120.725 -1.234 . . . . 2.29 112.79 -170.77 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 p -60.74 -28.13 42.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 CA-C-N 118.56 0.618 . . . . 2.2200000000000002 112.586 176.517 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -74.72 -58.9 3.0 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.921 0.889 . . . . 2.3100000000000001 110.469 -175.752 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.494 ' H ' HD23 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -61.83 -24.53 66.94 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 118.045 -0.978 . . . . 2.0299999999999998 113.126 172.452 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 53.7 m -58.59 -53.72 55.21 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.874 0.87 . . . . 0.84999999999999998 110.946 165.411 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 61.8 mtm -60.95 -40.18 92.31 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.822 0.737 . . . . 1.49 112.356 178.451 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 60.7 mt -60.09 -51.42 69.69 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.784 0.72 . . . . 1.48 110.729 174.698 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 82.0 m -63.84 -35.07 79.41 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.098 0.777 . . . . 1.8400000000000001 113.098 178.024 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 75.3 mtp -62.81 -44.35 96.38 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.892 1.224 . . . . 2.0800000000000001 111.325 171.57 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.44 -47.82 82.39 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.932 -0.556 . . . . 0.82999999999999996 111.452 177.249 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -62.85 -32.16 73.33 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.941 0.792 . . . . 3.1299999999999999 113.085 177.005 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -67.74 -39.98 84.17 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 119.88 1.218 . . . . 2.2599999999999998 111.358 177.133 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -72.69 -39.47 67.0 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.001 0.819 . . . . 2.98 110.965 178.465 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -53.62 -42.34 67.63 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.008 1.723 . . . . 2.3900000000000001 111.464 170.653 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -58.92 -29.31 66.99 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.23 1.012 . . . . 2.4199999999999999 112.886 -179.448 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.9 mp -74.7 -23.55 58.62 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.57 0.748 . . . . 2.23 112.916 174.494 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -91.82 -14.58 29.53 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.809 1.644 . . . . 2.6499999999999999 114.359 175.858 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -98.98 -30.08 12.55 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 128.045 2.538 . . . . 3.71 113.067 -170.475 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -98.54 20.5 12.7 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.316 1.446 . . . . 3.21 112.125 179.412 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 81.6 tttt . . . . . 0 C--O 1.25 1.11 0 C-N-CA 129.563 3.145 . . . . 4.21 115.873 -161.845 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 7.7 ttp . . . . . 0 N--CA 1.483 1.196 0 CA-C-O 119.893 -0.098 . . . . 7.4100000000000001 111.235 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 46.38 -90.81 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 128.062 2.545 . . . . 6.79 117.6 154.631 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 17.2 p -102.06 155.87 35.92 Favored Pre-proline 0 N--CA 1.469 0.476 0 C-N-CA 124.253 1.021 . . . . 1.8300000000000001 113.037 -153.002 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -62.75 -18.93 66.87 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.701 2.267 . . . . 2.3900000000000001 112.257 166.713 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 9.7 tt -68.39 -51.99 37.94 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-O 118.482 -0.771 . . . . 2.7400000000000002 110.387 166.477 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.05 -30.62 71.74 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.755 1.161 . . . . 3.79 111.974 176.973 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -33.54 68.18 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 119.523 -1.986 . . . . 5.3300000000000001 111.963 172.494 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.03 -40.03 94.23 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 119.691 1.132 . . . . 1.8100000000000001 112.648 169.76 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 68.2 mt -64.77 -35.55 81.45 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.287 0.949 . . . . 2.1800000000000002 111.872 171.018 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 36.5 m -60.96 -52.01 66.83 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 118.061 -0.971 . . . . 1.3500000000000001 110.182 170.416 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 93.1 m -50.93 -38.75 52.23 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.069 1.348 . . . . 1.6499999999999999 111.802 175.776 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 5.1 ttp -53.45 -51.52 62.41 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.585 0.754 . . . . 3.3900000000000001 112.022 174.229 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 34.5 m -74.66 -27.84 21.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 N-CA-C 113.251 0.834 . . . . 2.25 113.251 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 17.9 m -59.22 -54.84 42.37 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.656 1.182 . . . . 1.29 110.745 176.446 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.93 -32.12 51.41 Favored 'General case' 0 C--O 1.224 -0.252 0 O-C-N 123.62 0.575 . . . . 3.6499999999999999 110.463 -175.989 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -54.49 -44.52 72.72 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.312 0.505 . . . . 1.96 110.718 172.418 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.21 -27.32 63.79 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.821 1.415 . . . . 2.02 114.821 179.04 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -63.71 -45.6 89.26 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 120.833 -1.167 . . . . 5.0700000000000003 111.537 172.541 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.503 ' CD2' HD13 ' B' ' 37' ' ' LEU . 21.5 m-85 -87.7 -10.27 51.7 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.428 1.091 . . . . 2.0299999999999998 113.098 -178.383 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 68.2 m -58.05 -56.52 20.96 Favored 'General case' 0 C--O 1.241 0.624 0 O-C-N 120.883 -1.136 . . . . 1.8300000000000001 112.009 164.018 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.12 -20.31 53.24 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-O 117.407 -1.774 . . . . 2.52 114.77 -168.439 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -47.85 -46.51 31.2 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.402 1.481 . . . . 3.7799999999999998 113.118 -169.572 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 57.0 mp0 -130.74 153.53 48.92 Favored 'General case' 0 C--O 1.248 0.981 0 CA-C-O 124.014 1.864 . . . . 3.5899999999999999 111.912 167.744 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.92 -8.15 2.65 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.32 1.438 . . . . 2.3700000000000001 113.903 -172.309 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 15.1 m 57.1 -142.83 0.73 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.485 1.114 . . . . 6.1500000000000004 109.781 -159.782 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 24.1 mttt 68.25 -172.48 0.19 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.274 1.83 . . . . 11.44 112.541 172.522 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 mp -82.91 -0.8 50.1 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.829 1.251 . . . . 3.71 112.843 173.683 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 21.8 p -113.57 152.47 30.25 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 115.765 1.765 . . . . 1.1200000000000001 115.765 -155.578 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -101.43 108.39 19.97 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 127.205 2.202 . . . . 2.0899999999999999 113.022 -172.215 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 12.9 t -84.1 162.46 20.29 Favored 'General case' 0 C--N 1.315 -0.896 0 O-C-N 120.247 -1.533 . . . . 2.0899999999999999 112.16 176.835 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 24.0 ttt85 -45.14 -41.11 7.69 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.603 1.561 . . . . 4.0099999999999998 114.426 -178.17 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.82 -36.36 42.71 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.898 -1.126 . . . . 6.3099999999999996 113.277 174.279 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -60.5 -46.11 91.32 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 120.041 1.291 . . . . 1.8 110.393 176.349 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 8.2 tp -65.69 -36.78 84.61 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.008 1.723 . . . . 1.9399999999999999 113.076 178.7 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -64.91 -28.03 69.26 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.362 1.065 . . . . 5.2599999999999998 112.363 174.506 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.03 -77.19 0.08 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.061 -0.971 . . . . 3.2400000000000002 108.541 158.822 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 37' ' ' LEU . . . . . 0.503 HD13 ' CD2' ' B' ' 19' ' ' TYR . 23.3 tp -48.69 -43.2 36.79 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.276 1.83 . . . . 2.1000000000000001 114.502 -163.684 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 58.6 mt -57.15 -64.51 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 120.191 1.36 . . . . 1.3 107.49 174.474 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 25.4 mtpt -62.09 -26.37 68.25 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.398 0.888 . . . . 4.6100000000000003 113.398 -174.803 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.73 -36.48 50.8 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.113 1.765 . . . . 5.7699999999999996 113.308 -179.534 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -122.17 -29.48 4.19 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.145 1.165 . . . . 6.04 114.145 -170.189 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -118.36 79.44 1.38 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.168 1.787 . . . . 3.9199999999999999 107.098 169.446 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 93.4 m -68.53 -47.81 65.96 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.36 -0.836 . . . . 3.9500000000000002 112.448 -155.722 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 6.7 mp 61.84 -34.86 0.11 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 129.755 3.222 . . . . 5.2999999999999998 118.604 170.519 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.68 -51.22 4.39 Favored Glycine 0 N--CA 1.473 1.164 0 C-N-CA 126.598 2.047 . . . . 2.6899999999999999 112.788 174.411 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -68.72 -4.36 15.58 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.497 1.119 . . . . 5.2000000000000002 112.217 168.322 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.55 63.84 0.42 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 124.542 2.115 . . . . 2.29 111.063 163.698 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -76.46 147.89 37.59 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 127.269 2.228 . . . . 3.7799999999999998 109.147 174.457 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.16 -37.1 66.56 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.674 1.361 . . . . 4.8300000000000001 114.674 -157.348 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 8.5 t -74.74 -24.17 58.68 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.884 1.439 . . . . 2.6800000000000002 114.884 174.389 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 4.8 m -63.55 -18.23 63.63 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 120.06 1.3 . . . . 2.2999999999999998 111.957 173.895 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 42.7 mm -67.62 -25.7 33.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 C-N-CA 124.805 1.242 . . . . 1.5800000000000001 111.834 174.299 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -70.75 -34.45 71.85 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.958 0.799 . . . . 5.0599999999999996 111.944 173.391 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.61 -32.95 47.73 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.203 1.001 . . . . 3.54 111.732 174.821 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.87 -44.38 93.25 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 118.414 -0.803 . . . . 2.48 111.211 167.453 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 14.0 mtp -57.64 -49.35 76.76 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.86 1.209 . . . . 1.8 110.71 171.453 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -60.87 -29.32 69.47 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.303 1.441 . . . . 3.4700000000000002 113.142 -178.607 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 33.2 t -76.09 -22.03 56.05 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 115.086 1.513 . . . . 3.5299999999999998 115.086 172.021 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mp -109.21 -45.91 3.66 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.736 1.614 . . . . 3.0600000000000001 114.775 -172.401 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -85.11 88.49 7.47 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.485 1.514 . . . . 1.6000000000000001 111.26 -163.587 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -62.82 -29.36 70.66 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.614 1.565 . . . . 5.1100000000000003 114.634 -173.431 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -85.04 -16.31 41.15 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 117.83 -1.081 . . . . 2.0499999999999998 112.711 169.059 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 20.6 m 49.64 66.1 1.22 Allowed 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 126.261 1.825 . . . . 3.9199999999999999 112.28 176.224 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -136.69 -102.12 0.2 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.377 0.671 . . . . 3.29 110.804 -148.851 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -145.19 -10.17 0.57 Allowed 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 115.592 1.701 . . . . 6.1500000000000004 115.592 167.17 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -137.87 146.12 43.0 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 125.357 1.463 . . . . 2.3900000000000001 112.961 175.541 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 2.6 mt -100.02 109.3 24.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 C-N-CA 127.89 2.476 . . . . 1.4399999999999999 107.284 173.321 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.07 160.2 30.02 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.752 1.621 . . . . 2.4900000000000002 111.181 168.334 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -56.46 -31.26 63.81 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 121.078 -1.014 . . . . 2.3999999999999999 112.999 -174.463 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.6 -11.06 43.74 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.304 1.841 . . . . 3.5899999999999999 112.81 -179.465 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -75.02 -57.18 4.06 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 108.468 -0.938 . . . . 1.6899999999999999 108.468 153.494 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -54.84 -24.88 25.15 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.653 2.381 . . . . 1.8500000000000001 115.663 -174.607 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 1.8 m -49.54 -31.08 9.61 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 120.754 -1.216 . . . . 2.4700000000000002 112.689 170.121 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 95.4 t -74.21 -25.46 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.159 0.583 . . . . 1.6499999999999999 111.959 -179.777 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -61.31 -56.98 14.29 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-N 119.199 0.908 . . . . 2.7599999999999998 111.037 171.039 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 76' ' ' LEU . . . . . 0.524 HD22 ' H ' ' B' ' 76' ' ' LEU . 2.7 mm? -56.75 -45.57 81.95 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.51 0.724 . . . . 3.04 110.772 179.242 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 76.4 m -53.19 -54.5 35.02 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.118 1.367 . . . . 1.1899999999999999 112.154 176.707 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 12.7 tmm? -65.73 -43.99 87.39 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.948 1.299 . . . . 3.2799999999999998 112.412 -176.293 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -55.27 -50.4 69.62 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.631 0.772 . . . . 2.23 110.978 170.149 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 9.6 t -61.71 -36.11 79.98 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.117 0.784 . . . . 2.6800000000000002 113.117 -179.254 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 94.0 mtp -67.79 -35.95 79.59 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.244 1.017 . . . . 2.46 113.004 173.926 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.91 -30.27 50.53 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 119.453 1.024 . . . . 1.1599999999999999 112.969 175.623 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -74.75 -18.39 60.5 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.668 -1.27 . . . . 2.9199999999999999 111.719 -177.537 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -55.9 -32.97 64.21 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.527 1.531 . . . . 2.5699999999999998 114.055 161.262 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -105.9 -28.94 10.3 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 127.408 2.283 . . . . 3.04 112.126 -167.752 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.67 -41.14 61.16 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.382 1.073 . . . . 3.1099999999999999 110.369 159.336 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -65.94 -24.23 66.77 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.288 1.835 . . . . 2.54 113.218 173.099 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 75.1 mt -90.05 -3.68 57.81 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.453 1.501 . . . . 2.9199999999999999 113.935 178.306 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.454 ' CD ' ' HZ3' ' B' ' 92' ' ' LYS . 72.4 mm-40 -90.45 -4.72 56.8 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.085 0.954 . . . . 3.8900000000000001 112.685 162.014 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -119.02 -66.96 1.02 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.335 1.454 . . . . 3.0499999999999998 111.268 -174.798 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -81.75 47.83 1.13 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.401 1.481 . . . . 3.3300000000000001 111.372 169.544 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 92' ' ' LYS . . . . . 0.454 ' HZ3' ' CD ' ' B' ' 89' ' ' GLU . 22.2 tttp . . . . . 0 C--O 1.251 1.148 0 C-N-CA 129.748 3.219 . . . . 5.0199999999999996 115.839 -173.316 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.9 ttp . . . . . 0 N--CA 1.485 1.302 0 N-CA-C 111.498 0.184 . . . . 5.9100000000000001 111.498 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 57.63 -71.17 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 118.412 2.745 . . . . 7.0099999999999998 118.412 148.998 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 76.4 p -147.91 161.0 36.45 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 118.603 0.638 . . . . 2.04 112.146 -154.88 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -62.36 -23.86 75.4 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 121.933 1.755 . . . . 1.5600000000000001 111.836 165.384 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -69.87 -48.38 58.97 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.994 1.318 . . . . 2.5699999999999998 111.083 177.411 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -63.77 -44.01 94.69 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 122.522 1.153 . . . . 3.3900000000000001 110.611 177.363 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -66.04 -19.98 66.03 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.686 -1.259 . . . . 4.2300000000000004 112.282 175.105 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -81.94 -45.12 15.84 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.167 1.387 . . . . 1.29 112.379 171.54 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.4 pp -63.37 -30.14 71.32 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 121.999 2.182 . . . . 2.96 112.157 171.588 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 30.0 m -53.09 -56.75 13.8 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.223 1.009 . . . . 1.47 109.371 164.622 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.76 -34.72 73.35 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.926 1.291 . . . . 1.71 114.008 179.503 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -56.88 -44.46 82.28 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.335 1.054 . . . . 3.46 112.444 170.193 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.2 t -71.66 -32.03 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 CA-C-O 118.597 -0.716 . . . . 1.8999999999999999 112.178 173.235 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 54.3 m -57.34 -56.61 19.62 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 119.758 1.163 . . . . 0.93000000000000005 111.641 175.476 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -57.93 -43.12 86.12 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 123.344 0.657 . . . . 2.0699999999999998 110.068 173.537 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -64.5 -45.2 88.3 Favored 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 120.677 -0.409 . . . . 1.9099999999999999 111.99 -173.265 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.32 -45.59 92.56 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 120.379 -1.451 . . . . 2.1499999999999999 112.061 176.336 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.17 -41.36 67.15 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.948 0.721 . . . . 5.8600000000000003 112.948 -176.513 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -72.74 -43.4 62.98 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.083 0.856 . . . . 2.1899999999999999 112.99 173.096 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.2 m -72.45 -26.2 61.74 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 120.307 1.412 . . . . 2.8500000000000001 111.964 -179.407 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.02 -35.44 89.33 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 124.689 1.138 . . . . 2.04 113.164 173.891 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.3 ttt85 -45.55 -50.1 13.31 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 128.073 2.549 . . . . 5.1699999999999999 115.609 -168.775 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -138.6 161.95 35.83 Favored 'General case' 0 C--O 1.25 1.127 0 C-N-CA 126.167 1.787 . . . . 4.7199999999999998 111.465 -177.255 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.52 -87.81 0.27 Allowed Glycine 0 C--N 1.346 1.123 0 C-N-CA 127.234 2.349 . . . . 2.3500000000000001 109.62 179.678 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -146.36 -179.54 6.82 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 121.559 -0.965 . . . . 4.75 110.04 142.75 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.73 156.35 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.489 1.916 . . . . 6.4000000000000004 113.011 147.106 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.0 mt 78.85 -50.7 0.45 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 128.185 2.594 . . . . 3.0699999999999998 110.712 -169.857 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.6 p -86.18 136.6 33.13 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 113.243 0.831 . . . . 2.1200000000000001 113.243 -176.326 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 28.3 mt -90.7 107.4 19.15 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.56 -0.904 . . . . 1.54 108.56 149.394 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.0 t -71.01 161.22 31.52 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 120.646 -1.284 . . . . 1.8799999999999999 111.177 163.425 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 22.4 ttt180 -42.2 -35.34 0.93 Allowed 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.757 1.623 . . . . 3.48 114.209 179.819 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 mmmm -71.38 -55.74 7.35 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 116.071 1.878 . . . . 4.5599999999999996 116.071 173.507 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -49.9 -35.65 24.46 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.2 1.4 . . . . 2.0600000000000001 110.002 171.606 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.7 tp -81.57 -49.07 10.98 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.968 0.907 . . . . 1.8700000000000001 110.902 -174.814 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -55.34 -38.22 68.48 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.06 0.846 . . . . 6.3300000000000001 111.384 175.885 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -79.19 -8.61 59.14 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.83 1.419 . . . . 3.7599999999999998 114.83 -174.73 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 50.8 tp -92.27 -55.28 3.48 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.855 1.262 . . . . 2.8500000000000001 111.212 169.611 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 23.0 mt -57.86 -49.07 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 O-C-N 121.668 -0.645 . . . . 1.24 110.08 -174.133 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.09 -3.94 15.23 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 113.475 0.917 . . . . 4.3899999999999997 113.475 -178.008 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.6 mmtp -95.37 -45.82 6.97 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.948 1.299 . . . . 2.7000000000000002 110.88 167.942 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -64.82 -53.0 53.69 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.227 1.411 . . . . 5.2800000000000002 111.81 -177.131 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -82.47 41.5 0.71 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.029 1.332 . . . . 2.7799999999999998 112.245 -175.621 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 53.4 t -58.04 -33.52 69.09 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.17 1.388 . . . . 3.7799999999999998 112.646 177.916 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -71.42 -6.34 39.57 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.896 1.443 . . . . 4.5800000000000001 114.896 174.332 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -133.67 -8.96 2.09 Favored Glycine 0 N--CA 1.472 1.045 0 CA-C-O 118.195 -1.336 . . . . 3.7000000000000002 115.881 -178.173 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 52.32 41.38 30.47 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.157 1.783 . . . . 7.9100000000000001 113.509 -179.436 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.4 tpt -39.33 104.97 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.609 1.564 . . . . 2.3100000000000001 112.102 -173.509 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -73.53 158.79 34.22 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.393 0.516 . . . . 6.0199999999999996 112.393 -160.641 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.54 -47.02 73.68 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 119.761 1.164 . . . . 5.6299999999999999 111.822 175.447 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.8 t -65.34 -3.67 4.45 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 115.183 1.549 . . . . 2.7999999999999998 115.183 173.782 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -114.1 -18.46 11.67 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.833 1.253 . . . . 2.7599999999999998 113.086 170.317 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 24.8 mt -76.71 -31.15 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 125.908 1.683 . . . . 1.23 110.527 172.029 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -70.2 -41.22 73.96 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 118.127 -0.94 . . . . 2.8500000000000001 113.197 177.166 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -65.92 -44.59 84.7 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 120.385 1.448 . . . . 2.8700000000000001 110.348 168.316 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 49.1 tp -54.67 -48.45 72.35 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.109 -0.948 . . . . 1.96 110.403 179.847 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.6 ttt -55.9 -50.39 70.82 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.192 1.36 . . . . 1.5600000000000001 112.144 172.249 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.56 -18.56 30.72 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.549 1.54 . . . . 4.7400000000000002 113.322 175.345 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.5 m -101.17 -22.85 14.57 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 127.077 2.151 . . . . 2.3700000000000001 113.763 179.067 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.7 mp -72.9 -46.17 54.16 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.573 -1.33 . . . . 2.8700000000000001 110.79 162.328 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -78.48 63.13 3.25 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.826 2.05 . . . . 1.9399999999999999 112.577 -166.295 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -51.06 -39.62 56.41 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 125.804 1.642 . . . . 3.4300000000000002 113.962 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -82.02 -8.02 59.64 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.777 1.399 . . . . 2.6400000000000001 114.777 176.004 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.4 t 63.36 39.55 9.27 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.871 1.268 . . . . 2.3199999999999998 114.202 166.855 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 42.3 p-10 -109.45 1.96 20.23 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 127.946 2.499 . . . . 2.6000000000000001 112.976 -175.074 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 78.66 -7.35 1.8 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 128.157 2.583 . . . . 3.75 115.639 -178.385 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -116.0 141.94 47.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.049 1.34 . . . . 3.8500000000000001 109.895 -179.659 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 22.4 mm -100.22 103.82 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 O-C-N 120.514 -1.366 . . . . 1.1100000000000001 111.569 175.994 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.48 162.22 29.52 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 125.139 1.376 . . . . 2.3999999999999999 112.132 164.057 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.32 -40.72 74.86 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 120.544 -1.348 . . . . 2.0600000000000001 113.16 -174.818 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.63 -14.65 62.94 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 120.977 -1.077 . . . . 3.3700000000000001 112.744 174.855 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -84.88 -51.93 6.37 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.34 -0.85 . . . . 2.0699999999999998 110.789 168.682 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -52.97 -45.0 67.58 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 127.195 2.198 . . . . 2.1299999999999999 114.513 -171.571 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.0 t -54.09 -27.28 31.85 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.225 1.194 . . . . 1.9099999999999999 114.225 -171.214 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.3 m -68.24 -22.97 27.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 O-C-N 120.759 -1.213 . . . . 2.46 113.48 -179.556 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -60.54 -62.83 1.58 Allowed 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 123.704 0.802 . . . . 1.8700000000000001 110.542 171.712 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.408 ' H ' HD12 ' A' ' 76' ' ' LEU . 3.8 mp -60.91 -30.93 70.47 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.347 1.059 . . . . 2.3900000000000001 111.404 179.71 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.5 m -59.73 -58.93 6.42 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.958 0.903 . . . . 0.77000000000000002 111.318 172.167 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 13.6 ptp -65.32 -34.0 77.31 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 118.405 0.548 . . . . 1.6499999999999999 112.228 -178.493 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -54.18 46.42 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.489 1.116 . . . . 2.98 110.794 173.557 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 7.6 t -64.3 -33.76 76.57 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.024 0.53 . . . . 1.6399999999999999 112.08 179.741 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.8 mtp -61.46 -44.18 97.55 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 118.957 0.798 . . . . 2.5099999999999998 112.954 168.616 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.45 -40.84 89.65 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.176 0.898 . . . . 1.1299999999999999 111.293 178.66 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -64.27 -22.39 66.93 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 118.77 -0.633 . . . . 2.7000000000000002 112.705 175.098 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -67.44 -40.9 85.47 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 120.146 1.339 . . . . 1.9199999999999999 111.682 174.013 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -71.91 -40.54 68.76 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.976 0.911 . . . . 2.6899999999999999 110.463 178.806 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -52.89 -48.3 67.26 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.142 1.377 . . . . 2.96 111.871 170.068 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -58.37 -24.38 59.71 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.992 1.717 . . . . 2.7000000000000002 113.618 179.355 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.2 mp -72.27 -17.79 61.86 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.41 1.005 . . . . 2.54 113.37 171.998 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -112.58 6.26 18.31 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 126.889 2.076 . . . . 3.77 114.892 173.985 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -88.61 -46.44 9.06 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 120.262 -1.524 . . . . 4.4400000000000004 112.169 162.362 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 41.9 p-10 -76.96 16.06 0.59 Allowed 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 117.123 2.268 . . . . 3.5099999999999998 117.123 -173.071 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.258 1.534 0 N-CA-C 118.953 2.945 . . . . 4.79 118.953 -129.041 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.421 ' SD ' ' HE3' ' B' ' 7' ' ' LYS . 30.2 mmt . . . . . 0 N--CA 1.474 0.77 0 N-CA-C 107.421 -1.326 . . . . 5.1699999999999999 107.421 . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 17.9 mp0 -109.01 -94.4 0.41 Allowed 'General case' 0 CA--C 1.54 0.559 0 O-C-N 125.493 1.746 . . . . 4.8399999999999999 108.633 -150.813 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 71.8 p -135.99 159.38 71.3 Favored Pre-proline 0 N--CA 1.472 0.659 0 C-N-CA 124.626 1.171 . . . . 1.9199999999999999 110.938 173.224 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.01 -13.07 35.85 Favored 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 122.43 2.086 . . . . 1.4199999999999999 112.757 167.053 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -82.01 -44.14 17.05 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.638 1.175 . . . . 2.73 112.986 -179.58 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 6' ' ' GLU . . . . . 0.411 ' CD ' ' HZ3' ' B' ' 7' ' ' LYS . 1.4 tm-20 -57.56 -40.88 79.92 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 122.343 1.068 . . . . 4.3200000000000003 110.045 168.981 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 7' ' ' LYS . . . . . 0.421 ' HE3' ' SD ' ' B' ' 1' ' ' MET . 49.9 mttm -76.79 -27.84 55.4 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 121.125 -0.985 . . . . 4.5599999999999996 112.259 179.599 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.81 -43.08 80.5 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.876 0.762 . . . . 0.90000000000000002 111.532 169.257 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 42.9 mt -58.22 -39.02 77.96 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.576 1.15 . . . . 1.52 111.12 169.557 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 71.1 m -65.19 -42.59 93.45 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.006 0.922 . . . . 1.48 112.131 171.977 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 63.2 m -58.48 -46.45 86.64 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 120.328 1.422 . . . . 1.3700000000000001 111.047 171.152 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 82.3 mtp -57.24 -49.37 76.25 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.531 1.532 . . . . 3.2000000000000002 111.756 173.754 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.73 -27.36 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.188 0.904 . . . . 1.8999999999999999 112.647 177.279 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 94.1 m -67.96 -54.75 16.21 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.127 1.371 . . . . 0.97999999999999998 110.458 174.012 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.2 p -59.28 -35.95 74.66 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.346 0.975 . . . . 1.97 110.702 173.538 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 16' ' ' PHE . . . . . 0.448 ' CE1' HD23 ' B' ' 29' ' ' LEU . 27.8 t80 -67.79 -45.72 74.01 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 118.729 -0.653 . . . . 2.1800000000000002 110.96 179.801 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -69.75 -46.78 65.1 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 120.432 1.469 . . . . 2.1600000000000001 111.345 176.42 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -58.69 -44.78 90.37 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.22 1.408 . . . . 5.8799999999999999 113.71 179.306 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -81.14 -19.9 42.48 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 120.641 -1.287 . . . . 2.3100000000000001 112.094 171.235 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 26.9 m -67.79 -22.33 65.19 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 121.112 1.778 . . . . 1.71 112.94 170.207 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.15 7.58 81.78 Favored Glycine 0 CA--C 1.53 1.02 0 C-N-CA 126.467 1.984 . . . . 1.77 114.73 176.216 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 5.0 mmm-85 -76.46 -14.22 60.06 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.477 1.638 . . . . 4.6900000000000004 113.868 178.897 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 171.28 -174.16 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 129.713 3.205 . . . . 3.2799999999999998 110.852 -176.572 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 62.72 -139.1 44.94 Favored Glycine 0 N--CA 1.472 1.096 0 O-C-N 120.731 -1.231 . . . . 1.8600000000000001 110.651 -179.624 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 8.1 t -82.28 158.89 23.3 Favored 'General case' 0 C--O 1.245 0.819 0 CA-C-N 118.054 0.927 . . . . 4.1799999999999997 110.418 157.012 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.6 51.23 1.44 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.89 1.676 . . . . 6.9199999999999999 111.421 172.476 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 63.3 tp -168.07 -35.05 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 126.878 2.071 . . . . 2.9199999999999999 110.678 -170.431 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 25.6 p -102.98 152.75 20.97 Favored 'General case' 0 C--O 1.248 1.001 0 C-N-CA 126.794 2.038 . . . . 1.6000000000000001 111.622 173.801 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.448 HD23 ' CE1' ' B' ' 16' ' ' PHE . 0.0 OUTLIER -122.4 78.48 1.51 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.919 1.287 . . . . 2.21 110.214 -163.807 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.463 ' HA ' ' HA ' ' B' ' 66' ' ' GLU . 1.0 OUTLIER -54.96 150.51 10.09 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.536 1.935 . . . . 2.1400000000000001 112.967 177.738 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 23.5 ttp85 -40.34 -55.23 2.26 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.547 0.943 . . . . 3.2400000000000002 113.547 178.144 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.22 -27.35 61.93 Favored 'General case' 0 CA--C 1.554 1.116 0 N-CA-C 117.15 2.278 . . . . 4.2300000000000004 117.15 177.655 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -76.6 -52.95 8.72 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.181 1.792 . . . . 1.76 108.022 175.284 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.07 -31.59 69.26 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.095 0.558 . . . . 3.2599999999999998 112.314 -173.192 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.58 -15.06 63.41 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.154 1.168 . . . . 5.6699999999999999 114.154 175.777 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.57 -61.95 1.59 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 118.22 -0.895 . . . . 4.0800000000000001 112.555 156.625 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 37' ' ' LEU . . . . . 0.417 HD23 ' C ' ' B' ' 37' ' ' LEU . 3.6 tt -45.18 -54.0 7.47 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.449 1.499 . . . . 2.0899999999999999 111.577 -174.115 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 11.8 mt -58.6 -68.14 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 119.075 0.852 . . . . 1.22 110.448 -173.742 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -12.57 42.94 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 113.546 0.943 . . . . 4.1799999999999997 113.546 -176.513 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.12 -53.77 6.1 Favored 'General case' 0 N--CA 1.444 -0.763 0 O-C-N 120.479 -1.388 . . . . 6.7000000000000002 111.3 165.84 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -75.8 -32.33 59.81 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 120.461 1.482 . . . . 3.73 112.104 -172.998 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -126.1 110.99 14.15 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.985 2.114 . . . . 2.4100000000000001 110.106 168.578 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 29.4 p -99.26 2.43 45.58 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 121.375 -0.828 . . . . 4.21 112.706 164.821 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 7.2 mp -77.01 155.3 32.67 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.081 0.953 . . . . 4.6200000000000001 112.263 -160.825 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.52 -73.8 1.13 Allowed Glycine 0 N--CA 1.469 0.875 0 C-N-CA 124.709 1.147 . . . . 5.4699999999999998 110.774 -175.073 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -154.71 7.37 0.29 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.164 1.386 . . . . 5.5700000000000003 113.458 165.289 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 5.7 tpt -50.07 117.65 2.46 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.287 1.435 . . . . 3.2799999999999998 114.075 -156.231 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 ttmp? -164.09 162.56 23.04 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.344 1.457 . . . . 3.9900000000000002 110.162 -161.45 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.77 3.51 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 116.653 2.094 . . . . 4.2400000000000002 116.653 170.5 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 2.6 p -73.75 -42.9 60.45 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 119.834 -1.791 . . . . 6.0 113.666 159.25 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 2.8 p -103.92 -16.28 15.4 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.299 1.839 . . . . 2.4399999999999999 113.572 -176.284 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 30.1 mt -71.81 -34.17 50.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 N-CA-C 114.621 1.341 . . . . 2.0 114.621 -176.588 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.09 -29.99 65.97 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 120.464 1.484 . . . . 2.8599999999999999 112.301 -174.204 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -71.24 -45.16 63.87 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.421 1.489 . . . . 2.4700000000000002 112.142 169.829 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 53.4 tp -56.87 -51.09 70.4 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 124.251 1.02 . . . . 2.2000000000000002 109.977 173.093 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 8.6 tpt -52.66 -48.74 66.26 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 127.095 2.158 . . . . 2.1899999999999999 111.861 175.868 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.39 -27.28 62.19 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.741 0.816 . . . . 3.8100000000000001 113.186 172.206 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 58' ' ' SER . . . . . 0.402 ' O ' ' HE3' ' B' ' 61' ' ' LYS . 9.3 t -87.8 -30.3 20.34 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.242 1.417 . . . . 2.1400000000000001 113.396 176.74 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 30.5 mt -67.94 -49.15 63.48 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 121.223 -0.923 . . . . 1.8700000000000001 110.605 171.555 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -81.51 81.05 7.74 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 122.895 1.331 . . . . 1.54 112.562 -173.523 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 61' ' ' LYS . . . . . 0.402 ' HE3' ' O ' ' B' ' 58' ' ' SER . 1.6 mptm? -61.36 -17.04 52.09 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 114.257 1.206 . . . . 3.1200000000000001 114.257 178.607 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -78.3 -33.27 49.46 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.097 0.862 . . . . 2.25 112.915 171.105 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 57.8 m 54.35 56.78 6.5 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.437 1.495 . . . . 2.3599999999999999 111.526 -159.662 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 9.3 p30 -101.21 -72.58 0.67 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.572 1.149 . . . . 2.3599999999999999 109.656 -172.042 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 167.62 -25.71 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.831 1 C-N-CA 133.386 4.674 . . . . 5.9800000000000004 113.854 -177.886 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 66' ' ' GLU . . . . . 0.463 ' HA ' ' HA ' ' B' ' 30' ' ' SER . 1.2 mt-10 -125.31 133.76 52.5 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 126.624 1.97 . . . . 2.5800000000000001 110.458 -171.091 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 34.1 mt -87.88 112.14 23.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 122.118 0.961 . . . . 1.3300000000000001 109.572 173.876 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.75 163.09 27.91 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.535 1.934 . . . . 2.5600000000000001 111.085 166.527 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -57.1 -37.76 72.4 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 120.866 -1.147 . . . . 2.3199999999999998 113.803 -176.871 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 5.0 mtmp? -77.9 -29.68 50.27 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 120.476 -1.39 . . . . 3.4100000000000001 112.343 177.257 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -60.86 -52.05 66.7 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-N 119.911 1.232 . . . . 1.8600000000000001 108.866 163.229 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -58.0 -29.36 65.22 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 119.61 -1.931 . . . . 2.1899999999999999 114.186 -179.436 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 32.7 p -58.27 -26.14 62.61 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.397 -1.439 . . . . 2.5800000000000001 113.802 171.851 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 47.3 t -64.74 -44.98 96.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.042 0.937 . . . . 1.8300000000000001 109.953 172.939 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -58.12 -54.88 41.94 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 119.103 -0.475 . . . . 1.6599999999999999 111.115 176.805 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 91.4 mt -52.99 -45.74 67.99 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.169 0.987 . . . . 2.04 111.791 -179.748 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 25.3 m -64.11 -51.1 65.58 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.107 0.563 . . . . 1.01 112.286 -179.206 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 67.9 mtm -62.69 -39.69 94.79 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 118.245 0.475 . . . . 2.0099999999999998 111.729 -179.367 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.38 -48.45 67.38 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.353 0.661 . . . . 2.6699999999999999 111.719 179.381 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 84.6 m -65.91 -28.47 68.96 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.079 0.77 . . . . 2.04 113.079 179.657 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 48.0 mtm -72.69 -31.46 65.04 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.034 1.124 . . . . 3.0099999999999998 114.034 169.205 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.67 -43.15 56.71 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.861 1.209 . . . . 0.96999999999999997 112.033 173.738 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.89 -15.64 23.02 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.531 1.308 . . . . 2.2599999999999998 114.531 172.877 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -66.12 -38.12 87.42 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.514 0.726 . . . . 2.54 112.099 172.228 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -90.09 -25.48 20.74 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.736 1.214 . . . . 3.5099999999999998 112.657 -179.12 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.97 -18.9 61.98 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 124.925 1.29 . . . . 3.6099999999999999 112.43 167.9 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -88.57 -16.49 32.44 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.387 1.875 . . . . 2.8399999999999999 112.801 168.903 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 87.7 mt -94.99 -32.15 13.29 Favored 'General case' 0 C--O 1.222 -0.395 0 CA-C-O 116.999 -1.477 . . . . 3.1600000000000001 112.792 -179.951 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -55.48 -25.31 36.19 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 120.297 1.408 . . . . 8.0899999999999999 114.022 168.158 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -81.38 -53.74 6.06 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 128.245 2.618 . . . . 3.3100000000000001 112.492 168.498 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -77.73 -16.9 58.12 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 116.701 2.112 . . . . 3.23 116.701 -170.444 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? . . . . . 0 N--CA 1.469 0.498 0 N-CA-C 119.818 3.266 . . . . 5.5499999999999998 119.818 -159.767 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 108.012 -1.107 . . . . 6.8700000000000001 108.012 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -144.35 -99.62 0.11 Allowed 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 106.15 -1.796 . . . . 3.9900000000000002 106.15 -165.631 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 72.9 p -152.19 169.77 9.02 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 128.264 2.626 . . . . 1.8899999999999999 108.829 -168.921 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.89 -37.46 3.67 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 CA-C-N 120.73 1.296 . . . . 1.8300000000000001 111.372 167.612 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 26.4 mt -62.87 -49.68 73.9 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-O 117.729 -1.129 . . . . 3.23 112.792 -174.916 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -38.34 66.76 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.955 1.252 . . . . 4.4500000000000002 111.057 -178.839 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -73.86 -42.79 60.28 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 120.361 -1.462 . . . . 3.4399999999999999 113.431 171.475 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.566 ' HB1' ' HB2' ' B' ' 8' ' ' ALA . . . -75.13 -30.81 60.92 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 114.717 1.377 . . . . 2.3100000000000001 114.717 -174.782 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.3 mt -67.49 -35.57 79.41 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.908 1.683 . . . . 1.8899999999999999 110.066 166.958 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 56.9 m -67.96 -36.2 79.66 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 118.139 -0.934 . . . . 2.1699999999999999 111.038 170.893 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.9 m -56.61 -41.4 76.98 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 120.004 1.274 . . . . 1.78 111.3 167.38 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.5 tpt -63.34 -44.6 94.41 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.586 0.754 . . . . 4.4800000000000004 112.465 172.835 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 37.5 t -61.83 -33.65 58.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 O-C-N 120.478 -1.388 . . . . 2.23 112.229 173.958 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.9 m -71.24 -41.63 69.88 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.828 1.651 . . . . 1.3500000000000001 112.183 -177.804 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.0 p -69.0 -37.61 78.79 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 117.966 -1.016 . . . . 1.98 109.193 167.904 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -59.69 -57.16 14.12 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.462 0.574 . . . . 2.02 111.147 -173.538 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -59.57 -50.0 75.57 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-O 122.274 1.035 . . . . 2.8300000000000001 111.594 178.097 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -57.8 -34.14 69.31 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.923 -1.111 . . . . 3.5899999999999999 113.683 -178.695 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -97.0 -19.81 18.5 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.992 1.317 . . . . 2.1000000000000001 112.472 177.137 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.4 p -71.11 -29.51 65.37 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-N 121.624 2.011 . . . . 2.1400000000000001 111.952 171.081 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.24 -8.99 80.7 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 126.854 2.168 . . . . 1.8700000000000001 115.217 173.657 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.3 ttm-85 -66.18 -23.38 66.45 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 119.194 1.497 . . . . 4.5199999999999996 113.574 -177.948 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -166.72 158.78 13.32 Favored 'General case' 0 C--O 1.247 0.95 0 C-N-CA 124.404 1.082 . . . . 4.9800000000000004 112.468 -174.672 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.71 -134.25 52.42 Favored Glycine 0 C--N 1.339 0.743 0 C-N-CA 125.268 1.413 . . . . 2.5499999999999998 111.234 172.201 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.9 m -62.52 139.71 58.61 Favored 'General case' 0 C--O 1.246 0.918 0 O-C-N 121.824 -0.81 . . . . 3.77 110.697 165.364 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -89.51 -20.12 24.22 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 115.332 1.605 . . . . 6.21 115.332 -171.065 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.48 ' H ' HD23 ' A' ' 27' ' ' LEU . 2.5 pt? -81.27 -18.76 44.82 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.285 1.034 . . . . 5.2699999999999996 112.793 168.091 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.84 157.1 34.92 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 125.262 1.425 . . . . 1.6299999999999999 114.25 -169.553 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 88.3 mt -99.44 112.91 25.02 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.283 1.833 . . . . 1.6299999999999999 110.606 -177.085 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.35 168.55 16.52 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.983 1.313 . . . . 2.3799999999999999 112.526 170.611 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -51.46 -22.85 3.36 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 127.53 2.332 . . . . 4.0700000000000003 116.316 -175.442 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.68 -39.68 8.55 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 121.178 -0.951 . . . . 4.0199999999999996 112.96 173.972 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -48.29 -48.07 36.01 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.134 0.973 . . . . 1.6200000000000001 110.912 168.011 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.4 -48.38 67.53 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.91 1.284 . . . . 2.3599999999999999 112.444 178.306 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -51.96 -43.91 63.75 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.479 -1.388 . . . . 3.6899999999999999 112.643 174.407 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -68.18 -43.28 78.49 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.706 1.203 . . . . 3.2799999999999998 111.719 177.705 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.6 mt -53.43 -53.68 47.84 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.783 1.174 . . . . 2.7400000000000002 112.926 175.17 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.2 mt -55.15 -48.97 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.137 0.88 . . . . 0.85999999999999999 110.686 -178.481 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -64.94 -27.31 68.76 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 112.586 0.588 . . . . 3.8500000000000001 112.586 -176.738 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -87.62 -48.66 7.72 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.922 1.689 . . . . 2.7999999999999998 112.518 -179.068 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -73.34 -50.59 21.2 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.482 1.513 . . . . 4.4800000000000004 111.946 -175.26 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -95.59 61.73 2.31 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.498 1.519 . . . . 2.8500000000000001 109.313 -177.458 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.6 t -63.64 5.17 0.21 Allowed 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 126.05 1.74 . . . . 3.8300000000000001 115.552 -173.927 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.479 HD12 ' H ' ' A' ' 44' ' ' LEU . 5.0 mp -69.87 -24.23 63.39 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.163 1.785 . . . . 4.4500000000000002 111.968 166.926 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.17 -108.39 3.67 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 125.013 1.292 . . . . 4.7800000000000002 112.211 171.706 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 62.27 -75.65 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.843 2.057 . . . . 5.3700000000000001 112.17 -167.526 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.44 107.44 0.11 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 127.124 2.17 . . . . 2.0800000000000001 115.318 -159.095 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -67.48 151.31 47.59 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.12 0.968 . . . . 5.1500000000000004 109.811 168.752 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -60.69 -33.7 73.24 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 116.027 1.862 . . . . 3.73 116.027 -159.757 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.4 t -84.23 -16.72 42.24 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 114.145 1.165 . . . . 3.1499999999999999 114.145 171.941 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.4 t -76.2 -21.32 56.6 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.259 1.39 . . . . 2.5099999999999998 112.074 174.606 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 21.9 mm -55.92 -40.7 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 124.056 0.943 . . . . 1.54 110.994 163.546 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -69.67 -39.55 76.93 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 123.423 0.689 . . . . 3.3999999999999999 110.609 -172.88 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.98 -33.86 68.47 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.167 0.987 . . . . 2.7200000000000002 113.331 171.935 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.9 -56.55 20.59 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-N 118.831 0.741 . . . . 2.6000000000000001 109.828 171.017 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.6 ptm -71.95 -25.52 61.91 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.918 1.081 . . . . 1.8999999999999999 113.918 -176.804 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.5 ttmp? -64.6 -24.96 67.76 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.316 1.046 . . . . 4.2300000000000004 111.939 168.657 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.3 t -78.29 -25.35 46.61 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.035 1.124 . . . . 2.3999999999999999 114.035 168.3 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.5 mp -73.95 -53.85 9.19 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.174 0.99 . . . . 2.5899999999999999 113.324 178.597 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -75.45 81.92 2.51 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 122.355 1.074 . . . . 1.8200000000000001 112.295 -169.881 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.7 tmtp? -62.19 -7.46 4.18 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 115.118 1.525 . . . . 5.4699999999999998 115.118 -171.141 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.13 -26.69 13.86 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.838 1.655 . . . . 2.79 112.913 172.365 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.1 m 57.84 32.46 21.95 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.322 1.049 . . . . 3.04 112.902 -160.9 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 p30 -75.55 -6.42 50.21 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.779 0.832 . . . . 3.4900000000000002 111.876 166.433 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.35 -3.9 2.46 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 129.505 3.122 . . . . 4.0999999999999996 113.425 171.977 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -106.85 121.4 44.33 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 123.484 1.612 . . . . 2.8100000000000001 110.123 166.565 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 49.9 mt -81.29 103.6 8.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 123.013 1.387 . . . . 1.4199999999999999 108.721 178.517 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.79 151.01 30.56 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 112.844 -1.98 . . . . 4.0300000000000002 109.45 178.979 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.19 -38.14 70.56 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 120.611 -1.306 . . . . 2.6800000000000002 113.375 -177.474 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -59.18 -22.22 60.63 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.335 2.254 . . . . 4.3899999999999997 115.787 172.256 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -94.83 -47.45 6.45 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.248 1.419 . . . . 3.46 109.81 173.091 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -51.36 -26.14 7.2 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 127.432 2.293 . . . . 2.2799999999999998 115.845 -170.853 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 47.3 p -64.18 -18.7 64.73 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 120.155 -1.591 . . . . 1.9099999999999999 113.295 175.839 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.5 m -63.95 -24.22 35.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 119.54 1.064 . . . . 2.52 112.822 170.385 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -60.05 -57.23 13.74 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.633 1.173 . . . . 2.1200000000000001 111.423 173.538 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.6 mp -55.59 -41.07 72.86 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 125.827 1.651 . . . . 3.04 110.56 173.332 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 44.3 m -61.14 -50.9 71.31 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 117.172 -1.394 . . . . 0.71999999999999997 111.742 178.826 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 2.5 mpp? -52.42 -45.89 66.12 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 120.865 1.666 . . . . 2.1200000000000001 111.562 174.735 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 46.5 mt -69.69 -49.25 55.23 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.624 0.77 . . . . 1.27 111.444 -175.716 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 99.3 m -65.37 -30.21 71.01 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.614 0.968 . . . . 1.6799999999999999 113.614 176.654 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 69.3 mtp -70.17 -37.0 75.07 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 120.01 1.277 . . . . 1.73 111.203 171.874 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.64 -37.05 84.01 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.181 0.901 . . . . 0.85999999999999999 112.616 173.102 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.0 m-30 -68.25 -23.33 64.77 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.987 0.915 . . . . 2.3100000000000001 112.575 174.6 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -68.0 -48.5 65.58 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.438 0.695 . . . . 2.3300000000000001 111.52 174.571 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -62.49 -43.11 99.62 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.968 1.707 . . . . 2.6600000000000001 111.643 178.673 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.43 -45.52 65.99 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.303 1.441 . . . . 2.3900000000000001 111.964 174.174 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -66.79 -27.76 67.83 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.803 1.241 . . . . 2.8700000000000001 112.533 178.69 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 84.4 mt -78.01 -17.65 56.85 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.581 1.152 . . . . 1.9399999999999999 113.511 175.829 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -101.35 1.44 38.54 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 114.485 1.291 . . . . 2.8199999999999998 114.485 173.725 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -97.82 -56.58 2.46 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.06 1.344 . . . . 4.1200000000000001 111.729 171.169 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -81.82 17.52 1.49 Allowed 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 115.127 1.529 . . . . 3.0600000000000001 115.127 -170.633 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.216 0 C-N-CA 127.5 2.32 . . . . 4.1200000000000001 115.871 -175.618 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.477 0.895 0 N-CA-C 107.331 -1.359 . . . . 6.0099999999999998 107.331 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -113.43 -96.13 0.45 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 106.443 -1.688 . . . . 4.3700000000000001 106.443 -156.796 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.4 p -122.86 159.88 51.65 Favored Pre-proline 0 C--O 1.238 0.486 0 C-N-CA 124.073 0.949 . . . . 2.04 109.351 152.839 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -71.65 -13.71 29.95 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.877 2.385 . . . . 1.8700000000000001 111.886 163.88 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 8.8 tt -76.34 -42.95 43.15 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 123.916 0.887 . . . . 2.9500000000000002 111.322 177.501 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -60.52 -30.29 69.64 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 118.617 0.644 . . . . 4.1500000000000004 111.28 177.032 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.48 -25.75 38.66 Favored 'General case' 0 CA--C 1.548 0.869 0 O-C-N 120.786 -1.196 . . . . 3.9199999999999999 114.166 169.334 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 8' ' ' ALA . . . . . 0.566 ' HB2' ' HB1' ' A' ' 8' ' ' ALA . . . -62.19 -42.58 99.42 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.012 -1.055 . . . . 1.3899999999999999 111.301 171.255 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 41.1 mt -69.71 -36.63 76.07 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.638 1.175 . . . . 1.55 111.441 -175.02 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.79 -47.01 67.21 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.821 0.848 . . . . 1.5600000000000001 112.002 168.268 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.3 t -65.44 -25.06 67.35 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 120.093 1.315 . . . . 2.6499999999999999 111.966 -178.571 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 85.9 mtp -59.2 -60.11 4.38 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.143 0.977 . . . . 2.8300000000000001 110.869 169.479 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 28.1 m -61.78 -22.95 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 120.378 -1.451 . . . . 2.1600000000000001 113.112 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 90.5 m -75.48 -40.15 57.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 126.269 1.828 . . . . 0.79000000000000004 113.185 178.7 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 10.7 p -75.33 -35.29 61.22 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.112 1.323 . . . . 1.72 109.923 169.25 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -54.28 -61.38 2.34 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.85 0.86 . . . . 2.0800000000000001 109.91 -179.273 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 42.4 m170 -71.15 -24.86 62.34 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 115.005 1.483 . . . . 2.6600000000000001 115.005 178.672 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -70.19 -33.92 72.32 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 122.026 2.194 . . . . 4.0999999999999996 113.657 174.199 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -92.0 -36.18 13.55 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.155 0.889 . . . . 2.0899999999999999 112.479 175.765 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t -64.83 -29.75 70.72 Favored 'General case' 0 C--O 1.247 0.963 0 N-CA-C 113.844 1.053 . . . . 1.98 113.844 171.355 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.29 -12.24 84.77 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 126.583 2.04 . . . . 1.6699999999999999 114.675 178.893 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -76.88 -44.6 31.35 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 118.783 1.292 . . . . 3.4399999999999999 112.361 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -123.65 144.57 49.55 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 118.768 0.713 . . . . 3.2000000000000002 111.888 -171.35 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.77 -129.69 30.66 Favored Glycine 0 C--N 1.341 0.845 0 C-N-CA 125.628 1.585 . . . . 2.2799999999999998 112.791 175.528 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 12.0 t -57.62 132.47 53.32 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.609 0.719 . . . . 3.6600000000000001 110.578 166.218 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -80.89 -12.75 59.36 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.575 1.15 . . . . 7.29 113.938 177.729 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 57.5 tp -84.17 -39.98 18.72 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.62 1.168 . . . . 2.7599999999999998 111.116 171.011 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 3.1 p -108.0 148.77 29.26 Favored 'General case' 0 C--O 1.253 1.256 0 C-N-CA 125.495 1.518 . . . . 1.5900000000000001 113.421 -173.208 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 2.4 pp -122.56 112.04 17.52 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 113.104 -1.862 . . . . 1.96 111.48 -174.94 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 79.9 p -97.12 -170.02 1.96 Allowed 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 122.144 0.973 . . . . 1.76 113.392 -178.989 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 25.6 ttt-85 -56.08 -8.12 0.43 Allowed 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 117.948 2.573 . . . . 3.5099999999999998 117.948 -172.349 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.89 -50.73 3.75 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 113.734 1.012 . . . . 4.2599999999999998 113.734 164.295 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -54.69 -34.06 61.77 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.771 1.228 . . . . 1.9199999999999999 112.029 178.015 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 54.6 tp -70.23 -49.4 50.43 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.28 1.032 . . . . 1.9399999999999999 112.335 174.548 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -78.83 -24.4 44.46 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.373 -1.454 . . . . 3.8599999999999999 114.65 -174.021 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -46.26 -71.68 0.07 Allowed 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 117.802 -1.094 . . . . 3.23 110.503 149.903 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.18 -57.75 6.18 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.612 1.165 . . . . 1.8300000000000001 113.215 -175.726 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 22.8 mt -53.98 -44.98 63.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 119.269 0.94 . . . . 0.97999999999999998 110.13 -176.558 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 22.9 mmmt -74.56 -5.61 43.82 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.559 1.318 . . . . 5.3399999999999999 114.559 -179.847 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 8.7 mmtp -102.78 -22.11 13.95 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 120.749 1.613 . . . . 3.9500000000000002 113.699 168.351 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -91.02 -87.9 0.19 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.315 1.046 . . . . 3.8700000000000001 108.491 170.875 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -77.37 37.77 0.22 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.099 1.76 . . . . 2.23 112.842 -175.936 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 39.8 t -51.05 -27.64 8.51 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.645 1.978 . . . . 4.0800000000000001 113.488 178.604 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.584 ' H ' HD12 ' B' ' 44' ' ' LEU . 3.3 mp -60.16 -37.06 79.01 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.369 2.268 . . . . 4.2800000000000002 113.641 178.92 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -81.83 40.53 2.65 Favored Glycine 0 N--CA 1.473 1.131 0 C-N-CA 124.798 1.19 . . . . 4.0599999999999996 113.983 -169.107 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.427 ' HG3' ' H ' ' B' ' 47' ' ' MET 0.266 6.2 pt-20 46.08 -68.67 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 129.521 3.128 . . . . 4.96 114.928 -165.288 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 47' ' ' MET . . . . . 0.427 ' H ' ' HG3' ' B' ' 46' ' ' GLU . 6.9 mmt 59.16 60.82 2.26 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 124.672 2.177 . . . . 3.0299999999999998 113.235 173.074 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.3 mppt? -65.51 159.46 24.44 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 111.604 -2.544 . . . . 3.6699999999999999 111.489 168.256 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.56 -41.85 6.83 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 128.275 2.63 . . . . 5.8600000000000003 115.66 -170.202 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 6.0 t -91.35 -32.97 15.47 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.456 1.102 . . . . 3.6600000000000001 113.151 177.405 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 35.9 t -62.74 -33.83 75.94 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 120.204 -1.56 . . . . 1.8600000000000001 111.398 174.074 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 3.7 mm -59.97 -38.42 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 126.974 2.11 . . . . 1.5700000000000001 112.878 166.815 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.85 -31.02 24.02 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 124.791 1.236 . . . . 2.7000000000000002 111.472 -168.902 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -81.67 -30.97 32.46 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.201 1.401 . . . . 4.6699999999999999 111.645 170.468 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 16.0 tp -57.74 -45.61 85.61 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.525 -0.75 . . . . 2.0899999999999999 110.061 162.355 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 3.2 ttt -58.68 -41.91 87.3 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-O 118.069 -0.967 . . . . 1.6200000000000001 113.279 173.66 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 31.0 mttp -61.02 -29.48 69.74 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 120.358 1.435 . . . . 4.8499999999999996 112.134 176.455 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 2.2 p -79.21 -37.34 38.42 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.258 0.836 . . . . 2.8700000000000001 113.258 173.643 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 59' ' ' LEU . . . . . 0.461 HD11 ' HB2' ' B' ' 75' ' ' PHE . 0.4 OUTLIER -67.85 -53.15 29.01 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 125.828 1.651 . . . . 2.5 110.603 179.733 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -76.85 68.08 3.0 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 123.671 1.7 . . . . 1.6299999999999999 111.19 -179.317 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -53.0 -26.51 15.6 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.905 2.482 . . . . 3.75 114.03 178.827 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -73.5 -34.39 65.27 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 118.199 -0.905 . . . . 2.8199999999999998 112.873 171.744 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 65.8 m 53.54 65.49 1.5 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.609 1.164 . . . . 3.25 111.388 -157.841 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -110.34 -74.2 0.66 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.78 1.232 . . . . 2.5800000000000001 109.893 -175.979 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 173.58 -25.23 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 131.362 3.865 . . . . 6.4800000000000004 112.765 -178.096 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -132.28 142.6 49.44 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 127.131 2.172 . . . . 3.5099999999999998 111.443 -169.342 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 46.5 mm -83.23 110.29 17.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 125.15 1.38 . . . . 1.23 109.383 172.937 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -74.45 163.18 28.08 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.86 1.664 . . . . 3.0800000000000001 110.557 161.552 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.62 -36.31 78.31 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 120.16 -1.588 . . . . 2.8100000000000001 112.627 178.446 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -71.89 -15.78 62.12 Favored 'General case' 0 CA--C 1.556 1.194 0 O-C-N 120.631 -1.293 . . . . 6.3399999999999999 111.876 177.433 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -81.14 -58.8 2.9 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.293 1.437 . . . . 1.8700000000000001 108.898 164.172 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -45.93 -45.3 15.37 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.344 2.257 . . . . 1.98 114.032 -175.532 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 56.3 m -53.76 -27.52 29.22 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.291 0.849 . . . . 2.27 113.291 178.477 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 87.5 t -62.16 -36.53 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 119.995 1.271 . . . . 1.6000000000000001 111.211 178.959 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.461 ' HB2' HD11 ' B' ' 59' ' ' LEU . 13.9 t80 -51.45 -62.08 1.84 Allowed 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.446 0.698 . . . . 1.75 111.062 174.135 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 77.9 mt -72.61 -22.72 60.92 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.993 0.917 . . . . 2.2000000000000002 112.328 -175.483 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.7 m -60.62 -56.16 24.69 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.631 1.173 . . . . 0.91000000000000003 110.197 169.378 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 58.1 mtm -55.58 -42.32 74.61 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 118.299 0.5 . . . . 1.5 112.099 -179.507 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 31.1 mt -71.18 -40.01 71.49 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.688 0.795 . . . . 1.4099999999999999 112.366 -177.145 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 14.7 t -64.42 -34.12 77.44 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.88 0.696 . . . . 2.2599999999999998 112.88 177.458 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 2.9 mtm -70.96 -36.59 72.63 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.596 -0.69 . . . . 3.6299999999999999 112.012 170.161 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.68 -34.66 78.36 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.76 1.164 . . . . 1.03 112.755 175.383 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -68.43 -35.6 77.84 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 119.182 0.901 . . . . 2.4500000000000002 112.343 171.922 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -64.93 -41.58 95.4 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.179 0.992 . . . . 1.8300000000000001 112.633 173.95 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -72.47 -29.78 63.96 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.043 0.937 . . . . 3.5600000000000001 111.347 179.054 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -58.75 -52.16 66.91 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.201 1.0 . . . . 2.4500000000000002 111.094 167.731 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -58.24 -32.62 68.51 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.161 1.385 . . . . 2.7200000000000002 112.13 -179.869 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 42.4 mt -72.34 -16.24 61.87 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.468 1.285 . . . . 1.8400000000000001 114.468 175.972 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.536 ' CD ' ' HZ3' ' B' ' 92' ' ' LYS . 72.8 mm-40 -97.95 -18.23 18.76 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.743 1.217 . . . . 4.5 113.839 172.915 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -101.17 -40.79 7.01 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.21 1.804 . . . . 2.9300000000000002 113.268 -169.282 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -89.34 24.23 2.28 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 124.598 1.159 . . . . 2.8500000000000001 112.989 177.65 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 92' ' ' LYS . . . . . 0.536 ' HZ3' ' CD ' ' B' ' 89' ' ' GLU . 38.4 mttp . . . . . 0 C--O 1.246 0.916 0 C-N-CA 126.828 2.051 . . . . 4.7000000000000002 115.14 174.496 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.8 mmt . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 107.713 -1.217 . . . . 6.2599999999999998 107.713 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 -112.08 -95.7 0.43 Allowed 'General case' 0 CA--C 1.535 0.388 0 O-C-N 125.467 1.73 . . . . 4.3899999999999997 109.215 -152.102 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.4 p -136.05 153.24 76.71 Favored Pre-proline 0 N--CA 1.468 0.461 0 C-N-CA 124.814 1.246 . . . . 1.8200000000000001 108.145 169.912 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.18 -17.75 59.45 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.221 1.947 . . . . 1.3700000000000001 112.486 176.333 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 17.1 tp -85.74 -44.64 12.35 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 118.044 -0.979 . . . . 3.02 112.524 -179.09 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -58.2 -49.47 76.95 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.84 1.2 . . . . 4.0499999999999998 109.48 165.615 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -29.9 67.19 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.473 -0.767 . . . . 4.46 112.213 178.767 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.8 -51.2 58.5 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 117.449 -1.262 . . . . 1.05 112.112 172.369 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.7 mt -55.85 -48.3 75.76 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 120.208 1.367 . . . . 1.54 111.01 174.94 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 36.9 m -52.81 -49.93 64.67 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 125.175 1.39 . . . . 1.6399999999999999 110.405 173.292 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 86.4 m -61.38 -45.8 92.85 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 120.077 1.308 . . . . 1.7 112.494 177.858 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 79.0 mtp -54.24 -48.45 71.1 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.427 1.091 . . . . 3.3700000000000001 111.711 175.885 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 78.0 t -78.53 -33.81 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.484 0.714 . . . . 2.9500000000000002 112.059 -176.405 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.1 m -56.37 -55.84 28.53 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.458 1.103 . . . . 1.28 110.322 170.28 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.8 t -67.84 -33.35 74.6 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 117.376 -1.297 . . . . 2.4199999999999999 110.15 -172.822 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -55.17 -48.88 73.15 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.702 0.683 . . . . 1.8100000000000001 111.504 172.962 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 23.1 m170 -64.68 -34.95 79.52 Favored 'General case' 0 CA--C 1.549 0.925 0 O-C-N 120.863 -1.148 . . . . 3.6699999999999999 112.736 178.291 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.4 tmtm? -61.12 -25.22 66.83 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.692 1.197 . . . . 5.8200000000000003 113.503 173.468 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.408 ' CE2' HD23 ' A' ' 37' ' ' LEU . 69.3 m-85 -88.27 -30.51 19.6 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 120.677 -1.264 . . . . 3.1099999999999999 112.084 168.924 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.5 p -60.26 -19.5 55.03 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 117.425 2.38 . . . . 3.1299999999999999 117.425 -172.092 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.61 -7.67 53.33 Favored Glycine 0 CA--C 1.537 1.412 0 CA-C-O 118.394 -1.226 . . . . 1.75 115.721 -178.893 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 88.5 mtt-85 -77.54 53.07 1.03 Allowed 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 120.278 2.039 . . . . 5.3899999999999997 112.785 176.197 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 121.2 175.33 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 131.221 3.808 . . . . 4.1100000000000003 108.945 -176.031 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 9.68 113.18 0.0 OUTLIER Glycine 0 N--CA 1.481 1.66 0 C-N-CA 128.615 3.007 . . . . 2.6699999999999999 117.964 178.187 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.3 m 69.86 155.51 0.13 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.59 1.156 . . . . 2.6699999999999999 113.69 166.153 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -101.05 52.26 0.85 Allowed 'General case' 0 N--CA 1.483 1.194 0 O-C-N 120.541 -1.35 . . . . 5.5599999999999996 111.136 171.883 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 tt -161.03 -58.3 0.05 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.345 1.058 . . . . 3.2599999999999998 112.338 -172.515 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.9 p -84.64 156.07 21.7 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 127.453 2.301 . . . . 1.4399999999999999 113.284 -173.883 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 18.6 mt -92.07 94.77 9.41 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 114.704 -1.134 . . . . 1.6699999999999999 109.303 161.05 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.0 m -74.37 133.55 42.49 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 125.231 1.413 . . . . 3.7999999999999998 109.304 170.486 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -0.12 -70.34 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 127.687 2.395 . . . . 4.3899999999999997 117.107 -173.476 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.56 -36.68 83.43 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 119.481 -2.012 . . . . 4.0499999999999998 114.539 -175.583 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -57.74 -41.63 82.23 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.846 1.659 . . . . 2.77 110.563 175.518 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -66.05 -40.67 91.15 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.755 1.222 . . . . 2.3599999999999999 110.711 178.944 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.1 mtpt -65.3 -41.55 93.99 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 120.712 -1.242 . . . . 3.3100000000000001 113.154 175.327 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -56.23 -51.46 68.01 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-O 117.995 -1.002 . . . . 5.0800000000000001 112.543 170.075 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.408 HD23 ' CE2' ' A' ' 19' ' ' TYR . 1.7 tm? -52.61 -57.64 9.36 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.078 0.854 . . . . 2.9700000000000002 111.154 -178.506 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 46.0 mt -54.43 -46.35 70.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 118.367 0.531 . . . . 0.79000000000000004 110.784 -178.807 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -70.08 -9.6 55.96 Favored 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 113.767 1.025 . . . . 4.5999999999999996 113.767 -176.624 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.38 -13.34 9.79 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.527 1.931 . . . . 4.4100000000000001 113.15 -178.089 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -71.45 -51.91 21.32 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.801 1.641 . . . . 4.5599999999999996 108.776 158.062 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -115.81 124.18 50.08 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.471 2.309 . . . . 2.75 108.439 179.779 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 62.0 m -107.27 -8.86 16.24 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.767 1.025 . . . . 3.8399999999999999 113.767 -178.68 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -60.99 154.77 21.67 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 119.559 1.072 . . . . 3.96 113.409 172.172 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -72.85 11.88 4.2 Favored Glycine 0 CA--C 1.537 1.423 0 N-CA-C 116.281 1.273 . . . . 3.9399999999999999 116.281 -169.315 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -85.45 -27.03 25.98 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.964 2.105 . . . . 5.6900000000000004 112.08 178.366 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.69 86.92 7.34 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 123.2 1.476 . . . . 2.6299999999999999 112.151 -178.518 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 72.7 mttt -132.14 170.63 14.72 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 127.662 2.385 . . . . 4.9800000000000004 111.245 -177.552 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.96 -46.8 71.71 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.293 -0.88 . . . . 4.2000000000000002 113.039 -164.81 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.8 m -63.04 -25.49 68.4 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.366 1.617 . . . . 2.77 115.366 176.403 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.6 p -94.56 6.78 47.8 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.513 1.125 . . . . 2.8900000000000001 112.735 171.554 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 28.2 mt -125.32 -35.48 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.885 1.274 . . . . 1.3300000000000001 113.448 -173.546 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -82.55 -29.47 30.31 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.478 1.035 . . . . 3.9700000000000002 112.244 179.27 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -66.62 -45.09 80.23 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 118.513 0.597 . . . . 2.46 110.052 158.683 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.5 tp -59.75 -39.38 84.57 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 118.552 -0.737 . . . . 1.79 110.636 -177.806 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.1 tpt -51.75 -59.5 4.23 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 119.241 0.928 . . . . 2.1499999999999999 109.996 165.853 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.19 -19.16 19.04 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 125.808 1.643 . . . . 3.96 115.008 176.367 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.8 m -98.98 -29.42 12.93 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.723 2.009 . . . . 3.1600000000000001 113.515 -178.006 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 97.5 mt -83.27 -42.81 16.76 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.494 1.518 . . . . 1.8899999999999999 111.814 170.873 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -73.76 81.28 1.59 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.418 2.287 . . . . 2.0099999999999998 111.663 -175.694 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -51.7 -32.45 30.06 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 115.247 1.573 . . . . 3.0600000000000001 115.247 -173.014 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -81.88 -11.96 58.67 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.973 1.101 . . . . 1.9399999999999999 113.973 178.793 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.8 t 55.4 45.53 25.16 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.558 1.143 . . . . 2.4399999999999999 111.72 -169.387 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -102.33 -131.89 0.27 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.575 1.95 . . . . 2.96 107.796 178.876 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -142.47 1.06 1.34 Allowed 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 120.337 1.426 . . . . 3.7599999999999998 114.741 164.326 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -103.07 134.17 46.95 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 126.485 1.914 . . . . 2.3500000000000001 109.324 173.548 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.7 mm -96.47 114.06 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 126.581 1.952 . . . . 1.4299999999999999 109.914 171.965 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -88.77 157.2 18.57 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.879 1.271 . . . . 2.6899999999999999 108.759 163.401 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -49.85 -42.17 46.82 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.326 -1.484 . . . . 2.3100000000000001 114.44 -177.394 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.457 ' H ' ' HD2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -69.85 -11.43 60.85 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 114.524 1.305 . . . . 3.1800000000000002 114.524 176.791 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -84.84 -56.06 3.77 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 124.929 1.292 . . . . 1.8 108.004 162.157 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -50.02 -45.14 51.71 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.192 1.797 . . . . 2.3100000000000001 115.771 -176.209 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.9 m -65.03 -8.61 16.84 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 120.793 -1.192 . . . . 2.0099999999999998 113.468 -177.313 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 99.7 t -62.24 -37.02 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 119.585 1.084 . . . . 2.2200000000000002 110.939 167.32 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -65.66 -52.35 52.35 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.18 0.992 . . . . 2.1299999999999999 110.036 178.083 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -55.67 -44.51 77.33 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.627 1.171 . . . . 2.2799999999999998 110.783 176.844 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.3 m -58.53 -52.32 66.15 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.764 0.826 . . . . 0.87 111.855 173.831 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 73.3 mtm -61.92 -35.58 78.82 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.229 0.922 . . . . 1.45 112.404 -179.476 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.75 -50.5 42.74 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 123.857 0.863 . . . . 2.98 111.623 175.715 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 28.1 m -60.66 -33.79 73.33 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 118.42 -0.8 . . . . 1.3799999999999999 112.737 174.428 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 62.6 mtp -70.58 -37.36 73.94 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.008 0.822 . . . . 2.1800000000000002 111.795 172.554 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.51 -41.63 92.97 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 119.571 1.078 . . . . 0.85999999999999999 111.047 173.5 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -70.85 -32.7 69.8 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.702 1.137 . . . . 2.3900000000000001 113.614 175.406 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -58.41 -52.28 66.28 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.407 1.083 . . . . 3.0600000000000001 110.718 168.189 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -67.95 -41.59 82.25 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.558 1.143 . . . . 4.1600000000000001 112.643 -177.262 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.63 -48.93 79.73 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.909 1.684 . . . . 2.6400000000000001 110.576 173.055 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -58.59 -36.96 74.82 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 123.974 0.91 . . . . 3.4199999999999999 111.991 -179.89 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 54.5 mt -72.87 -15.89 61.59 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.37 1.068 . . . . 2.7200000000000002 113.264 177.365 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -106.41 -7.85 17.44 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.433 1.493 . . . . 3.7599999999999998 114.505 175.963 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -108.41 -51.38 2.9 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.412 1.485 . . . . 3.48 112.375 -175.114 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -82.86 27.1 0.55 Allowed 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 125.122 1.369 . . . . 2.5800000000000001 113.085 179.561 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.252 1.199 0 C-N-CA 128.337 2.655 . . . . 3.9399999999999999 115.685 -178.182 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.473 0.714 0 N-CA-C 108.256 -1.016 . . . . 10.539999999999999 108.256 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -146.2 -72.77 0.23 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.861 2.064 . . . . 6.1699999999999999 111.697 -160.68 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 44.3 p -97.08 161.36 26.49 Favored Pre-proline 0 N--CA 1.468 0.461 0 C-N-CA 125.783 1.633 . . . . 2.25 111.279 -154.664 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -62.06 -21.21 72.0 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 121.887 1.725 . . . . 1.3899999999999999 111.696 171.122 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -85.96 -39.54 16.8 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-O 116.683 -1.627 . . . . 2.8199999999999998 113.837 178.101 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -57.69 -37.9 74.25 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 121.925 2.148 . . . . 5.1799999999999997 110.665 166.663 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -72.95 -26.71 61.47 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.087 -1.008 . . . . 4.7999999999999998 112.718 178.14 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.05 -44.53 38.67 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.218 0.607 . . . . 1.0600000000000001 112.004 171.454 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 58.2 mt -57.13 -45.61 83.35 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.987 1.315 . . . . 1.79 110.936 175.843 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 20.6 p -68.16 -43.57 77.94 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 116.875 -1.536 . . . . 2.2400000000000002 112.501 175.385 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 52.7 m -55.55 -43.18 75.61 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 120.567 1.531 . . . . 1.54 111.028 172.312 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -51.88 66.35 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.121 0.968 . . . . 4.0499999999999998 110.019 178.815 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 75.7 t -64.26 -31.78 54.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 O-C-N 121.158 -0.964 . . . . 1.8999999999999999 112.907 176.436 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 81.2 m -60.72 -57.89 10.76 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.543 1.137 . . . . 1.1399999999999999 109.841 176.135 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.44 -28.34 61.91 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 123.918 0.761 . . . . 3.1499999999999999 110.006 -173.598 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -55.85 -53.87 51.46 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-O 119.129 -0.462 . . . . 1.9199999999999999 110.571 166.573 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 49.0 m80 -70.28 -33.62 71.79 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 120.18 1.355 . . . . 2.6600000000000001 113.076 -178.609 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -64.26 -27.52 69.1 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.042 1.127 . . . . 4.9000000000000004 114.042 174.483 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -100.23 -34.55 9.97 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.993 1.317 . . . . 2.3199999999999998 112.995 177.8 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 7.4 t -82.03 -33.19 30.1 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 126.003 1.721 . . . . 2.0899999999999999 113.331 -178.69 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.54 -11.17 83.47 Favored Glycine 0 CA--C 1.525 0.68 0 O-C-N 120.949 -1.095 . . . . 1.6100000000000001 112.514 170.046 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -57.52 -41.14 80.28 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.671 1.236 . . . . 4.6100000000000003 112.402 -167.791 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -139.22 152.88 47.7 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 126.606 1.962 . . . . 4.9699999999999998 111.676 179.529 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 60.75 2.2 2.35 Favored Glycine 0 CA--C 1.535 1.324 0 O-C-N 121.112 -0.993 . . . . 2.1800000000000002 113.509 -165.302 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 6.0 t 59.47 -154.54 0.37 Allowed 'General case' 0 C--O 1.254 1.315 0 C-N-CA 126.022 1.729 . . . . 6.5199999999999996 111.477 -159.398 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 72.4 mttt 85.07 174.79 0.06 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 129.975 3.31 . . . . 10.65 113.738 156.16 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -76.71 19.33 0.28 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.68 0.792 . . . . 2.8799999999999999 112.721 158.0 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 69.7 p -121.06 132.83 55.12 Favored 'General case' 0 C--O 1.251 1.168 0 CA-C-O 122.978 1.371 . . . . 1.3100000000000001 113.588 -177.096 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -111.42 111.15 21.98 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 112.537 -2.12 . . . . 2.1600000000000001 110.913 177.13 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -88.29 170.02 11.34 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 121.517 0.675 . . . . 2.6699999999999999 111.789 166.364 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 -43.93 -29.59 0.59 Allowed 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 118.928 2.936 . . . . 3.2000000000000002 118.928 -162.803 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.92 -36.47 23.29 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.389 1.255 . . . . 5.2000000000000002 114.389 173.0 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -63.58 -49.58 72.81 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 106.845 -1.539 . . . . 2.1200000000000001 106.845 171.609 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 57.9 tp -56.13 -47.56 77.92 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.644 0.778 . . . . 2.5699999999999998 112.808 174.18 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -58.33 -44.4 88.65 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.394 0.997 . . . . 2.98 111.865 -176.245 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -79.79 -17.66 52.83 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.215 1.561 . . . . 4.1900000000000004 115.215 -179.65 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 2.3 tt -72.32 -54.99 7.9 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.983 1.265 . . . . 1.8799999999999999 110.695 165.795 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 33.4 mt -53.24 -44.57 53.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 CA-C-N 119.42 1.009 . . . . 1.03 110.688 -173.565 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -63.13 -13.93 42.58 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.044 1.127 . . . . 4.1399999999999997 114.044 -177.091 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -95.06 -18.67 20.81 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.471 1.908 . . . . 3.1499999999999999 112.607 176.159 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -96.02 -56.62 2.59 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.828 1.651 . . . . 5.8700000000000001 109.894 178.189 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -99.19 71.65 1.82 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.122 1.369 . . . . 2.7400000000000002 109.574 -179.237 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 14.2 p -73.33 -2.42 22.03 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.014 0.926 . . . . 4.6200000000000001 113.285 167.245 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.419 HD23 ' H ' ' B' ' 44' ' ' LEU . 2.2 pt? -138.39 162.57 34.08 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.854 2.461 . . . . 4.7800000000000002 110.371 -178.88 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.13 -129.83 10.03 Favored Glycine 0 N--CA 1.468 0.83 0 N-CA-C 108.884 -1.687 . . . . 5.3799999999999999 108.884 -165.43 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -148.62 64.73 1.06 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 122.761 1.267 . . . . 5.7000000000000002 111.805 168.139 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.15 66.78 3.01 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 123.871 1.795 . . . . 2.2200000000000002 112.019 176.303 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -63.31 143.92 57.39 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.106 -1.406 . . . . 4.25 109.614 165.199 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -57.78 -24.92 59.53 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.643 1.349 . . . . 4.4299999999999997 114.643 -174.342 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 8.6 t -78.45 -27.74 46.46 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 120.732 -1.23 . . . . 2.6899999999999999 113.71 172.332 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 3.6 m -65.87 -17.01 64.36 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.247 0.931 . . . . 2.6400000000000001 111.848 175.307 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 39.9 mm -64.53 -38.96 83.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 125.34 1.456 . . . . 1.6100000000000001 112.031 177.475 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.28 -30.07 65.83 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.509 1.123 . . . . 3.1600000000000001 112.311 -177.1 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -83.71 -40.67 18.58 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.776 0.83 . . . . 2.5899999999999999 112.27 172.793 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.35 -35.32 77.12 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.343 -0.848 . . . . 2.7200000000000002 110.819 173.483 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 2.5 ttt -52.79 -51.62 60.0 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 118.874 -0.584 . . . . 2.1200000000000001 110.93 167.574 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -71.81 -27.14 62.72 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.58 1.082 . . . . 5.79 113.008 -178.112 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 8.6 t -61.08 -31.82 71.49 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 113.868 1.062 . . . . 2.2000000000000002 113.868 168.64 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -114.6 -29.69 6.74 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 116.939 2.2 . . . . 2.6299999999999999 116.939 -176.119 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -76.29 85.14 3.08 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 124.725 1.21 . . . . 1.6399999999999999 107.809 168.419 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -47.43 -35.67 8.83 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.832 1.419 . . . . 4.7800000000000002 114.832 -164.943 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 44.1 p30 -96.58 -14.5 22.17 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.724 1.379 . . . . 2.6099999999999999 114.724 -179.917 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 70.9 m 53.98 62.97 2.35 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.932 1.293 . . . . 3.4900000000000002 111.644 -167.158 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 14.2 p30 -87.92 -79.49 0.29 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.044 1.338 . . . . 2.9300000000000002 108.787 177.306 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -178.92 -27.54 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 129.812 3.245 . . . . 5.5899999999999999 112.66 168.57 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -113.64 142.41 46.04 Favored 'General case' 0 C--O 1.242 0.667 0 C-N-CA 126.475 1.91 . . . . 2.7200000000000002 108.942 -174.366 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 6.3 mt -119.99 109.59 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 123.586 0.754 . . . . 1.5700000000000001 111.18 -176.451 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -84.06 157.61 21.73 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.008 2.123 . . . . 3.8100000000000001 110.987 172.731 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.93 -33.96 39.73 Favored 'General case' 0 CA--C 1.551 1.01 0 O-C-N 120.578 -1.326 . . . . 2.3999999999999999 114.11 179.92 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -75.67 -19.28 59.26 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 119.982 -1.699 . . . . 5.29 112.874 176.669 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -78.64 -63.65 1.36 Allowed 'General case' 0 CA--C 1.551 0.981 0 O-C-N 121.004 -1.06 . . . . 2.1800000000000002 108.624 160.727 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -58.03 -22.49 50.15 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.381 2.672 . . . . 2.27 117.093 -172.387 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 2.3 p -58.54 -21.35 52.17 Favored 'General case' 0 N--CA 1.481 1.075 0 O-C-N 119.117 -2.24 . . . . 2.8999999999999999 112.718 170.48 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.4 p -71.2 -33.33 50.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 O-C-N 121.55 -0.718 . . . . 2.4500000000000002 112.432 171.93 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -62.97 -51.72 65.78 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.197 0.908 . . . . 1.98 110.833 174.611 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 92.2 mt -53.51 -37.65 62.97 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.069 0.948 . . . . 1.79 111.687 174.678 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 55.1 m -74.26 -39.33 63.08 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.42 1.088 . . . . 1.6299999999999999 113.205 179.315 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.1 mtm -64.05 -44.97 90.87 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.491 1.041 . . . . 2.1600000000000001 110.95 172.837 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 71.6 mt -63.31 -46.09 88.32 Favored 'General case' 0 CA--C 1.528 0.098 0 CA-C-O 118.495 -0.764 . . . . 2.0099999999999998 112.176 178.191 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.9 p -59.71 -34.61 73.12 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.793 1.179 . . . . 3.98 112.655 178.834 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 20.9 mtp -72.34 -30.73 65.01 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.519 1.303 . . . . 2.48 114.519 173.002 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.27 -33.26 74.93 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 120.62 1.555 . . . . 1.28 111.536 171.543 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -73.07 -26.54 61.3 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.723 1.008 . . . . 2.8500000000000001 113.723 173.773 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -55.44 -53.8 51.81 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.93 1.241 . . . . 3.0600000000000001 110.213 166.008 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.17 -31.94 72.69 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.367 1.067 . . . . 3.6200000000000001 113.082 -175.861 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.0 -40.89 99.15 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.814 1.246 . . . . 2.5299999999999998 112.186 170.837 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -74.45 -30.3 61.83 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.331 1.452 . . . . 3.2200000000000002 112.134 176.563 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 34.9 mt -66.84 -30.1 70.2 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 117.289 -1.339 . . . . 2.6299999999999999 113.589 179.915 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -83.21 -6.31 59.43 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 114.363 1.246 . . . . 4.1699999999999999 114.363 174.834 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -92.92 -53.39 4.17 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.663 0.785 . . . . 4.5499999999999998 110.897 169.141 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -75.84 12.84 0.96 Allowed 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.798 1.407 . . . . 4.0599999999999996 114.798 -168.296 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.937 0 C-N-CA 128.978 2.911 . . . . 5.1900000000000004 113.334 179.71 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.5 mtt . . . . . 0 N--CA 1.477 0.91 0 N-CA-C 107.525 -1.287 . . . . 6.6100000000000003 107.525 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.3 mp0 -114.57 -95.74 0.46 Allowed 'General case' 0 CA--C 1.54 0.577 0 O-C-N 124.778 1.298 . . . . 4.4800000000000004 110.953 -151.172 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -140.72 155.83 69.21 Favored Pre-proline 0 N--CA 1.474 0.753 0 C-N-CA 124.648 1.179 . . . . 2.0 109.352 176.781 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.18 -20.78 27.93 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.434 2.089 . . . . 1.3899999999999999 112.963 -179.066 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 tt -82.68 -41.15 19.71 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.271 1.028 . . . . 2.6099999999999999 110.438 174.482 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.431 ' CD ' ' HZ2' ' A' ' 7' ' ' LYS . 4.0 tm-20 -64.97 -38.69 91.8 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.632 0.73 . . . . 3.73 109.944 175.315 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.483 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -70.57 -34.14 71.87 Favored 'General case' 0 C--O 1.232 0.159 0 O-C-N 120.546 -1.346 . . . . 4.9900000000000002 113.32 176.569 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.82 -47.61 82.13 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.567 0.747 . . . . 1.1000000000000001 111.934 169.23 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.3 mt -64.7 -36.02 82.93 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.463 1.029 . . . . 1.8 112.857 173.406 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 57.8 m -61.06 -42.33 98.3 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.995 0.918 . . . . 1.4099999999999999 111.437 172.537 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.5 m -57.93 -34.15 69.57 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.084 1.353 . . . . 1.5800000000000001 111.689 -178.958 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 10.2 mmt -53.65 -65.94 0.48 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.087 1.355 . . . . 3.1699999999999999 111.068 174.355 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.3 m -63.1 -28.39 44.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 CA-C-N 118.792 0.724 . . . . 2.1299999999999999 112.546 -176.162 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.0 m -70.01 -48.24 58.88 Favored 'General case' 0 CA--C 1.502 -0.877 0 C-N-CA 125.618 1.567 . . . . 1.48 112.691 -178.826 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.24 -35.48 48.24 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 117.772 -1.109 . . . . 2.9900000000000002 108.859 177.524 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.4 t80 -53.24 -45.13 68.62 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.994 0.918 . . . . 2.2000000000000002 111.897 -177.168 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.3 m80 -69.38 -11.97 61.27 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.671 1.36 . . . . 2.6400000000000001 114.671 -175.839 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -30.11 66.17 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 120.661 -1.274 . . . . 4.0800000000000001 111.11 170.562 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -102.98 -46.59 4.61 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.922 1.289 . . . . 2.0499999999999998 112.234 -176.888 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.7 p -65.41 -24.3 67.17 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 124.629 1.172 . . . . 2.3100000000000001 113.764 -178.597 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.09 7.42 60.07 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 127.357 2.408 . . . . 1.3100000000000001 115.6 177.607 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -87.26 -102.35 0.07 Allowed 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.053 1.426 . . . . 4.6600000000000001 109.903 170.792 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -66.78 161.99 22.46 Favored 'General case' 0 C--O 1.246 0.889 0 C-N-CA 124.772 1.229 . . . . 4.9800000000000004 113.421 -176.482 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.42 -134.55 51.75 Favored Glycine 0 C--N 1.341 0.816 0 C-N-CA 125.266 1.412 . . . . 1.8999999999999999 111.925 163.759 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.0 t -69.23 151.38 46.37 Favored 'General case' 0 C--O 1.251 1.159 0 CA-C-O 123.26 1.505 . . . . 3.0499999999999998 112.262 163.359 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -73.26 -22.2 60.45 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.989 0.916 . . . . 5.6399999999999997 112.958 171.174 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 28.8 tp -83.55 -11.18 57.71 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.307 1.043 . . . . 3.8399999999999999 112.65 175.748 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.0 p -115.59 154.33 29.61 Favored 'General case' 0 C--O 1.246 0.873 0 C-N-CA 125.981 1.712 . . . . 1.22 112.118 -177.367 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.4 ' HA ' ' OE1' ' A' ' 33' ' ' GLU 0.316 0.3 OUTLIER -121.6 108.18 13.27 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.862 1.06 . . . . 1.8600000000000001 113.862 166.582 . . . . . . . . 4 4 . 1 . 030 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.0 t -71.77 174.16 7.23 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 124.661 1.184 . . . . 2.48 113.993 174.336 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.446 HH21 ' CG ' ' A' ' 53' ' ' ASP . 19.1 ttt-85 -66.33 8.95 0.18 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 115.75 1.759 . . . . 4.4299999999999997 115.75 -170.181 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.06 -37.92 2.89 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 119.979 -1.7 . . . . 5.2000000000000002 112.381 166.279 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.4 ' OE1' ' HA ' ' A' ' 29' ' ' LEU . 35.7 mt-10 -52.67 -54.55 31.95 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.434 1.016 . . . . 1.54 111.007 165.834 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 22.0 tp -74.66 -32.55 62.28 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.54 0.736 . . . . 2.5499999999999998 112.476 -176.423 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -51.92 -47.85 64.46 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.631 0.651 . . . . 3.5 111.119 171.519 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.513 ' HG3' ' HE2' ' A' ' 40' ' ' LYS . 13.1 tp10 -91.64 4.06 53.58 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.08 1.141 . . . . 4.8099999999999996 114.08 -175.222 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 tt -78.49 -61.93 1.85 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.452 1.101 . . . . 1.8600000000000001 108.849 154.661 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.8 mt -51.32 -44.61 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 125.095 1.358 . . . . 0.89000000000000001 110.65 -178.214 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.02 -20.01 64.91 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.838 1.051 . . . . 3.9700000000000002 113.838 -177.007 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.513 ' HE2' ' HG3' ' A' ' 36' ' ' GLU . 43.2 mttm -102.36 -38.71 7.49 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 124.883 1.273 . . . . 2.75 112.336 179.508 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -58.9 -77.56 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 128.958 2.903 . . . . 4.7300000000000004 109.464 171.29 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.5 mt -81.04 48.2 1.09 Allowed 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.569 -1.332 . . . . 2.6000000000000001 112.798 -179.265 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.37 14.04 0.08 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 125.19 1.396 . . . . 3.21 114.485 176.794 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.429 HD23 ' H ' ' A' ' 44' ' ' LEU . 1.7 pt? -122.69 -3.15 8.77 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.181 2.192 . . . . 3.8300000000000001 114.436 -178.045 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -114.75 -178.99 18.85 Favored Glycine 0 N--CA 1.473 1.154 0 C-N-CA 124.867 1.223 . . . . 3.6000000000000001 114.208 -177.694 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -71.67 34.12 0.06 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 127.906 2.482 . . . . 6.3600000000000003 113.897 -176.359 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -81.46 53.98 2.22 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.668 2.387 . . . . 1.8600000000000001 115.821 -153.478 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.6 tttt -81.85 166.64 19.78 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 128.282 2.633 . . . . 6.0599999999999996 111.259 -179.899 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -45.79 -53.39 9.65 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.31 1.044 . . . . 5.71 113.332 -174.111 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.7 m -70.88 -31.15 67.73 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 113.923 1.082 . . . . 2.3399999999999999 113.923 178.819 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.2 m -65.16 -20.46 66.46 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.908 0.883 . . . . 2.3799999999999999 112.225 171.531 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 59.1 mt -93.8 -30.67 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 126.288 1.835 . . . . 1.22 111.314 174.043 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.446 ' CG ' HH21 ' A' ' 31' ' ' ARG . 5.6 t0 -70.45 -43.54 69.66 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.505 1.122 . . . . 3.1099999999999999 112.316 -178.233 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -69.11 -31.92 70.96 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.141 -0.974 . . . . 3.4500000000000002 111.502 174.431 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.71 -54.66 42.58 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.395 1.078 . . . . 2.7599999999999998 109.482 172.03 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.5 mmm -52.33 -41.14 62.75 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 127.257 2.223 . . . . 2.6699999999999999 112.038 174.403 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -26.94 66.82 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.561 1.545 . . . . 4.3899999999999997 113.043 177.639 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.6 t -92.69 -20.53 20.72 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.346 -1.471 . . . . 2.6600000000000001 113.272 171.97 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.3 -42.37 93.14 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 127.759 2.424 . . . . 2.9700000000000002 111.682 172.159 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -87.2 154.86 20.39 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 115.148 1.536 . . . . 1.96 115.148 -177.051 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -125.76 10.99 7.79 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 126.074 1.75 . . . . 3.0800000000000001 113.805 177.408 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -137.37 -34.94 0.69 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 116.064 1.876 . . . . 2.02 116.064 -162.563 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 75.07 26.95 1.18 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.701 1.601 . . . . 3.0899999999999999 111.551 -161.825 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 39.1 p-10 -93.73 -16.88 23.78 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.482 1.513 . . . . 2.3300000000000001 112.64 -169.84 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 68.78 -0.09 2.49 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.659 2.383 . . . . 4.2699999999999996 115.59 -178.333 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -101.25 140.85 34.98 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 122.244 1.021 . . . . 2.75 110.035 160.546 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 48.6 mm -100.25 113.5 36.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 106.622 -1.622 . . . . 1.1699999999999999 106.622 164.988 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.66 161.05 28.85 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.903 1.281 . . . . 2.5699999999999998 111.465 172.701 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -58.38 -26.69 63.49 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 115.008 1.485 . . . . 2.3599999999999999 115.008 -176.272 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.2 mtmm -79.82 -32.54 40.68 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.755 -1.215 . . . . 4.1200000000000001 112.397 173.222 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -60.67 -46.97 88.32 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 109.319 -0.623 . . . . 1.8999999999999999 109.319 168.94 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -58.28 -32.41 68.39 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.189 1.796 . . . . 2.3999999999999999 113.856 173.281 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.3 m -61.21 -29.84 70.06 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 119.603 -1.936 . . . . 2.5499999999999998 113.178 168.127 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 43.1 t -73.85 -36.07 44.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 O-C-N 121.127 -0.983 . . . . 2.9300000000000002 110.881 175.926 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -61.94 -51.44 68.09 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 118.911 0.778 . . . . 1.9399999999999999 112.853 170.842 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.4 mt -59.3 -33.29 70.92 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.467 0.707 . . . . 2.0099999999999998 111.578 174.95 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 92.7 m -60.52 -47.48 85.98 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 118.231 -0.89 . . . . 1.1100000000000001 111.346 168.919 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 16.1 mtm -58.08 -44.51 87.62 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 120.118 1.326 . . . . 1.79 112.022 177.441 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.0 mt -71.21 -43.63 66.98 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.546 0.612 . . . . 1.6399999999999999 112.632 -179.189 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 9.9 t -66.09 -26.37 67.44 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.294 -0.878 . . . . 1.51 112.852 175.462 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 76.7 mtp -72.45 -40.11 67.28 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.306 -0.871 . . . . 1.74 112.472 166.03 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.17 -38.5 89.27 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.571 1.078 . . . . 1.3500000000000001 112.757 -178.963 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -65.11 -24.07 67.33 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.839 1.052 . . . . 2.2400000000000002 113.839 171.648 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -70.92 -44.11 66.86 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.3 0.954 . . . . 2.9300000000000002 112.864 179.009 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -60.22 -47.32 86.46 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.766 1.227 . . . . 3.1400000000000001 110.66 170.959 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -50.84 -40.84 56.92 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.907 1.283 . . . . 2.6299999999999999 112.672 176.919 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -70.61 -30.78 67.53 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.001 1.321 . . . . 2.0600000000000001 112.966 179.304 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 60.2 mt -78.55 -20.6 50.3 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.21 1.004 . . . . 1.6100000000000001 112.278 176.612 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.445 ' HA ' ' HE2' ' A' ' 92' ' ' LYS . 59.3 mm-40 -90.01 -6.67 55.34 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.553 1.316 . . . . 3.79 114.553 174.487 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -100.11 -54.22 2.94 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.359 1.863 . . . . 2.8100000000000001 112.946 178.63 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.03 45.96 0.56 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.155 1.782 . . . . 2.6000000000000001 112.758 -177.096 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.445 ' HE2' ' HA ' ' A' ' 89' ' ' GLU . 52.0 mmtt . . . . . 0 C--O 1.252 1.237 0 C-N-CA 128.25 2.62 . . . . 3.4300000000000002 114.98 173.064 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 107.987 -1.116 . . . . 6.2199999999999998 107.987 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 10.1 mp0 -104.51 -67.37 0.91 Allowed 'General case' 0 CA--C 1.538 0.501 0 O-C-N 124.93 1.394 . . . . 4.7699999999999996 112.677 -148.597 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 1.3 t -162.58 149.86 11.22 Favored Pre-proline 0 N--CA 1.473 0.691 0 C-N-CA 124.315 1.046 . . . . 2.46 110.727 -166.334 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -62.54 -18.84 65.63 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 122.961 2.441 . . . . 1.3 114.089 175.869 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.7 -54.65 6.36 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.93 1.241 . . . . 2.6000000000000001 111.169 179.49 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -62.88 -30.97 71.92 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.931 0.787 . . . . 4.7599999999999998 110.657 174.482 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -62.98 -45.78 90.81 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 119.927 -1.733 . . . . 7.8399999999999999 111.471 166.512 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.5 -50.62 73.1 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.426 1.09 . . . . 0.90000000000000002 111.1 177.566 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 70.5 mt -56.99 -47.04 81.74 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.493 1.117 . . . . 1.52 111.704 172.696 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 96.9 m -56.53 -44.38 80.76 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.488 0.715 . . . . 1.4199999999999999 111.362 175.222 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 91.8 m -63.69 -44.56 93.32 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.406 1.482 . . . . 1.4099999999999999 109.842 179.336 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 79.7 mtp -57.13 -51.36 69.62 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.561 0.744 . . . . 3.0699999999999998 110.617 174.376 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 53.2 t -63.39 -30.45 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 N-CA-C 113.367 0.877 . . . . 1.8400000000000001 113.367 176.422 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 82.4 m -62.79 -52.6 62.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.877 1.271 . . . . 0.89000000000000001 110.246 174.717 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -31.78 69.37 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 118.545 -0.741 . . . . 1.6499999999999999 111.311 169.636 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -69.06 -58.41 4.13 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 118.642 0.655 . . . . 2.1000000000000001 111.942 -175.398 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -73.53 -12.31 60.73 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 120.307 1.412 . . . . 2.3799999999999999 114.281 177.287 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -67.51 -66.92 0.5 Allowed 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.247 -0.908 . . . . 4.2800000000000002 111.626 157.702 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -70.93 -32.53 69.46 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.73 1.011 . . . . 2.1299999999999999 113.73 -172.517 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 8.2 p -65.1 -18.32 65.2 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 120.477 -1.389 . . . . 2.0699999999999998 112.225 169.301 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.64 9.25 77.45 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 126.048 1.785 . . . . 1.74 114.777 171.058 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -72.72 -24.22 60.96 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.597 1.698 . . . . 3.9199999999999999 112.304 174.262 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -161.4 152.67 18.67 Favored 'General case' 0 C--O 1.252 1.214 0 C-N-CA 125.415 1.486 . . . . 3.3399999999999999 111.91 179.494 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.84 -131.34 52.0 Favored Glycine 0 C--N 1.339 0.697 0 C-N-CA 126.013 1.768 . . . . 2.7400000000000002 111.061 168.018 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.5 m -57.65 125.49 23.16 Favored 'General case' 0 C--O 1.248 1.025 0 O-C-N 122.139 -0.624 . . . . 3.1800000000000002 110.246 166.34 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -74.83 66.86 1.56 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.997 2.119 . . . . 8.0899999999999999 109.667 158.226 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 63.8 tp -167.97 -53.88 0.02 OUTLIER 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 127.526 2.33 . . . . 2.7200000000000002 107.728 -176.54 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 60.7 p -94.84 158.1 15.64 Favored 'General case' 0 C--O 1.252 1.196 0 C-N-CA 125.752 1.621 . . . . 1.23 112.911 176.429 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -103.82 116.8 32.95 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 127.05 2.14 . . . . 2.6499999999999999 109.701 169.112 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 3.0 p -74.34 165.98 24.26 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.141 0.576 . . . . 2.3900000000000001 111.602 164.674 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 15.8 tpp180 -41.49 -33.01 0.38 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.517 1.927 . . . . 4.7000000000000002 113.778 167.98 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.61 -40.11 12.81 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 120.698 -1.251 . . . . 4.4900000000000002 113.753 -179.353 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -56.84 -44.08 81.75 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.45 0.643 . . . . 2.02 110.457 170.564 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 tp -66.75 -44.31 81.81 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.35 1.06 . . . . 2.0600000000000001 112.138 -179.498 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -57.38 -37.25 72.36 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.804 1.242 . . . . 2.9399999999999999 113.175 178.631 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -62.96 -65.76 0.64 Allowed 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 117.839 -1.077 . . . . 3.75 111.087 168.831 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 tp -48.06 -57.31 5.98 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 127.779 2.432 . . . . 2.2200000000000002 112.024 -175.107 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 34.9 mt -56.17 -56.87 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.065 0.848 . . . . 1.29 110.135 -177.395 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -24.02 66.13 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.632 0.773 . . . . 5.4299999999999997 112.446 -174.111 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.95 -31.84 12.89 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.092 1.757 . . . . 6.21 112.835 -173.586 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.6 mm-40 -97.04 -21.22 17.51 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 119.407 1.003 . . . . 5.25 112.712 176.924 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -113.31 118.27 34.15 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 119.712 1.142 . . . . 2.2000000000000002 108.488 171.755 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 15.7 p -139.55 10.73 2.49 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.756 1.222 . . . . 3.2400000000000002 113.623 -175.103 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -68.92 -42.9 76.18 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.615 1.566 . . . . 3.2000000000000002 111.088 -177.265 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -96.88 165.4 23.13 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 110.211 -1.156 . . . . 3.0800000000000001 110.211 156.475 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.91 96.88 0.45 Allowed 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.899 -1.149 . . . . 5.4800000000000004 107.899 165.891 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 8.0 tpt -72.27 75.93 0.99 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.396 1.879 . . . . 2.8500000000000001 112.263 -168.088 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.44 ' H ' ' HE2' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -83.49 163.73 20.29 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.731 1.613 . . . . 3.8100000000000001 114.45 -161.669 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -47.82 -59.95 2.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.775 1.63 . . . . 5.0 112.057 177.839 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 13.1 m -71.77 6.09 2.17 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 115.179 1.548 . . . . 2.6000000000000001 115.179 178.973 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 34.3 p -119.83 16.73 12.67 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.768 -1.208 . . . . 2.79 112.554 163.708 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 35.1 mt -110.42 -47.64 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.018 0.927 . . . . 1.55 111.976 171.691 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -71.89 -30.43 65.38 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.996 1.271 . . . . 3.0699999999999998 113.255 -173.386 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -65.52 -37.05 85.64 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.924 0.784 . . . . 2.4199999999999999 111.5 167.56 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 10.0 tt -60.93 -43.54 98.49 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 117.73 -1.129 . . . . 2.6200000000000001 110.097 176.092 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 6.3 ttt -59.34 -50.55 73.55 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 120.099 1.318 . . . . 1.8700000000000001 113.276 170.632 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.0 tmtt? -52.49 -33.32 44.25 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.71 1.204 . . . . 4.2699999999999996 112.195 173.272 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 63.3 m -86.58 -22.94 25.98 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.758 1.623 . . . . 2.5299999999999998 113.532 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 9.5 mt -70.16 -42.18 72.84 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 120.159 1.345 . . . . 1.9199999999999999 110.877 169.386 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.71 141.53 43.58 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.235 1.414 . . . . 2.6400000000000001 113.093 -179.929 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 33.9 mmtm -124.21 -1.06 8.23 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.69 1.196 . . . . 3.23 113.066 172.432 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 31.4 p-10 -113.47 -48.84 2.92 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.642 1.977 . . . . 2.4199999999999999 111.125 167.345 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 5.0 t 94.62 111.12 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 129.399 3.08 . . . . 2.3500000000000001 107.879 -167.29 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 p30 -155.69 -135.46 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 122.037 0.922 . . . . 3.0800000000000001 109.0 -173.475 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -140.58 5.63 2.02 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 114.544 1.313 . . . . 5.1299999999999999 114.544 175.856 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -132.32 136.89 47.19 Favored 'General case' 0 C--O 1.246 0.898 0 C-N-CA 127.393 2.277 . . . . 3.5099999999999998 111.998 -174.306 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 31.8 mm -108.71 122.27 63.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 126.08 1.752 . . . . 1.3 108.456 169.186 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -98.44 -174.48 2.83 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.594 1.957 . . . . 3.0699999999999998 110.994 169.239 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -25.11 65.31 Favored 'General case' 0 CA--C 1.551 0.985 0 O-C-N 120.456 -1.402 . . . . 2.8199999999999998 114.374 177.456 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -71.65 -46.68 58.26 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.436 -1.415 . . . . 5.9299999999999997 112.079 174.137 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -63.11 -48.73 77.31 Favored 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 118.829 0.741 . . . . 1.77 110.177 171.329 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -59.48 -23.43 62.74 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 120.029 -1.669 . . . . 1.96 114.33 -179.33 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 41.4 t -53.01 -35.18 59.12 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.612 -1.305 . . . . 2.3199999999999998 111.904 167.887 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 59.7 t -64.63 -40.54 89.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 CA-C-N 119.181 0.9 . . . . 1.6799999999999999 111.357 178.383 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -62.94 -50.98 68.67 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.881 0.873 . . . . 1.6399999999999999 111.26 176.867 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.9 -43.81 98.02 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.167 0.987 . . . . 1.55 110.961 178.546 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 95.0 m -60.93 -52.12 66.37 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.909 1.284 . . . . 0.93999999999999995 112.07 177.841 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 30.6 ttp -61.06 -41.16 96.09 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.097 0.959 . . . . 2.2599999999999998 111.93 -175.22 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 98.0 mt -72.45 -45.3 60.2 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 123.796 0.838 . . . . 1.75 112.219 175.784 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.4 t -67.19 -28.46 68.11 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.111 0.869 . . . . 1.54 112.998 -177.99 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -50.01 71.48 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.013 0.824 . . . . 3.6899999999999999 111.338 166.63 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.9 -30.56 70.24 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.742 0.701 . . . . 0.87 112.865 -178.71 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -74.64 -24.73 58.88 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.768 1.025 . . . . 2.2999999999999998 113.768 172.282 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -78.59 -42.26 29.54 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.069 0.948 . . . . 2.7000000000000002 111.537 172.725 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -60.8 -35.89 77.62 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.664 0.786 . . . . 3.8100000000000001 110.703 171.589 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -57.24 -46.33 83.09 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.185 0.994 . . . . 2.79 112.203 171.527 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -65.5 -34.95 79.47 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.503 1.121 . . . . 2.3100000000000001 112.217 -179.057 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 98.0 mt -69.58 -30.98 68.87 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.776 0.83 . . . . 1.6699999999999999 112.816 175.749 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -89.31 -6.44 56.71 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 114.498 1.295 . . . . 4.5199999999999996 114.498 178.656 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -93.54 -50.01 5.62 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.395 1.478 . . . . 3.0800000000000001 112.142 170.852 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.73 44.26 0.72 Allowed 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 123.09 1.424 . . . . 2.79 112.963 -178.303 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm . . . . . 0 C--O 1.25 1.116 0 C-N-CA 129.7 3.2 . . . . 4.3600000000000003 115.234 171.399 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.9 mmt . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 108.424 -0.954 . . . . 5.8200000000000003 108.424 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 -116.2 -104.24 0.41 Allowed 'General case' 0 CA--C 1.539 0.532 0 O-C-N 125.506 1.754 . . . . 4.1399999999999997 107.844 -159.183 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.4 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 46.3 p -120.21 174.75 2.69 Favored Pre-proline 0 N--CA 1.469 0.522 0 C-N-CA 124.052 0.941 . . . . 1.72 113.372 -153.703 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.4 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 90.8 Cg_endo -75.11 -29.52 7.97 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 121.659 1.572 . . . . 1.8600000000000001 111.485 159.222 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.0 tp -77.17 -53.77 7.34 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.318 0.963 . . . . 3.1499999999999999 113.064 -170.816 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -71.03 -26.82 63.27 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.876 1.217 . . . . 5.6200000000000001 111.068 -177.874 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -60.58 -40.99 93.75 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.122 -0.986 . . . . 4.7300000000000004 111.67 164.38 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.97 -31.11 61.38 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.048 0.939 . . . . 0.97999999999999998 112.148 176.421 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.5 mt -66.36 -42.57 87.85 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.012 1.278 . . . . 1.51 111.587 168.018 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 91.5 m -60.4 -43.35 96.74 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 121.341 -0.849 . . . . 1.5900000000000001 110.692 172.872 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 51.2 m -60.91 -38.4 85.62 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.205 1.002 . . . . 1.7 111.158 172.065 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 43.1 ttm -62.85 -49.82 73.36 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.56 -1.21 . . . . 3.1099999999999999 111.952 175.764 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.3 m -66.36 -22.4 30.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 CA-C-N 120.804 1.638 . . . . 2.4300000000000002 113.317 174.938 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 60.2 m -67.75 -54.74 16.83 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 117.608 -1.187 . . . . 0.80000000000000004 109.72 173.069 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -52.99 -36.55 60.51 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-N 119.2 0.909 . . . . 2.4399999999999999 111.221 168.753 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -64.42 -44.79 90.12 Favored 'General case' 0 C--O 1.219 -0.503 0 O-C-N 123.849 0.718 . . . . 1.75 111.3 -175.173 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -75.22 -37.28 61.17 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.999 1.272 . . . . 1.9399999999999999 112.895 173.375 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -15.99 17.72 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.121 1.768 . . . . 5.9100000000000001 113.683 175.607 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.483 ' CD2' HD13 ' A' ' 37' ' ' LEU . 90.4 m-85 -121.66 -20.18 6.58 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 116.718 2.118 . . . . 2.25 116.718 162.966 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.7 t -71.44 -23.66 61.88 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 122.462 2.392 . . . . 1.8100000000000001 112.478 172.743 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.8 0.77 89.4 Favored Glycine 0 CA--C 1.535 1.31 0 CA-C-O 118.192 -1.338 . . . . 1.8999999999999999 114.062 166.103 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.4 tpt85 -62.84 -22.86 66.98 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 119.898 1.849 . . . . 5.8099999999999996 112.76 177.525 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -164.03 148.61 10.19 Favored 'General case' 0 C--O 1.252 1.218 0 C-N-CA 127.483 2.313 . . . . 5.0099999999999998 110.447 168.182 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 43.35 -126.55 5.33 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 126.573 2.035 . . . . 2.9100000000000001 114.772 163.185 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.5 m -44.68 137.65 3.79 Favored 'General case' 0 C--O 1.245 0.853 0 C-N-CA 126.686 1.994 . . . . 2.8300000000000001 114.149 178.557 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -110.5 -11.59 14.46 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 127.018 2.127 . . . . 4.2800000000000002 115.586 -163.011 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 28.2 tp -95.89 0.02 51.5 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.095 0.958 . . . . 3.75 111.066 170.259 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.3 p -142.68 156.38 45.03 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 126.14 1.776 . . . . 0.98999999999999999 113.99 -162.174 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.9 mt -111.34 104.58 13.05 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.703 1.201 . . . . 1.52 109.145 171.129 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.1 t -66.25 152.4 44.99 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.4 -0.813 . . . . 1.97 110.683 168.044 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.7 ttp180 -42.51 -29.86 0.31 Allowed 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.926 2.09 . . . . 5.54 115.693 -175.377 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -83.38 -33.17 25.85 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 116.592 2.071 . . . . 7.4400000000000004 116.592 171.479 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -60.81 -43.31 98.37 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.011 0.925 . . . . 1.98 109.948 165.874 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.9 tp -66.94 -45.14 78.72 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.669 0.788 . . . . 2.1800000000000002 112.656 -174.703 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -50.3 -47.29 55.66 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.383 0.992 . . . . 3.4900000000000002 111.44 174.757 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -70.89 -46.0 63.36 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 118.441 -0.79 . . . . 3.0499999999999998 111.615 -174.017 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.483 HD13 ' CD2' ' A' ' 19' ' ' TYR . 29.4 tp -55.47 -52.84 62.3 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.859 1.264 . . . . 2.3199999999999998 112.352 179.824 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 51.3 mt -54.05 -57.57 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 107.866 -1.161 . . . . 1.04 107.866 -178.866 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.16 -16.7 60.5 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.883 1.068 . . . . 4.0099999999999998 113.883 -171.27 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.2 mmtp -81.99 -47.93 12.07 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.984 1.314 . . . . 3.3199999999999998 112.208 177.553 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.511 ' HA ' HG21 ' B' ' 3' ' ' THR . 11.0 mm-40 -101.98 15.23 29.69 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.604 1.162 . . . . 6.04 111.696 -172.23 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.412 HD12 HD22 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -164.83 122.11 1.59 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.217 2.207 . . . . 2.6800000000000002 111.643 173.698 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 48.8 t -71.39 -53.69 13.25 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 114.045 1.128 . . . . 4.7300000000000004 114.045 -179.188 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.412 HD22 HD12 ' A' ' 42' ' ' LEU . 3.9 mm? 61.99 -56.52 0.13 Allowed 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 128.778 2.831 . . . . 5.7199999999999998 113.973 -170.993 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 161.42 26.45 0.02 OUTLIER Glycine 0 CA--C 1.536 1.369 1 C-N-CA 130.818 4.056 . . . . 2.77 110.427 -174.355 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 65.09 132.79 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 128.706 2.802 . . . . 9.4299999999999997 111.458 -157.328 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 41.8 mmm -88.24 129.29 35.4 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.892 0.853 . . . . 2.52 110.335 174.797 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -112.85 159.19 19.28 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.241 1.017 . . . . 4.0899999999999999 110.463 178.417 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -45.2 -46.29 12.17 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 114.673 1.36 . . . . 5.1900000000000004 114.673 -169.928 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -61.46 -7.29 2.96 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 115.588 1.699 . . . . 4.2699999999999996 115.588 179.884 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.3 m -115.44 -12.11 11.75 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.584 1.084 . . . . 2.1200000000000001 113.139 171.935 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 74.7 mt -84.39 -44.72 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 O-C-N 120.692 -1.255 . . . . 2.5600000000000001 112.287 -171.347 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -74.94 -12.68 60.41 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.237 0.458 . . . . 4.2599999999999998 112.237 176.742 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.446 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 1.0 OUTLIER -91.0 -28.75 17.79 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.43 1.092 . . . . 2.6200000000000001 113.383 169.375 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.0 -47.27 81.24 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.573 -0.704 . . . . 2.2200000000000002 109.654 156.925 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 6.4 tpt -56.35 -49.05 75.49 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.659 0.784 . . . . 1.8100000000000001 110.712 176.224 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.446 ' HE2' ' HA ' ' A' ' 54' ' ' ASP . 14.8 mtmm -60.05 -39.12 84.86 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.587 1.085 . . . . 4.3200000000000003 112.916 174.37 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 73.0 m -67.32 -25.04 65.82 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.091 0.774 . . . . 1.8600000000000001 113.091 175.575 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.566 HD12 ' HA ' ' A' ' 72' ' ' TYR . 2.4 mm? -86.67 -40.85 14.71 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.055 1.342 . . . . 2.6400000000000001 113.631 172.069 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -88.73 64.3 7.25 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 114.606 1.336 . . . . 1.9099999999999999 114.606 -156.378 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -47.6 -44.85 26.91 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.568 1.547 . . . . 3.1400000000000001 114.28 -176.258 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . 0.281 0.4 OUTLIER -84.03 2.93 36.8 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 114.008 1.114 . . . . 2.7400000000000002 114.008 -175.159 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 69.2 m 60.14 79.68 0.23 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 127.659 2.384 . . . . 4.21 113.253 168.998 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -158.3 -114.8 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.652 -0.655 . . . . 2.7799999999999998 110.153 -155.105 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -155.4 -10.58 0.12 Allowed 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 116.424 2.009 . . . . 4.8200000000000003 116.424 176.816 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -127.35 146.14 50.56 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.227 1.811 . . . . 2.4300000000000002 109.412 -173.467 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.415 HD12 ' HB3' ' A' ' 59' ' ' LEU . 9.4 mm -106.54 98.44 6.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 125.801 1.641 . . . . 1.22 110.205 176.136 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -67.76 158.08 33.23 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.557 1.143 . . . . 3.2799999999999998 111.973 168.543 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -52.64 -31.38 36.52 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.216 1.561 . . . . 2.6400000000000001 115.216 -176.533 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.469 ' HE3' ' H ' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -76.2 -35.4 59.11 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 120.669 -1.269 . . . . 4.0499999999999998 112.581 175.309 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -62.55 -47.86 82.03 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.118 0.567 . . . . 1.72 109.532 166.433 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.566 ' HA ' HD12 ' A' ' 59' ' ' LEU . 73.8 t80 -60.8 -39.67 89.77 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 127.451 2.3 . . . . 2.3700000000000001 115.219 -170.758 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 38.9 m -53.62 -25.56 18.17 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.629 1.171 . . . . 1.98 114.117 -171.29 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.7 m -69.59 -25.6 29.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 O-C-N 121.017 -1.052 . . . . 2.6000000000000001 113.548 178.351 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.53 ' HB2' HD11 ' A' ' 59' ' ' LEU . 20.4 t80 -62.88 -56.97 12.61 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.519 1.054 . . . . 2.0699999999999998 110.866 -177.82 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.6 mt -65.41 -29.06 69.71 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 118.583 -0.723 . . . . 2.4100000000000001 112.009 176.115 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 66.6 m -60.72 -52.22 66.05 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.792 0.837 . . . . 1.0900000000000001 110.94 170.85 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 77.5 mtm -60.12 -41.69 93.16 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.557 0.743 . . . . 1.6299999999999999 111.65 177.088 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 77.2 mt -67.48 -41.59 84.35 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 118.582 -0.723 . . . . 1.26 112.589 179.4 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 3.7 t -69.66 -28.13 65.62 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.735 1.152 . . . . 2.1499999999999999 113.053 175.329 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 27.2 mtp -65.52 -42.53 91.9 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.295 -0.878 . . . . 2.3300000000000001 112.515 165.896 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.04 -33.94 76.88 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 120.009 1.277 . . . . 0.81999999999999995 113.031 175.962 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -64.58 -24.16 67.5 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.221 -0.925 . . . . 2.5699999999999998 112.8 171.459 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -75.51 -35.76 60.7 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.279 -0.888 . . . . 2.7400000000000002 113.0 178.379 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -62.37 -44.66 95.95 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.604 1.162 . . . . 3.9900000000000002 110.839 171.558 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.64 -50.75 62.52 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.048 1.339 . . . . 2.5 111.728 171.673 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -62.78 -33.57 75.46 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.161 0.984 . . . . 2.2799999999999998 111.935 178.711 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 42.6 mt -69.63 -18.61 63.61 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 117.507 -1.235 . . . . 1.5 113.308 178.297 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -91.24 -17.2 26.4 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 114.917 1.451 . . . . 2.7400000000000002 114.917 171.622 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -93.73 -43.55 8.58 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.663 1.185 . . . . 3.6400000000000001 112.835 -176.13 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.77 8.11 2.13 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 116.828 2.158 . . . . 4.7400000000000002 116.828 -179.424 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 74.5 tttt . . . . . 0 C--O 1.249 1.028 0 C-N-CA 129.869 3.267 . . . . 4.3300000000000001 116.314 -148.299 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.9 tmm? . . . . . 0 N--CA 1.479 0.989 0 CA-C-O 115.832 -2.032 . . . . 6.5800000000000001 105.751 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 72.51 -142.86 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 120.104 1.32 . . . . 6.3600000000000003 111.799 131.576 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 3' ' ' THR . . . . . 0.511 HG21 ' HA ' ' A' ' 41' ' ' GLU . 58.7 p -105.49 167.27 9.98 Favored Pre-proline 0 N--CA 1.471 0.612 0 C-N-CA 125.41 1.484 . . . . 1.8200000000000001 112.24 -166.488 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -62.56 -16.33 51.69 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 122.323 2.015 . . . . 1.52 113.039 165.69 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -80.72 -32.04 35.89 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 117.516 -1.231 . . . . 2.3100000000000001 111.911 173.274 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -50.41 -46.07 56.07 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.194 0.906 . . . . 6.1200000000000001 109.118 159.675 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 7' ' ' LYS . . . . . 0.484 ' HA ' ' CE ' ' B' ' 7' ' ' LYS . 0.2 OUTLIER -77.67 -25.34 49.48 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 114.707 1.373 . . . . 4.0800000000000001 114.707 -177.544 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.38 -46.28 56.02 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.859 0.754 . . . . 1.01 110.959 171.157 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 79.7 mt -68.86 -37.62 79.22 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.248 1.019 . . . . 1.8 111.834 175.568 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 97.2 m -54.22 -56.54 17.27 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 117.831 -1.08 . . . . 2.6800000000000002 108.657 167.098 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 43.9 m -53.18 -49.73 66.06 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.319 0.963 . . . . 1.72 110.527 -179.13 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 37.2 ttm -62.42 -46.17 89.78 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.666 0.786 . . . . 3.0 112.556 -178.146 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 1.8 p -70.25 -26.46 29.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.871 1.214 . . . . 2.6899999999999999 112.691 175.685 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 65.6 m -70.82 -46.03 63.49 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.373 1.469 . . . . 1.1399999999999999 111.736 -177.898 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -64.79 -43.16 94.12 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.86 0.864 . . . . 1.6000000000000001 109.459 169.189 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 29.7 t80 -66.55 -49.75 65.43 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 120.081 -0.648 . . . . 2.0299999999999998 111.417 -168.671 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.94 -3.6 10.4 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 120.689 -1.257 . . . . 2.2799999999999998 114.337 178.086 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.63 -57.9 2.08 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.026 -1.046 . . . . 4.6200000000000001 110.806 171.291 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -61.97 -34.1 75.52 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.303 -0.873 . . . . 1.8 112.717 177.056 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 67.5 m -70.02 -11.99 61.28 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.58 -1.325 . . . . 2.0099999999999998 114.121 171.645 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -94.11 -4.04 63.25 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 125.187 1.375 . . . . 1.3300000000000001 114.451 166.349 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 36.5 tpt85 -64.5 -23.48 67.29 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.138 1.469 . . . . 4.0599999999999996 112.502 176.941 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -151.59 175.52 12.25 Favored 'General case' 0 C--O 1.246 0.879 0 C-N-CA 127.225 2.21 . . . . 4.5700000000000003 108.658 172.08 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -41.31 153.8 0.1 OUTLIER Glycine 0 N--CA 1.474 1.176 0 C-N-CA 126.688 2.089 . . . . 3.46 115.122 -174.022 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 16.3 m 63.26 122.78 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.205 1.402 . . . . 3.5499999999999998 112.613 -179.358 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 23.2 mtpt -81.25 -25.39 36.65 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 114.819 1.414 . . . . 7.54 114.819 -175.063 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.437 ' H ' HD23 ' B' ' 27' ' ' LEU . 1.6 pt? -94.02 6.47 48.42 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.195 0.998 . . . . 3.5099999999999998 113.513 -173.882 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 19.0 p -144.63 154.39 42.76 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 127.159 2.184 . . . . 1.96 111.849 -166.929 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 77.1 mt -107.0 108.54 20.1 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.224 1.41 . . . . 1.79 109.722 167.686 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.42 160.9 4.86 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 120.156 -1.59 . . . . 1.8300000000000001 111.228 161.484 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -43.98 -35.21 1.96 Allowed 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.441 1.097 . . . . 3.8100000000000001 113.921 176.488 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.97 -40.5 39.09 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.245 1.018 . . . . 5.5 113.331 178.623 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -59.17 -42.48 90.91 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.084 0.954 . . . . 2.2400000000000002 109.76 173.282 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tp -66.33 -47.02 74.84 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.265 -0.874 . . . . 2.0099999999999998 111.839 176.032 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -54.73 -54.21 44.88 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 120.354 1.434 . . . . 3.0800000000000001 112.045 176.994 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -41.81 -62.61 0.87 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.262 1.425 . . . . 3.48 112.601 170.66 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 tp -48.93 -62.96 1.24 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.114 1.766 . . . . 2.1000000000000001 110.433 -177.871 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 22.3 mt -62.01 -38.01 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 109.546 -0.539 . . . . 1.8300000000000001 109.546 -171.942 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 51.2 mttm -58.12 -33.24 68.92 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.907 0.706 . . . . 4.9500000000000002 112.907 179.955 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -82.97 -47.69 11.48 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 122.979 0.512 . . . . 4.9299999999999997 111.927 177.835 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -75.63 -55.71 5.4 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 124.335 1.022 . . . . 5.5300000000000002 111.014 -172.598 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -83.01 49.13 1.47 Allowed 'General case' 0 CA--C 1.546 0.814 0 O-C-N 119.679 -1.888 . . . . 2.7000000000000002 110.928 -177.899 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 15.4 t -75.92 16.62 0.39 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.617 1.967 . . . . 4.5999999999999996 114.573 -176.521 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.48 18.05 0.18 Allowed 'General case' 0 N--CA 1.478 0.955 0 O-C-N 120.084 -1.635 . . . . 3.71 115.093 -177.029 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.95 -40.93 1.45 Allowed Glycine 0 CA--C 1.534 1.245 0 C-N-CA 126.172 1.844 . . . . 4.1699999999999999 114.72 -179.526 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -64.27 -22.61 67.01 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.177 1.391 . . . . 5.2699999999999996 113.985 -175.82 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 7.6 tpt -74.85 76.83 2.12 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.759 1.624 . . . . 2.1600000000000001 112.509 -175.866 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 20.2 mttm -62.74 120.73 11.81 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 120.786 -1.196 . . . . 3.9900000000000002 111.029 -170.548 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.67 -34.9 69.87 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.923 1.453 . . . . 3.7999999999999998 114.923 -156.934 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 3.0 m -87.93 -14.68 38.65 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.299 -0.876 . . . . 4.8799999999999999 112.388 -178.442 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 17.9 t -70.48 -10.26 58.71 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.479 -1.388 . . . . 2.5800000000000001 111.979 166.426 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 5.4 mm -65.35 -35.34 75.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 124.191 0.996 . . . . 1.3500000000000001 111.532 172.138 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.78 -39.4 69.97 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.148 0.885 . . . . 3.5 111.821 -176.633 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.29 -30.9 66.82 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.543 0.737 . . . . 4.2999999999999998 112.985 170.895 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 7.8 tt -65.13 -45.83 83.47 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.617 -0.706 . . . . 2.3300000000000001 110.664 166.917 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -56.56 -48.77 76.62 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.576 1.55 . . . . 2.0099999999999998 111.257 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 35.8 mtpt -54.75 -32.79 60.35 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.549 1.54 . . . . 4.4199999999999999 113.782 171.592 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 50.7 m -82.51 -30.21 29.97 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.291 1.037 . . . . 2.52 113.065 178.618 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 19.1 mt -73.66 -36.07 65.31 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.893 0.877 . . . . 2.02 111.988 173.856 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -74.82 74.88 2.12 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 123.178 1.466 . . . . 1.8799999999999999 110.24 -177.892 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.2 tmtm? -61.33 -16.22 43.74 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 114.137 -1.392 . . . . 4.9199999999999999 113.863 -158.424 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 48.1 p-10 -105.89 -14.44 15.21 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 115.777 1.769 . . . . 3.4199999999999999 115.777 172.594 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 40.1 t 56.54 90.88 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.308 1.443 . . . . 4.3600000000000003 113.064 -162.341 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 11.3 p30 -123.91 -79.93 0.62 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.153 1.381 . . . . 3.21 109.864 176.48 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -168.74 -34.77 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 129.77 3.228 . . . . 8.2100000000000009 112.024 177.428 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -129.12 147.22 50.95 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 126.178 1.791 . . . . 2.5699999999999998 110.443 -167.349 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 67' ' ' ILE . . . . . 0.43 HG22 ' HB2' ' B' ' 72' ' ' TYR . 75.2 mt -97.06 102.36 13.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 121.941 0.877 . . . . 1.3500000000000001 109.105 178.576 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -66.68 152.95 44.39 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.163 1.785 . . . . 3.1400000000000001 108.961 171.752 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -47.65 -41.85 23.14 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.062 1.345 . . . . 2.3799999999999999 113.57 -178.11 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.55 -8.37 59.12 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 115.612 1.708 . . . . 3.4700000000000002 115.612 177.031 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -83.28 -52.29 6.69 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 107.505 -1.295 . . . . 2.1099999999999999 107.505 160.528 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 72' ' ' TYR . . . . . 0.43 ' HB2' HG22 ' B' ' 67' ' ' ILE . 40.5 t80 -52.98 -34.0 53.94 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.584 1.954 . . . . 2.73 114.867 -174.765 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 79.6 p -63.07 -17.64 62.5 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 117.401 -1.285 . . . . 1.95 113.992 174.695 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 92.6 t -56.71 -38.91 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-N 120.837 1.653 . . . . 1.6100000000000001 111.213 168.361 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -60.41 -54.23 48.06 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 118.634 0.652 . . . . 2.04 111.394 172.517 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 69.4 mt -62.8 -37.68 87.69 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 123.784 0.834 . . . . 1.6499999999999999 110.768 -174.63 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 19.1 m -69.37 -43.35 73.75 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.634 1.574 . . . . 1.7 112.532 175.446 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 5.8 mmm -56.47 -46.11 80.57 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 120.191 1.359 . . . . 2.73 111.801 173.101 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 97.3 mt -67.25 -50.72 59.5 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.43 0.692 . . . . 1.6699999999999999 111.365 175.949 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 2.0 t -66.45 -25.58 66.8 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.101 -0.999 . . . . 2.0099999999999998 113.131 -177.151 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 62.7 mtm -73.04 -37.34 66.92 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.156 -0.965 . . . . 3.1099999999999999 112.683 168.36 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.97 -33.87 76.3 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.164 0.893 . . . . 1.0600000000000001 112.049 170.929 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -70.68 -32.85 70.25 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 113.378 0.881 . . . . 2.0600000000000001 113.378 168.381 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -69.74 -42.99 73.21 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.28 0.945 . . . . 3.1899999999999999 112.087 179.845 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -58.04 -46.46 85.3 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.729 1.212 . . . . 3.0299999999999998 112.075 170.818 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.26 -50.67 64.34 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.879 1.272 . . . . 3.8399999999999999 111.424 175.615 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -66.67 -27.71 67.88 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.566 1.546 . . . . 2.4199999999999999 111.336 -177.695 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 34.1 mt -81.16 -9.53 59.78 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 125.414 1.485 . . . . 3.1800000000000002 114.488 177.757 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -87.76 -18.0 30.39 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 120.047 1.294 . . . . 5.5599999999999996 114.168 164.155 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -80.92 -52.92 6.92 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.108 0.963 . . . . 5.0499999999999998 110.821 164.406 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -98.46 28.13 4.34 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.297 1.839 . . . . 5.7999999999999998 113.11 -171.906 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.071 0 C-N-CA 128.272 2.629 . . . . 9.2899999999999991 114.445 -177.485 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.242 0.663 0 N-CA-C 106.39 -1.707 . . . . 3.9700000000000002 106.39 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.7 p -71.05 168.07 24.04 Favored Pre-proline 0 N--CA 1.478 0.94 0 C-N-CA 123.379 0.671 . . . . 1.76 112.805 -171.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -61.28 -20.82 69.73 Favored 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 122.484 2.123 . . . . 1.78 113.211 165.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.01 -41.59 42.11 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.637 1.175 . . . . 2.4100000000000001 111.327 173.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -61.08 -36.05 78.59 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.642 -1.286 . . . . 3.8599999999999999 110.741 169.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.9 mttp -69.97 -32.61 70.91 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.723 -1.236 . . . . 3.54 112.749 172.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.05 -53.07 55.71 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.261 1.025 . . . . 0.89000000000000001 111.091 170.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.4 mt -55.31 -43.18 74.64 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.35 1.46 . . . . 1.4399999999999999 111.729 173.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 95.7 m -59.14 -40.95 87.08 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 117.611 -1.185 . . . . 1.6100000000000001 111.678 173.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 29.0 m -66.13 -39.45 89.89 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.397 1.079 . . . . 1.25 110.756 176.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 61.1 mtp -64.19 -40.42 96.06 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.89 1.276 . . . . 3.1299999999999999 111.691 174.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.35 -33.19 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 123.493 0.717 . . . . 1.8999999999999999 112.291 167.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 94.0 m -71.15 -58.21 3.77 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 117.677 -1.154 . . . . 1.02 110.464 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.3 p -65.09 -31.49 72.73 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 118.164 -0.922 . . . . 2.0600000000000001 110.271 178.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -67.32 -64.56 0.83 Allowed 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 119.288 -0.965 . . . . 1.9399999999999999 110.508 176.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.47 -39.62 84.3 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 120.12 1.327 . . . . 2.2799999999999998 112.462 -176.243 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -60.1 -51.45 69.55 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.766 -1.209 . . . . 3.8799999999999999 112.345 176.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -78.24 -24.34 47.01 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.002 -1.061 . . . . 2.0499999999999998 112.185 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.6 t -68.67 -19.04 64.38 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 126.466 1.906 . . . . 1.8999999999999999 112.715 173.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.84 2.47 87.18 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 126.057 1.789 . . . . 1.3 115.393 167.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.34 -26.01 61.76 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 120.415 2.108 . . . . 4.25 113.192 176.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -167.21 177.94 5.89 Favored 'General case' 0 C--O 1.245 0.848 0 C-N-CA 125.776 1.63 . . . . 4.1299999999999999 111.129 -172.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.77 -141.5 44.73 Favored Glycine 0 N--CA 1.468 0.831 0 C-N-CA 124.216 0.912 . . . . 1.8799999999999999 111.951 170.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.1 t -73.97 157.33 36.38 Favored 'General case' 0 CA--C 1.551 1.013 0 O-C-N 121.558 -0.966 . . . . 3.21 111.979 159.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -71.48 -12.81 61.58 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 127.009 2.124 . . . . 4.9299999999999997 112.952 173.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.8 mt -101.57 -11.5 19.2 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.126 1.37 . . . . 3.5899999999999999 112.96 176.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.9 p -111.04 144.22 40.5 Favored 'General case' 0 C--O 1.248 1.002 0 C-N-CA 125.089 1.355 . . . . 0.97999999999999998 112.86 176.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.8 mt -95.08 104.94 16.82 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.324 1.05 . . . . 1.6399999999999999 109.396 161.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.6 p -57.33 162.09 2.97 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 120.684 -1.26 . . . . 2.48 111.223 168.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -50.55 -25.42 4.07 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 120.133 -1.604 . . . . 3.1499999999999999 114.267 174.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.87 -45.42 18.68 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.105 0.962 . . . . 4.5800000000000001 113.212 171.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -62.48 -41.64 98.93 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.888 0.875 . . . . 1.4299999999999999 110.947 175.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.2 tp -66.14 -46.65 76.74 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.176 0.591 . . . . 1.8799999999999999 110.09 176.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 15.4 ttmt -61.81 -46.14 90.79 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.054 0.843 . . . . 3.6200000000000001 111.803 178.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -45.05 -59.87 2.38 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 117.406 -1.283 . . . . 3.6299999999999999 111.84 165.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.0 -54.14 49.54 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.974 1.261 . . . . 1.73 112.407 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.7 mt -56.25 -42.66 74.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 119.592 1.087 . . . . 1.04 109.509 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 26.1 mmmt -64.87 -14.41 59.48 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 113.524 0.935 . . . . 3.6099999999999999 113.524 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 32.2 mmtm -102.22 -38.28 7.74 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.988 1.267 . . . . 3.6699999999999999 113.726 169.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -82.99 -31.62 27.41 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.534 1.534 . . . . 3.6800000000000002 112.472 -166.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -117.34 94.71 4.66 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.574 1.149 . . . . 2.6499999999999999 109.19 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.4 t -79.11 -6.25 56.02 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 115.048 1.499 . . . . 3.3700000000000001 115.048 -166.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.31 33.77 0.08 Allowed 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 117.65 2.463 . . . . 3.8199999999999998 117.65 -161.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.78 -46.88 2.69 Favored Glycine 0 N--CA 1.477 1.383 0 C-N-CA 125.469 1.509 . . . . 3.04 115.407 166.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.427 ' CD ' ' HZ3' ' A' ' 48' ' ' LYS . 38.0 mm-40 -86.07 7.23 25.5 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.357 1.243 . . . . 5.2400000000000002 114.357 -176.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.7 66.2 0.73 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 124.677 2.179 . . . . 2.8700000000000001 111.001 163.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.427 ' HZ3' ' CD ' ' A' ' 46' ' ' GLU . 60.7 mttp -101.4 165.55 11.2 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 128.363 2.665 . . . . 4.3499999999999996 110.839 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -62.8 -45.47 92.48 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 115.193 1.553 . . . . 3.7400000000000002 115.193 -160.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.3 t -73.83 -28.67 61.73 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 117.91 -1.043 . . . . 2.8700000000000001 113.3 172.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.77 -38.69 79.04 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.548 1.522 . . . . 2.2999999999999998 110.61 170.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 65.3 mt -81.85 -39.22 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 124.875 1.27 . . . . 1.3400000000000001 112.73 -176.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -76.71 -26.87 55.17 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 118.99 0.814 . . . . 3.3500000000000001 112.787 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -78.6 -38.69 39.39 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.116 0.871 . . . . 2.25 112.208 168.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 39.3 tp -55.03 -54.06 47.91 Favored 'General case' 0 C--N 1.344 0.362 0 O-C-N 121.462 -0.774 . . . . 1.72 109.964 168.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 8.9 tpt -48.61 -49.45 36.96 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.706 2.002 . . . . 1.8300000000000001 111.913 176.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.58 -25.6 60.24 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.037 1.335 . . . . 3.77 113.66 176.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.7 t -96.3 -25.87 15.6 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.941 1.297 . . . . 1.9099999999999999 113.788 177.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.1 mt -73.37 -41.93 62.8 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.154 0.981 . . . . 2.0299999999999998 111.565 173.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -69.32 149.74 48.11 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.495 0.718 . . . . 1.6899999999999999 112.053 176.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.19 -10.14 19.86 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 120.954 -1.091 . . . . 3.1499999999999999 113.791 -176.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -148.52 -10.84 0.35 Allowed 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.962 1.467 . . . . 2.6099999999999999 114.962 -165.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.0 t 79.66 18.95 0.7 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.625 2.37 . . . . 3.1800000000000002 113.315 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.3 p30 -65.05 -24.3 67.43 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.331 1.452 . . . . 2.2400000000000002 110.928 -178.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 63.84 22.23 12.95 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 130.701 3.6 . . . . 4.3899999999999997 114.211 -172.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -115.78 121.35 42.18 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 128.907 2.883 . . . . 2.6099999999999999 107.304 164.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 14.1 mm -93.03 105.02 16.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 124.998 1.319 . . . . 1.03 109.037 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.23 158.13 36.41 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.894 2.078 . . . . 2.52 111.379 167.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -54.82 -34.0 62.27 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.982 -1.074 . . . . 1.8999999999999999 113.704 -175.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm -78.88 -27.31 43.99 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 120.781 -1.199 . . . . 2.96 112.347 177.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -64.82 -53.02 53.42 Favored 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 108.307 -0.997 . . . . 1.77 108.307 163.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -55.57 -31.38 62.14 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 119.866 -1.771 . . . . 2.0600000000000001 114.349 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.53 -24.04 63.34 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 119.543 -1.973 . . . . 1.6299999999999999 114.28 172.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 49.0 t -63.81 -41.33 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 CA-C-N 119.067 0.849 . . . . 1.8600000000000001 110.153 172.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -61.26 -51.83 67.29 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.036 0.934 . . . . 1.9199999999999999 111.116 176.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.8 mt -59.3 -38.11 79.42 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.894 1.278 . . . . 2.3199999999999998 112.204 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 83.2 m -59.87 -55.79 29.75 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.803 0.841 . . . . 0.95999999999999996 110.545 175.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 75.0 mtm -61.44 -40.27 93.85 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 111.951 0.352 . . . . 1.3700000000000001 111.951 -176.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 89.0 mt -69.15 -37.0 78.02 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.281 0.845 . . . . 1.6100000000000001 113.281 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 5.7 t -73.94 -31.53 63.09 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.134 0.879 . . . . 1.78 112.979 176.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 49.1 mtp -67.65 -42.76 81.72 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.319 0.509 . . . . 1.8300000000000001 111.652 167.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.07 -41.1 91.18 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.071 -1.018 . . . . 1.03 112.621 -175.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -68.4 -26.94 65.8 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 113.12 0.785 . . . . 2.3700000000000001 113.12 174.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -67.88 -43.5 79.23 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 120.231 1.378 . . . . 1.6899999999999999 112.734 169.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -71.26 -28.8 64.41 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.731 0.813 . . . . 4.1100000000000003 110.973 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.46 -51.01 70.48 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.855 1.262 . . . . 1.8600000000000001 111.652 164.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 35.3 t80 -60.14 -33.43 72.15 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.104 1.362 . . . . 2.3500000000000001 112.316 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 41.1 mt -68.02 -20.28 64.98 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.859 1.264 . . . . 1.54 113.87 173.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -101.11 -9.95 20.9 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.632 1.173 . . . . 2.6400000000000001 114.09 176.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 12.4 t70 . . . . . 0 N--CA 1.472 0.642 0 C-N-CA 125.163 1.385 . . . . 2.7200000000000002 113.079 -173.068 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 59.1 p . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 113.519 0.933 . . . . 1.97 113.519 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.69 -21.51 69.72 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.579 2.186 . . . . 1.45 112.967 167.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.57 -44.11 36.03 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 119.397 0.999 . . . . 2.5299999999999998 110.842 173.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -58.93 -35.07 72.47 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.398 -0.814 . . . . 3.6299999999999999 111.026 170.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -74.94 -27.95 60.4 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 119.869 -1.769 . . . . 3.9199999999999999 113.72 173.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.8 -50.66 61.93 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.373 1.069 . . . . 0.91000000000000003 110.8 169.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 48.0 mt -56.83 -39.73 74.75 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.282 1.433 . . . . 1.53 111.898 169.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 88.0 m -62.39 -43.27 99.22 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 117.918 -1.039 . . . . 1.6599999999999999 111.033 173.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 62.0 m -57.74 -47.85 81.29 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.583 1.083 . . . . 1.3200000000000001 109.896 173.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 61.9 mtp -59.2 -43.41 92.22 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.086 1.354 . . . . 2.9199999999999999 112.826 175.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 32.2 t -64.76 -32.59 58.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 O-C-N 121.009 -1.057 . . . . 1.8200000000000001 112.045 173.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 89.3 m -74.49 -45.23 47.37 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.336 1.455 . . . . 0.87 112.16 -178.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 22.4 p -70.64 -37.86 73.8 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.293 0.637 . . . . 1.53 109.536 173.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -62.66 -66.59 0.52 Allowed 'General case' 0 C--O 1.219 -0.53 0 CA-C-O 117.383 -1.294 . . . . 1.95 109.864 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -59.06 -29.5 67.36 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 121.544 1.975 . . . . 2.4500000000000002 112.653 -173.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -62.17 -56.52 17.9 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.976 -1.078 . . . . 3.6099999999999999 113.455 173.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -81.24 -34.15 32.32 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.422 -0.799 . . . . 2.3500000000000001 112.979 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.5 t -64.76 -20.61 66.45 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 127.535 2.334 . . . . 2.1699999999999999 112.032 174.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.32 -5.44 79.56 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 127.307 2.384 . . . . 1.8600000000000001 116.133 170.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.52 -4.53 50.89 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-N 119.709 1.754 . . . . 3.2599999999999998 114.596 -163.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -165.35 161.6 19.11 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.393 1.477 . . . . 3.6699999999999999 111.843 174.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.13 -131.42 52.04 Favored Glycine 0 N--CA 1.472 1.082 0 O-C-N 120.985 -1.072 . . . . 2.2400000000000002 111.027 173.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 18.9 m -80.88 159.02 25.13 Favored 'General case' 0 CA--C 1.546 0.793 0 O-C-N 121.699 -0.883 . . . . 3.77 111.184 166.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -93.35 -3.3 53.64 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 116.557 2.058 . . . . 6.21 116.557 -167.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 22.9 tp -112.28 16.21 20.1 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.503 1.521 . . . . 3.29 110.625 178.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 23.3 p -148.78 133.1 17.48 Favored 'General case' 0 C--O 1.242 0.702 0 C-N-CA 127.029 2.132 . . . . 1.21 109.545 -161.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 5.7 mt -98.57 96.23 7.82 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.058 1.343 . . . . 1.8899999999999999 112.539 179.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 14.9 t -43.25 152.92 0.11 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.867 2.067 . . . . 2.1400000000000001 112.764 160.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.7 ttp85 -43.13 -27.96 0.25 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.779 1.632 . . . . 3.2999999999999998 113.323 171.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.6 -45.21 11.26 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.577 1.325 . . . . 4.4100000000000001 114.577 172.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -58.73 -38.22 77.87 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.686 1.194 . . . . 1.8999999999999999 111.47 174.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 29.4 tp -72.15 -44.57 62.89 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.862 1.265 . . . . 1.8899999999999999 110.603 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.3 ttmm -67.58 -36.28 80.6 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 120.707 -1.246 . . . . 3.0800000000000001 112.396 -179.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -52.2 -68.01 0.2 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.578 1.551 . . . . 3.4100000000000001 111.619 157.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 tt -52.23 -49.41 64.03 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.67 1.188 . . . . 1.9099999999999999 112.875 -174.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 48.4 mt -58.62 -51.33 73.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 108.461 -0.94 . . . . 1.1399999999999999 108.461 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -72.14 -9.11 57.98 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 112.841 0.682 . . . . 3.7599999999999998 112.841 -175.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -91.28 -37.22 13.42 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.707 1.603 . . . . 3.5099999999999998 113.664 168.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -88.89 -27.24 21.13 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.219 1.408 . . . . 3.9399999999999999 113.885 -175.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -117.46 108.26 15.32 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.588 1.155 . . . . 2.2000000000000002 110.631 -174.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 8.0 t -79.23 3.92 16.49 Favored 'General case' 0 CA--C 1.555 1.15 0 N-CA-C 115.064 1.505 . . . . 3.5499999999999998 115.064 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -61.88 -42.83 99.53 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.83 2.052 . . . . 2.71 115.439 -161.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.23 -23.79 34.13 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 124.672 1.13 . . . . 3.1499999999999999 114.49 -178.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -86.97 9.44 19.45 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 118.743 1.272 . . . . 5.1299999999999999 113.711 167.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.76 57.91 2.66 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 123.896 1.807 . . . . 2.8300000000000001 111.096 165.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -89.56 161.47 16.17 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.733 2.413 . . . . 3.8500000000000001 112.334 -177.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -53.2 -53.17 54.61 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 115.902 1.816 . . . . 3.27 115.902 -166.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 5.2 m -73.01 -28.26 62.26 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 119.767 1.167 . . . . 2.6800000000000002 114.002 178.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 1.2 t -61.72 -42.05 98.44 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.312 0.645 . . . . 2.54 109.779 169.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 47.7 mt -73.82 -35.06 42.06 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.191 0 C-N-CA 124.353 1.061 . . . . 1.45 112.61 176.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.66 -35.67 72.99 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.197 0.908 . . . . 2.8100000000000001 111.408 178.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -69.47 -46.47 66.58 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 119.199 0.909 . . . . 2.5099999999999998 111.425 167.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 51.7 tp -55.88 -49.36 73.58 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.151 0.98 . . . . 2.04 110.628 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.22 -57.8 9.24 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.662 1.185 . . . . 2.1299999999999999 110.12 172.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -25.76 44.87 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.836 1.254 . . . . 3.4500000000000002 113.83 176.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 13.8 m -88.67 -27.42 21.28 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.639 1.976 . . . . 2.75 113.028 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 66.6 mt -78.72 -39.25 36.9 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 125.705 1.602 . . . . 2.02 111.096 174.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -76.27 73.1 3.07 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.872 2.069 . . . . 1.6899999999999999 112.808 -171.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.36 -30.71 0.88 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 125.927 1.691 . . . . 3.2400000000000002 114.614 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -112.95 -4.28 13.94 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.779 2.431 . . . . 1.9099999999999999 114.083 -168.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 8.5 t 65.31 14.94 9.75 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 115.322 1.601 . . . . 2.4500000000000002 115.322 173.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -79.74 -15.83 56.76 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.335 1.454 . . . . 2.3900000000000001 111.651 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 68.0 14.44 9.35 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 128.841 2.857 . . . . 5.0 114.371 174.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -101.21 153.36 19.68 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-O 124.169 1.938 . . . . 2.7599999999999998 110.61 141.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 29.9 mm -99.62 101.41 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 127.477 2.311 . . . . 1.23 108.296 171.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.82 162.52 3.14 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.404 1.482 . . . . 2.5099999999999998 112.143 162.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.61 -36.76 67.3 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.05 -1.031 . . . . 2.21 113.083 -177.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -80.2 -17.66 51.73 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 120.939 -1.101 . . . . 3.6099999999999999 112.26 178.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -73.92 -44.94 53.46 Favored 'General case' 0 CA--C 1.552 1.046 0 O-C-N 121.156 -0.965 . . . . 1.8 109.233 163.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -62.88 -30.98 71.93 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.871 1.669 . . . . 2.0699999999999998 112.969 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 85.9 p -63.68 -24.39 67.76 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 119.973 -1.705 . . . . 1.96 113.433 172.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 24.4 t -67.26 -36.13 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 CA-C-N 119.561 1.073 . . . . 1.55 110.984 174.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -63.22 -53.13 57.97 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.836 0.854 . . . . 1.72 110.916 173.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 83.7 mt -57.74 -36.54 72.22 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.217 1.007 . . . . 1.5700000000000001 111.945 177.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 93.1 m -62.4 -54.06 45.83 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.894 1.278 . . . . 0.81000000000000005 111.538 175.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.2 mtm -58.41 -39.42 79.68 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 118.164 0.438 . . . . 1.45 111.662 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 94.3 mt -69.92 -45.25 67.95 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.669 -0.682 . . . . 1.6799999999999999 112.297 177.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 87.1 m -64.24 -32.46 74.06 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.672 1.124 . . . . 1.8700000000000001 113.205 176.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 52.6 mtp -71.24 -38.86 71.94 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.977 0.808 . . . . 2.1200000000000001 112.522 168.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.9 -36.78 75.68 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.084 1.311 . . . . 0.95999999999999996 112.955 -177.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -75.35 -26.15 58.34 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.787 -0.571 . . . . 2.6099999999999999 111.824 176.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -66.08 -42.99 88.63 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.793 0.837 . . . . 1.9199999999999999 112.267 166.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -71.17 -26.99 63.21 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.142 0.577 . . . . 3.7200000000000002 111.408 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -54.76 35.57 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.511 1.524 . . . . 2.21 112.266 162.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -59.48 -27.73 66.39 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.592 1.957 . . . . 2.1099999999999999 112.556 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 16.8 mt -72.38 -11.48 60.71 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 126.163 1.785 . . . . 1.8300000000000001 114.446 176.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -96.38 -3.93 42.8 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 113.625 0.972 . . . . 3.8999999999999999 113.625 170.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -117.43 -65.1 1.22 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.391 1.476 . . . . 3.1899999999999999 110.919 -178.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -87.37 40.47 0.93 Allowed 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 126.932 2.093 . . . . 4.7300000000000004 112.45 173.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp . . . . . 0 C--O 1.251 1.141 0 C-N-CA 129.558 3.143 . . . . 8.0199999999999996 116.493 -169.069 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 . . . . . 0 C--O 1.238 0.456 0 N-CA-C 112.372 0.508 . . . . 5.0499999999999998 112.372 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.475 ' HB ' ' H ' ' A' ' 5' ' ' LEU . 40.7 p -158.7 161.59 28.09 Favored Pre-proline 0 CA--C 1.534 0.338 0 C-N-CA 127.527 2.331 . . . . 2.3799999999999999 109.968 -176.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -70.74 -8.71 24.23 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.708 2.272 . . . . 1.8600000000000001 112.188 157.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.475 ' H ' ' HB ' ' A' ' 3' ' ' THR . 0.3 OUTLIER -73.32 -47.4 42.94 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.751 2.02 . . . . 2.6099999999999999 110.247 179.963 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.32 -40.61 71.37 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.066 0.848 . . . . 3.3399999999999999 111.199 167.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.9 mtpt -67.87 -28.15 67.29 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 119.829 -1.794 . . . . 5.6699999999999999 114.113 173.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.83 -50.6 19.67 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.471 1.108 . . . . 1.03 110.653 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.0 mt -56.04 -50.6 70.48 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.862 1.265 . . . . 1.78 110.497 175.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 32.5 p -65.89 -39.65 90.85 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 116.845 -1.55 . . . . 2.2400000000000002 112.398 178.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 50.0 m -57.55 -45.75 84.75 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 120.603 1.547 . . . . 1.5 109.949 172.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 12.8 ttp -66.85 -45.11 79.21 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.444 1.098 . . . . 2.9500000000000002 112.126 -175.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -60.13 -41.62 87.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 124.799 1.24 . . . . 2.2599999999999998 112.023 171.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 90.4 m -61.43 -52.05 66.17 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.218 1.007 . . . . 1.03 111.333 177.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.46 -36.93 67.1 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 119.148 -0.453 . . . . 2.1200000000000001 111.302 170.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -64.02 -37.51 87.7 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 120.81 -0.356 . . . . 2.0499999999999998 111.708 -177.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.3 m-70 -62.29 -50.26 72.37 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.098 0.863 . . . . 4.5300000000000002 111.718 170.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.424 ' HE2' ' CE1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -60.75 -38.65 85.93 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.423 0.689 . . . . 6.75 112.842 -176.719 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.424 ' CE1' ' HE2' ' A' ' 18' ' ' LYS . 49.2 m-85 -76.58 -43.87 36.94 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.79 0.836 . . . . 3.21 111.303 172.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.0 t -64.43 -38.73 92.06 Favored 'General case' 0 C--O 1.241 0.635 0 O-C-N 119.936 -1.727 . . . . 2.2000000000000002 113.244 -176.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.36 3.59 86.49 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 126.178 1.847 . . . . 1.6899999999999999 115.325 -175.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.09 -43.23 61.03 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.464 1.505 . . . . 5.2599999999999998 113.958 175.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 178.29 -138.3 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 129.28 3.032 . . . . 3.77 107.116 -173.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -11.6 99.06 0.01 OUTLIER Glycine 0 N--CA 1.475 1.263 0 C-N-CA 127.939 2.685 . . . . 3.7599999999999998 114.284 -174.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.2 t 57.4 163.4 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 116.357 1.984 . . . . 2.7200000000000002 116.357 175.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -137.68 134.71 35.72 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.429 1.891 . . . . 4.9900000000000002 110.532 -171.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 92.9 mt 92.34 -9.08 0.2 Allowed 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 130.135 3.374 . . . . 3.5800000000000001 111.042 -158.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.1 p -132.49 152.16 51.64 Favored 'General case' 0 C--O 1.249 1.035 0 C-N-CA 127.68 2.392 . . . . 1.6699999999999999 114.021 -176.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 10.8 mt -104.62 103.63 13.32 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.163 1.385 . . . . 1.9399999999999999 109.638 172.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.4 t -72.88 150.92 42.22 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 120.395 -1.441 . . . . 2.27 111.017 168.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -40.61 -45.31 2.3 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 116.444 2.016 . . . . 3.2799999999999998 116.444 -165.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.45 -31.45 69.77 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.178 -1.576 . . . . 4.2000000000000002 114.022 177.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -68.52 -47.07 67.9 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.441 1.897 . . . . 2.0299999999999998 109.812 173.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.1 tp -59.8 -37.85 80.28 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.148 0.579 . . . . 1.98 111.117 175.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.1 ttmt -68.33 -42.63 79.03 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 121.654 -0.654 . . . . 3.2599999999999998 111.845 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -51.24 -44.0 61.61 Favored 'General case' 0 CA--C 1.55 0.956 0 CA-C-N 118.405 0.548 . . . . 5.4100000000000001 112.244 164.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.2 tt -63.23 -64.1 1.0 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.013 0.925 . . . . 2.1200000000000001 111.324 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.3 mt -56.94 -50.08 77.01 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 N-CA-C 108.851 -0.796 . . . . 0.77000000000000002 108.851 -175.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.3 tttt -66.22 -13.17 59.89 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 119.708 1.14 . . . . 4.0 113.941 -176.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -95.88 -32.89 12.43 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 117.914 -1.041 . . . . 3.0699999999999998 113.809 168.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -80.82 -46.82 14.75 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.963 1.705 . . . . 4.2999999999999998 111.554 -178.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 26.6 mt -147.44 80.8 1.51 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.157 1.783 . . . . 3.0299999999999998 110.409 -177.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 43.9 t -91.84 -51.01 5.43 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 120.398 -1.439 . . . . 5.54 111.969 169.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.6 mp 52.53 -143.6 0.69 Allowed 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.94 1.296 . . . . 4.5999999999999996 108.17 -165.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -95.64 10.8 68.72 Favored Glycine 0 CA--C 1.533 1.199 0 O-C-N 121.263 -0.898 . . . . 3.8999999999999999 112.312 157.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -107.32 -55.52 2.33 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 118.166 0.983 . . . . 5.5800000000000001 112.812 -157.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 42.7 tpp -76.59 88.01 3.29 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.337 1.455 . . . . 2.73 110.733 -171.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.8 mttp -87.11 166.97 14.6 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.569 1.548 . . . . 3.96 112.737 -175.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -47.61 -53.17 15.49 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 115.593 1.701 . . . . 4.3700000000000001 115.593 -169.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.3 m -73.98 -26.58 60.54 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.139 0.792 . . . . 3.52 113.139 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.8 m -71.27 -29.79 65.5 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 118.819 0.736 . . . . 2.54 110.829 174.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.4 mt -68.55 -47.78 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.214 1.005 . . . . 1.51 110.676 169.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -71.03 -30.92 67.26 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 112.787 0.662 . . . . 4.0499999999999998 112.787 -176.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -73.9 -37.75 64.57 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.355 -0.841 . . . . 3.1200000000000001 112.229 170.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 64.8 tp -60.84 -40.32 92.37 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-O 117.738 -1.125 . . . . 2.02 111.109 169.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -57.31 -51.51 69.08 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 120.278 1.399 . . . . 1.8100000000000001 110.213 176.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 tttm -50.66 -30.39 13.44 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.228 1.411 . . . . 3.3100000000000001 113.673 168.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.35 -32.36 22.49 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.515 1.126 . . . . 2.0699999999999998 112.205 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.7 mt -67.27 -41.54 85.35 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.091 0.956 . . . . 2.3399999999999999 110.622 173.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -94.47 80.02 3.88 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.93 2.092 . . . . 1.6399999999999999 113.297 -167.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -58.77 -21.6 56.16 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 115.044 1.498 . . . . 3.6699999999999999 115.044 -166.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -106.69 -5.73 18.38 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.201 1.4 . . . . 2.3100000000000001 114.374 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.5 t 58.61 31.16 20.79 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.915 1.286 . . . . 2.6499999999999999 114.215 -175.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.6 p30 -69.68 -14.64 62.91 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.578 1.151 . . . . 2.6000000000000001 111.791 175.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 68.02 8.5 6.54 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 129.861 3.264 . . . . 4.5300000000000002 114.39 -178.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -112.56 120.13 40.52 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 127.092 2.157 . . . . 3.1299999999999999 107.554 172.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 15.4 mm -90.23 101.28 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 123.466 0.707 . . . . 1.1000000000000001 109.256 174.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -48.35 155.42 0.51 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.24 1.016 . . . . 3.5899999999999999 111.955 161.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.459 ' CZ ' ' HB3' ' B' ' 80' ' ' CYS . 0.1 OUTLIER -51.43 -41.85 61.11 Favored 'General case' 0 CA--C 1.548 0.865 0 O-C-N 120.634 -1.291 . . . . 3.1499999999999999 110.982 158.122 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.8 pttm -66.86 -21.08 66.02 Favored 'General case' 0 CA--C 1.552 1.023 0 O-C-N 120.035 -1.666 . . . . 3.8300000000000001 114.781 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -85.39 -48.78 8.69 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.147 1.379 . . . . 2.2799999999999998 110.834 170.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -55.89 -33.8 64.96 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 126.029 1.732 . . . . 2.0299999999999998 112.43 174.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.3 t -58.94 -29.1 66.87 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.542 -1.349 . . . . 2.27 113.333 170.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 19.2 t -69.34 -36.86 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 O-C-N 120.563 -1.335 . . . . 2.1000000000000001 110.407 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.405 ' CZ ' HD11 ' A' ' 79' ' ' LEU . 52.5 t80 -63.32 -51.72 64.87 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.525 1.13 . . . . 2.5299999999999998 111.722 169.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 65.9 mt -58.01 -33.77 69.31 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 118.512 0.596 . . . . 1.7 112.388 176.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 50.0 m -62.41 -54.73 35.95 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.642 1.177 . . . . 0.78000000000000003 110.344 171.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 45.6 mtp -53.27 -45.99 69.08 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.401 1.08 . . . . 1.6499999999999999 112.028 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.405 HD11 ' CZ ' ' A' ' 75' ' ' PHE . 88.8 mt -66.83 -48.83 67.68 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 123.898 0.879 . . . . 1.29 112.211 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 9.0 t -66.76 -34.4 77.74 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.695 -0.628 . . . . 1.6499999999999999 112.406 -178.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 89.9 mtp -64.61 -39.1 93.11 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.289 0.636 . . . . 1.55 112.258 168.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.32 -34.68 78.52 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.669 1.122 . . . . 0.70999999999999996 112.743 177.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -63.42 -23.18 67.29 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 113.357 0.873 . . . . 2.54 113.357 170.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.65 -40.45 88.69 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 119.923 1.238 . . . . 2.25 112.472 170.081 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -71.58 -39.24 70.71 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.681 0.792 . . . . 3.1400000000000001 110.825 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.2 -43.35 67.12 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.25 1.42 . . . . 1.98 112.287 170.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -67.76 -27.46 66.79 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.234 1.414 . . . . 2.5800000000000001 112.971 177.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.3 mt -74.31 -15.49 60.96 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 113.454 0.909 . . . . 2.0800000000000001 113.454 172.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -95.07 -4.84 45.64 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.873 1.269 . . . . 4.5300000000000002 114.394 173.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 20.7 t70 . . . . . 0 N--CA 1.468 0.47 0 C-N-CA 125.131 1.372 . . . . 3.77 111.805 175.783 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 74.2 p . . . . . 0 N--CA 1.466 0.37 0 N-CA-C 111.601 0.223 . . . . 2.02 111.601 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.46 -21.95 69.9 Favored 'Trans proline' 0 CA--C 1.537 0.65 0 C-N-CA 121.987 1.791 . . . . 1.3999999999999999 113.235 170.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -83.89 -42.35 16.46 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.757 1.162 . . . . 3.3599999999999999 112.417 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -59.81 -43.18 94.63 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 118.918 0.781 . . . . 4.1799999999999997 110.214 168.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -62.76 -39.29 93.71 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 120.855 -1.153 . . . . 4.0999999999999996 112.471 171.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.97 -52.68 62.06 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.44 1.018 . . . . 0.93000000000000005 111.23 176.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 37.6 mt -57.38 -39.04 75.22 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.785 1.234 . . . . 1.55 112.231 176.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 94.8 m -61.75 -51.98 66.1 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.451 0.7 . . . . 1.6299999999999999 110.793 171.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 86.5 m -55.54 -36.22 66.53 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.396 1.478 . . . . 1.48 112.28 -179.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 75.1 mmm -55.63 -51.98 65.37 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 122.926 0.49 . . . . 3.2799999999999998 111.943 170.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.17 -26.07 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.158 0.89 . . . . 2.52 112.842 -178.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 25.4 m -56.67 -56.49 20.75 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.078 1.351 . . . . 0.77000000000000002 110.844 169.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.98 -35.94 77.29 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 118.08 -0.962 . . . . 2.7200000000000002 109.482 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -59.73 -49.25 78.45 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 118.448 -0.787 . . . . 2.2000000000000002 111.972 177.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 15.8 m80 -56.82 -48.69 77.44 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 120.012 1.278 . . . . 2.0600000000000001 111.544 173.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -26.62 65.93 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 124.144 0.978 . . . . 5.8099999999999996 113.082 178.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -87.96 -30.24 20.18 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.6 -1.313 . . . . 3.2599999999999998 113.281 168.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 42.2 p -87.24 -36.99 17.63 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 120.914 1.688 . . . . 1.77 114.678 -162.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.45 3.15 85.85 Favored Glycine 0 CA--C 1.533 1.166 0 O-C-N 119.714 -1.866 . . . . 1.55 112.922 169.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -43.23 91.68 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 119.042 1.421 . . . . 4.7000000000000002 111.81 -172.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -138.27 157.78 45.59 Favored 'General case' 0 C--O 1.249 1.073 0 C-N-CA 127.237 2.215 . . . . 4.5599999999999996 111.153 173.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.88 7.1 10.92 Favored Glycine 0 CA--C 1.534 1.233 0 CA-C-N 114.703 -1.135 . . . . 2.2999999999999998 113.25 -167.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 53.9 m 48.1 -145.51 0.32 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.044 1.737 . . . . 6.96 111.464 -161.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 32.3 mtpt 71.53 -163.94 0.13 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 127.324 2.25 . . . . 11.51 111.938 169.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 5.4 mp -106.68 14.07 27.34 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.655 1.582 . . . . 4.5599999999999996 111.63 168.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 74.7 p -108.72 149.44 29.0 Favored 'General case' 0 C--O 1.248 1.023 0 C-N-CA 126.223 1.809 . . . . 1.28 113.402 -174.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -115.13 90.62 3.38 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.712 2.405 . . . . 1.98 109.45 -157.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.2 m -81.53 160.58 23.86 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.324 1.45 . . . . 2.0800000000000001 113.304 -173.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -40.44 -41.26 1.37 Allowed 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 116.41 2.004 . . . . 3.5600000000000001 116.41 -175.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? -78.63 -43.04 27.22 Favored 'General case' 0 CA--C 1.546 0.827 0 O-C-N 119.971 -1.706 . . . . 6.4199999999999999 112.034 175.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -53.7 -44.16 69.56 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.364 0.983 . . . . 1.72 109.6 172.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.43 -49.33 77.27 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.889 2.076 . . . . 2.2200000000000002 112.029 176.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -52.39 -47.1 66.42 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 121.093 -1.005 . . . . 2.8999999999999999 111.795 169.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -68.67 -24.21 64.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.108 1.763 . . . . 3.4199999999999999 114.381 177.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.5 tt -71.58 -59.32 2.82 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.001 1.32 . . . . 2.1000000000000001 108.912 172.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 78.8 mt -53.76 -58.71 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.386 0.674 . . . . 1.24 110.419 -176.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -9.15 8.56 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 114.07 1.137 . . . . 5.2199999999999998 114.07 -172.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . 0.434 ' HA ' ' HE2' ' B' ' 40' ' ' LYS . 0.0 OUTLIER -114.29 -40.79 3.59 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 125.942 1.697 . . . . 6.25 110.836 -177.496 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . 0.448 ' HA ' HG21 ' A' ' 3' ' ' THR . 80.9 mt-10 -68.04 -49.9 58.58 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.187 1.358 . . . . 3.9199999999999999 110.839 176.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -115.21 178.24 4.36 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.979 2.512 . . . . 2.8300000000000001 111.93 -171.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.1 m -138.55 -43.35 0.49 Allowed 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 114.774 1.398 . . . . 4.3700000000000001 114.774 165.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 7.4 mp 50.92 -112.73 0.65 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.626 1.571 . . . . 5.9000000000000004 111.759 -176.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -157.99 -58.12 0.01 OUTLIER Glycine 0 N--CA 1.471 1.023 0 CA-C-N 119.067 0.848 . . . . 4.1100000000000003 113.934 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.71 -23.43 66.11 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 117.45 0.625 . . . . 6.7300000000000004 112.018 174.279 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 2.0 ttm -58.5 104.88 0.24 Allowed 'General case' 0 C--N 1.338 0.105 0 C-N-CA 124.988 1.315 . . . . 2.6600000000000001 113.538 -157.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -163.62 176.7 9.4 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 128.122 2.569 . . . . 4.54 109.532 -171.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 33.7 tp10 -39.35 -58.9 1.14 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.912 1.685 . . . . 4.8399999999999999 113.639 -171.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 3.7 m -74.18 -4.88 38.55 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 116.439 2.014 . . . . 2.6299999999999999 116.439 -176.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 97.6 p -102.21 -28.72 12.13 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 120.979 1.718 . . . . 2.2200000000000002 112.5 161.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 54.0 mt -69.5 -39.77 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.645 1.578 . . . . 1.8300000000000001 112.826 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -72.33 -37.4 68.9 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.637 0.653 . . . . 2.9300000000000002 112.546 -177.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -67.92 -45.39 74.5 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.42 -0.8 . . . . 2.96 111.315 169.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.426 HD23 ' C ' ' B' ' 55' ' ' LEU . 4.7 tt -51.86 -51.37 57.17 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 117.588 -1.196 . . . . 2.1400000000000001 110.211 176.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.6 ppp? -64.72 -44.83 88.95 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.128 0.876 . . . . 2.02 112.021 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.54 -32.29 68.75 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.607 1.163 . . . . 3.8199999999999998 111.832 174.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 58.9 m -80.49 -16.92 53.14 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.969 1.307 . . . . 2.2999999999999998 113.663 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 17.7 mt -73.78 -40.32 63.53 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 119.124 0.874 . . . . 2.1299999999999999 110.442 165.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -76.32 149.27 37.07 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.696 1.199 . . . . 2.1499999999999999 114.2 -176.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.77 -2.73 9.28 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.756 1.222 . . . . 2.9500000000000002 112.997 171.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -103.86 -27.47 12.18 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.547 1.314 . . . . 2.0099999999999998 114.547 -168.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 16.4 t 69.5 30.62 4.0 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.246 1.819 . . . . 3.1699999999999999 111.9 -158.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 42.5 p30 -91.21 -24.92 19.75 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.376 1.071 . . . . 2.4100000000000001 112.629 -172.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 63.38 16.8 9.81 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 129.24 3.016 . . . . 5.9900000000000002 113.697 -171.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -116.8 122.23 43.84 Favored 'General case' 0 C--O 1.24 0.565 0 C-N-CA 129.173 2.989 . . . . 2.6800000000000002 108.826 176.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 25.1 mm -101.37 87.87 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 125.779 1.632 . . . . 1.3200000000000001 109.169 -177.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -62.55 165.98 5.74 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.986 0.914 . . . . 4.1500000000000004 111.442 171.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.71 -34.15 37.54 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 120.563 -1.336 . . . . 2.1200000000000001 113.262 -177.443 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -73.66 -17.5 61.14 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.486 1.514 . . . . 4.9900000000000002 114.825 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -93.03 -44.17 8.54 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.38 1.872 . . . . 1.8600000000000001 108.896 169.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -54.07 -36.97 63.7 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.409 1.484 . . . . 2.1000000000000001 113.152 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 90.8 p -68.7 -19.95 64.39 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 119.993 -1.692 . . . . 1.6399999999999999 114.243 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 46.9 t -61.61 -41.78 91.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 120.658 1.572 . . . . 1.47 109.724 172.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -61.4 -52.41 64.69 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.567 1.147 . . . . 1.71 110.397 175.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 76.7 mt -58.22 -33.3 69.17 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.379 0.672 . . . . 1.3 112.066 177.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 28.0 m -67.33 -51.91 46.69 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.401 1.08 . . . . 0.82999999999999996 110.974 175.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 70.7 mtp -55.13 -44.37 74.99 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.539 1.136 . . . . 1.96 111.312 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.91 -51.19 65.64 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.617 1.167 . . . . 2.9300000000000002 111.639 178.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . 0.459 ' HB3' ' CZ ' ' A' ' 69' ' ' PHE . 86.2 m -70.48 -33.58 71.41 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 114.065 1.135 . . . . 1.78 114.065 -175.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 94.0 mtp -68.06 -41.34 82.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 118.934 0.788 . . . . 2.0 111.256 171.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.98 -35.82 77.17 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 118.659 -0.686 . . . . 0.88 112.78 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -76.84 -29.79 56.04 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.729 1.149 . . . . 3.02 112.366 177.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -56.37 -47.67 78.4 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.213 0.915 . . . . 1.77 111.551 165.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -69.75 -35.38 74.92 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.183 0.993 . . . . 3.6200000000000001 112.01 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -60.67 -48.78 80.26 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.438 1.495 . . . . 2.9300000000000002 111.722 173.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -63.86 -34.95 79.09 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.049 0.94 . . . . 4.0700000000000003 111.214 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 83.4 mt -70.77 -11.72 61.12 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.658 0.985 . . . . 2.2599999999999998 113.658 175.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -99.06 -6.12 29.05 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.601 1.561 . . . . 3.6699999999999999 113.747 169.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -110.65 -42.74 3.98 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.061 1.745 . . . . 3.6800000000000002 112.552 -171.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -81.96 24.26 0.64 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.125 1.37 . . . . 3.8799999999999999 113.027 173.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 77.1 tttt . . . . . 0 C--O 1.254 1.306 0 C-N-CA 129.584 3.154 . . . . 5.25 115.78 -163.73 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 C--O 1.238 0.452 0 N-CA-C 105.835 -1.913 . . . . 4.2000000000000002 105.835 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.421 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 12.8 p -73.48 168.52 24.6 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 124.367 1.067 . . . . 2.3199999999999998 112.03 -175.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.421 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 37.5 Cg_endo -63.58 -29.23 70.11 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.756 1.637 . . . . 1.8300000000000001 112.946 176.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 42.7 tp -70.33 -39.66 74.6 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 118.555 0.616 . . . . 3.0800000000000001 111.111 174.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.424 ' HA ' ' HG ' ' A' ' 9' ' ' LEU . 50.0 mt-10 -65.43 -39.09 91.67 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.108 0.563 . . . . 3.8799999999999999 111.923 173.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.1 -43.25 95.71 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.211 -0.931 . . . . 3.6000000000000001 111.723 172.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.95 -51.95 67.5 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.403 1.081 . . . . 0.89000000000000001 112.738 175.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.424 ' HG ' ' HA ' ' A' ' 6' ' ' GLU . 4.5 pp -64.82 -28.47 69.59 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.387 0.994 . . . . 3.2999999999999998 113.195 175.153 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 90.7 m -58.73 -49.94 75.75 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 118.286 -0.864 . . . . 1.55 109.853 167.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.4 m -57.43 -37.27 72.51 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 119.537 1.062 . . . . 1.3500000000000001 111.717 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 80.6 mmm -59.78 -58.27 9.29 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.778 0.831 . . . . 3.1099999999999999 111.541 174.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.2 m -66.94 -29.18 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 O-C-N 121.242 -0.911 . . . . 2.1299999999999999 112.233 -176.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 52.4 m -61.55 -55.38 31.54 Favored 'General case' 0 CA--C 1.506 -0.742 0 C-N-CA 125.591 1.556 . . . . 1.0800000000000001 111.313 176.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -75.87 -35.34 59.91 Favored 'General case' 0 CA--C 1.522 -0.116 0 O-C-N 125.28 1.613 . . . . 2.9300000000000002 109.417 -176.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -57.24 -44.04 83.48 Favored 'General case' 0 C--O 1.226 -0.177 0 CA-C-O 118.504 -0.76 . . . . 2.3100000000000001 111.156 177.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -70.26 -35.71 73.95 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.127 1.33 . . . . 2.27 112.594 175.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -70.65 -12.22 61.42 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.712 1.004 . . . . 6.2599999999999998 113.712 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -107.58 -47.99 3.51 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.903 2.081 . . . . 1.98 112.94 171.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.5 t -62.0 -29.74 70.47 Favored 'General case' 0 C--O 1.249 1.04 0 C-N-CA 126.554 1.941 . . . . 2.04 113.553 176.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.56 -4.84 87.86 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 127.763 2.601 . . . . 1.3899999999999999 114.009 173.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -78.53 60.22 2.61 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.812 1.806 . . . . 6.6299999999999999 110.365 171.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 51.86 -151.07 0.28 Allowed 'General case' 0 C--O 1.252 1.196 0 C-N-CA 126.154 1.782 . . . . 8.3699999999999992 112.803 -175.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.91 -151.59 8.53 Favored Glycine 0 CA--C 1.529 0.966 0 N-CA-C 109.659 -1.376 . . . . 2.0299999999999998 109.659 -145.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.5 m -69.3 161.19 29.8 Favored 'General case' 0 C--O 1.25 1.125 0 CA-C-O 123.338 1.542 . . . . 3.6299999999999999 111.032 155.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.1 mtmt -139.01 108.55 6.18 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.201 1.4 . . . . 7.8499999999999996 108.228 -160.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 43.4 mt 114.6 -17.74 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.482 1 C-N-CA 132.592 4.357 . . . . 3.23 110.459 -154.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.3 p -121.62 161.97 21.49 Favored 'General case' 0 C--O 1.246 0.91 0 C-N-CA 127.177 2.191 . . . . 1.1100000000000001 112.0 173.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 39.8 mt -104.95 117.45 34.04 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.73 1.212 . . . . 1.78 110.1 170.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 13.0 t -80.61 160.29 25.13 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 118.28 0.491 . . . . 2.2799999999999998 111.0 160.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.72 -46.77 2.7 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 127.149 2.18 . . . . 3.8799999999999999 114.045 -169.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -76.01 -27.36 57.35 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 120.706 -1.246 . . . . 6.4500000000000002 112.718 -175.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -65.37 -57.27 8.78 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.733 1.213 . . . . 1.49 108.573 173.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.3 tp -56.39 -45.02 80.78 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.136 0.975 . . . . 2.2599999999999998 112.152 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -31.76 71.69 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.5 -0.75 . . . . 4.6399999999999997 112.846 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -82.33 -28.95 31.32 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.943 0.897 . . . . 4.0599999999999996 112.837 174.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.3 tt -73.34 -52.05 15.25 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.552 1.141 . . . . 2.2999999999999998 110.947 178.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.5 mt -50.88 -60.27 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-N 119.853 1.206 . . . . 1.3200000000000001 111.114 -175.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.273 0.0 OUTLIER -78.1 9.33 3.8 Favored 'General case' 0 CA--C 1.56 1.328 0 N-CA-C 114.197 1.184 . . . . 4.9800000000000004 114.197 -175.778 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.0 mmtm -106.53 -31.04 8.69 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 127.441 2.296 . . . . 2.5800000000000001 112.556 166.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -71.18 -56.74 5.45 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 126.371 1.868 . . . . 4.6200000000000001 108.463 173.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -102.69 125.36 49.4 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 127.863 2.465 . . . . 2.6000000000000001 108.248 172.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 30.4 m -107.07 26.14 10.5 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.455 1.102 . . . . 3.9300000000000002 112.693 176.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -147.44 172.72 13.5 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.716 1.206 . . . . 4.1699999999999999 113.352 -175.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.78 -178.96 53.5 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 124.787 1.184 . . . . 4.2199999999999998 112.919 -175.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -82.83 51.87 2.01 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.92 1.288 . . . . 6.5199999999999996 110.025 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.2 tpt -83.85 56.65 3.76 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 123.249 1.5 . . . . 1.8700000000000001 112.876 -168.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -102.68 175.16 5.59 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.11 1.764 . . . . 4.4699999999999998 112.171 -173.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -58.26 -39.52 79.42 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.14 -0.975 . . . . 3.6200000000000001 113.412 -170.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -71.54 6.23 1.97 Allowed 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 114.571 1.323 . . . . 3.7400000000000002 114.571 175.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 29.7 t -121.75 -48.07 2.17 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.278 1.831 . . . . 2.8100000000000001 109.889 170.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 37.1 mt -54.1 -39.21 40.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.778 1.231 . . . . 1.3 113.304 174.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.69 -54.07 37.37 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.778 0.717 . . . . 4.0099999999999998 111.695 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.96 -30.21 65.05 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.149 0.426 . . . . 2.9300000000000002 112.149 -176.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.8 tt -57.89 -51.61 68.89 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 116.895 -1.526 . . . . 1.98 110.135 165.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.9 ttt -52.22 -48.94 64.85 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 120.98 1.718 . . . . 1.6799999999999999 112.176 174.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.0 mtpt -62.63 -27.23 69.07 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.515 0.726 . . . . 4.7699999999999996 112.676 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.5 m -89.0 -25.73 21.85 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.48 1.512 . . . . 2.48 113.91 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.415 HD22 ' HB2' ' A' ' 75' ' ' PHE . 14.5 mt -63.56 -42.02 98.39 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.685 1.13 . . . . 2.0600000000000001 110.676 171.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -87.13 142.34 27.99 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 124.588 1.155 . . . . 1.8 113.509 -169.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.98 9.6 42.07 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.55 1.54 . . . . 3.1099999999999999 112.779 178.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -143.48 -25.65 0.58 Allowed 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 115.969 1.841 . . . . 2.2400000000000002 115.969 -164.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.6 m 56.45 34.31 24.04 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.432 1.493 . . . . 2.3999999999999999 112.88 -161.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -79.43 1.17 26.45 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.116 1.767 . . . . 2.1699999999999999 111.558 178.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 58.53 -13.43 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 129.475 3.11 . . . . 4.2599999999999998 116.569 -163.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -101.45 123.65 45.86 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-O 124.071 1.891 . . . . 2.7200000000000002 112.239 -176.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.6 mm -92.49 93.81 4.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 113.747 -1.57 . . . . 1.25 109.013 171.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -53.15 147.22 10.16 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 127.283 2.233 . . . . 2.5 110.542 164.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -47.44 -37.19 11.11 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.58 1.152 . . . . 2.3999999999999999 113.079 178.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -69.56 -31.08 69.05 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.714 2.405 . . . . 2.9700000000000002 113.862 176.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -77.49 -47.66 19.06 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.595 1.158 . . . . 2.0899999999999999 109.06 170.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -55.05 -28.16 50.12 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.297 1.439 . . . . 1.8799999999999999 112.277 173.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 52.1 m -62.03 -26.93 68.53 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 119.882 -1.761 . . . . 2.2400000000000002 113.683 171.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 m -78.68 -28.94 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 CA-C-N 121.004 1.729 . . . . 2.7999999999999998 112.831 175.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.492 ' CE1' HD11 ' A' ' 79' ' ' LEU . 18.0 t80 -59.97 -55.14 37.76 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.357 1.063 . . . . 1.8200000000000001 110.678 169.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.1 mt -56.06 -38.84 71.16 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.754 0.822 . . . . 1.8999999999999999 112.438 175.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 75.8 m -60.74 -55.53 32.12 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.495 1.118 . . . . 0.81000000000000005 111.562 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 16.3 ptp -61.07 -38.08 84.95 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.986 0.812 . . . . 1.77 112.333 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.492 HD11 ' CE1' ' A' ' 75' ' ' PHE . 85.5 mt -64.74 -41.44 95.94 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.829 0.851 . . . . 1.73 113.047 175.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 40.4 t -71.7 -32.16 67.51 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.656 0.613 . . . . 1.3600000000000001 112.656 178.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 77.2 mtp -65.83 -43.27 89.07 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.284 0.475 . . . . 1.6299999999999999 112.284 167.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.22 -38.07 89.73 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.659 0.663 . . . . 1.0 111.95 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -61.35 -20.56 63.13 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.18 1.178 . . . . 2.4100000000000001 114.18 174.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.407 HD21 ' CE1' ' B' ' 17' ' ' HIS . 0.2 OUTLIER -71.25 -40.88 70.73 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 120.77 1.623 . . . . 2.9199999999999999 112.332 171.109 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -69.51 -45.12 69.64 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.872 1.269 . . . . 3.46 109.833 -177.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.68 -46.43 67.25 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.539 1.936 . . . . 3.1899999999999999 111.224 171.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -68.58 -27.28 65.92 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.252 1.021 . . . . 3.48 113.645 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 58.5 mt -72.0 -8.26 53.48 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 120.759 -1.213 . . . . 2.6699999999999999 113.51 175.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -98.56 0.23 44.54 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 114.73 1.382 . . . . 5.21 114.73 167.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 30.7 t70 . . . . . 0 N--CA 1.474 0.73 0 C-N-CA 125.148 1.379 . . . . 3.8599999999999999 111.466 165.967 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.479 0.991 0 CA-C-O 119.301 -0.381 . . . . 2.0 110.536 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -63.17 -14.86 44.44 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.273 1.982 . . . . 1.9099999999999999 112.446 173.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.01 -48.1 15.03 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.316 1.447 . . . . 2.71 111.155 171.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -52.1 -42.21 63.06 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.494 1.043 . . . . 3.9199999999999999 110.753 167.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . 0.444 ' HA ' ' CE ' ' B' ' 7' ' ' LYS . 0.0 OUTLIER -71.77 -25.87 62.21 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 114.781 1.4 . . . . 5.1399999999999997 114.781 178.965 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.31 -51.57 59.75 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 117.685 -1.15 . . . . 1.1000000000000001 111.439 165.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.2 mp -59.41 -40.64 87.33 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 121.05 1.75 . . . . 2.6699999999999999 111.898 173.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 40.3 m -53.78 -51.63 62.81 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.455 1.102 . . . . 1.54 110.001 173.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 90.8 m -53.48 -37.43 62.69 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.516 1.126 . . . . 1.4199999999999999 112.638 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 11.5 mtp -61.49 -47.04 87.44 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.105 0.562 . . . . 3.8599999999999999 111.671 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 4.0 p -76.02 -32.4 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-O 118.438 -0.791 . . . . 2.23 113.008 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 89.1 m -54.86 -56.72 16.43 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.171 1.35 . . . . 1.1599999999999999 110.547 175.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.43 -37.21 77.3 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.543 -0.753 . . . . 2.6800000000000002 109.705 -175.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -60.68 -52.93 63.05 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.626 0.77 . . . . 2.3500000000000001 112.673 175.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . 0.407 ' CE1' HD21 ' A' ' 84' ' ' ASN . 9.3 t60 -66.23 -38.0 86.86 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.75 0.82 . . . . 2.25 111.312 -178.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.563 ' HZ3' ' HB3' ' B' ' 18' ' ' LYS . 3.7 ttpm? -56.19 -58.94 5.8 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.86 1.264 . . . . 5.2300000000000004 112.069 170.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -67.36 -25.91 66.21 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 121.259 -0.901 . . . . 1.8400000000000001 112.699 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 61.1 m -63.33 -10.08 14.78 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.839 1.051 . . . . 1.6299999999999999 113.839 171.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -88.11 -7.4 73.68 Favored Glycine 0 CA--C 1.536 1.399 0 CA-C-O 118.347 -1.252 . . . . 1.4299999999999999 115.216 170.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 7.0 mmt180 -70.26 -3.59 17.86 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 120.406 2.103 . . . . 3.75 114.489 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -175.0 174.0 2.56 Favored 'General case' 0 C--O 1.247 0.94 0 C-N-CA 129.328 3.051 . . . . 3.6400000000000001 108.39 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -40.28 153.69 0.06 OUTLIER Glycine 0 N--CA 1.468 0.822 0 C-N-CA 126.469 1.985 . . . . 3.02 114.459 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 35.6 m 63.76 124.53 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.245 1.418 . . . . 3.5600000000000001 111.753 -176.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 24.1 tttt -102.08 -4.19 26.34 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 114.05 1.13 . . . . 7.4800000000000004 114.05 -178.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.506 ' H ' HD23 ' B' ' 27' ' ' LEU . 1.9 pt? -103.49 0.12 30.62 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.105 1.762 . . . . 3.6200000000000001 112.94 169.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 9.6 p -132.16 153.84 50.13 Favored 'General case' 0 C--O 1.249 1.052 0 C-N-CA 125.609 1.563 . . . . 1.3700000000000001 109.155 173.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.406 HD12 ' HB ' ' B' ' 67' ' ' ILE . 0.2 OUTLIER -110.42 124.56 51.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.375 -1.284 . . . . 1.76 109.537 158.527 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 9.7 p -59.25 165.63 2.57 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.015 0.526 . . . . 2.1600000000000001 111.225 167.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 23.4 ttt180 -52.5 -29.74 26.63 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 120.562 -1.336 . . . . 5.5899999999999999 114.117 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 tmtt? -79.34 -36.36 39.56 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.716 -1.24 . . . . 5.3200000000000003 112.863 177.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -63.85 -53.79 45.14 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.589 0.709 . . . . 1.9099999999999999 109.512 169.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 20.2 tp -51.74 -41.21 61.39 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 128.058 2.543 . . . . 2.2000000000000002 112.427 176.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 15.8 mttt -56.37 -46.85 79.84 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 121.079 -1.013 . . . . 3.25 112.476 -178.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -60.91 -53.22 59.91 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 117.761 -1.114 . . . . 3.8300000000000001 111.718 173.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -51.98 -53.47 41.1 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.429 1.013 . . . . 2.5 111.48 177.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 96.4 mt -60.35 -55.49 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-N 119.575 1.08 . . . . 1.22 109.12 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 25.6 ttpt -69.15 -15.19 63.35 Favored 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 113.281 0.845 . . . . 4.4500000000000002 113.281 -169.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 18.3 mmtp -85.77 -63.11 1.38 Allowed 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 127.49 2.316 . . . . 4.0700000000000003 112.402 170.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -75.41 -9.03 58.21 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.856 0.862 . . . . 4.8700000000000001 112.584 -171.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 89.6 mt -125.83 42.3 3.33 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.416 1.486 . . . . 3.2400000000000002 110.727 165.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 19.5 p -68.13 11.59 0.15 Allowed 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 115.444 1.646 . . . . 3.04 115.444 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -103.49 -6.3 21.94 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.005 1.722 . . . . 3.0299999999999998 113.843 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -131.87 -171.43 12.82 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 124.395 0.998 . . . . 3.0499999999999998 115.07 -170.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -74.65 53.78 0.58 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.213 1.805 . . . . 5.29 112.583 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.91 19.16 9.32 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.327 1.851 . . . . 3.3999999999999999 113.219 -179.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.0 ptmt -52.44 152.42 3.53 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.898 1.679 . . . . 3.9700000000000002 112.886 165.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -39.29 -54.77 1.8 Allowed 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 116.41 2.004 . . . . 3.79 116.41 -163.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 8.7 m -67.53 -23.19 65.42 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 114.458 1.281 . . . . 3.3700000000000001 114.458 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 8.2 t -65.79 -26.16 67.57 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 120.757 -1.214 . . . . 2.4500000000000002 111.125 169.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 74.7 mt -88.21 -8.75 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.988 1.315 . . . . 1.97 111.449 175.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -72.94 -44.93 60.59 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.051 -1.031 . . . . 3.4300000000000002 109.03 160.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.575 ' HA ' ' HE3' ' B' ' 57' ' ' LYS . 9.9 t0 -71.17 -47.34 58.21 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.508 0.594 . . . . 3.3700000000000001 112.355 176.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -59.17 -39.74 83.45 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 118.169 -0.919 . . . . 2.8399999999999999 111.05 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 27.6 tpp -53.79 -65.11 0.62 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.866 0.866 . . . . 2.48 109.26 169.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . 0.575 ' HE3' ' HA ' ' B' ' 54' ' ' ASP . 12.1 ttpp -48.16 -34.78 10.47 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.845 1.658 . . . . 4.5800000000000001 114.034 177.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 52.4 m -87.14 -30.57 20.96 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.312 1.045 . . . . 2.77 113.595 -174.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.1 pp -90.99 -36.27 14.18 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.211 -0.931 . . . . 2.6000000000000001 112.087 174.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . 0.426 ' O ' ' HE3' ' B' ' 61' ' ' LYS . 30.5 t70 -76.06 153.66 36.22 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.412 1.485 . . . . 2.7400000000000002 112.404 171.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . 0.426 ' HE3' ' O ' ' B' ' 60' ' ' ASP . 6.4 mmtp -130.36 15.35 5.56 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.401 1.26 . . . . 3.5299999999999998 114.401 -171.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -161.4 -3.42 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 117.028 2.233 . . . . 2.5499999999999998 117.028 -165.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 74.0 m 60.65 41.81 14.7 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.077 2.151 . . . . 2.6200000000000001 112.877 179.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 59.0 p30 -95.39 -17.98 21.11 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.495 1.518 . . . . 2.5699999999999998 112.76 -174.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 62.76 -12.31 0.08 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 129.85 3.26 . . . . 5.5700000000000003 115.806 -172.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -79.46 131.35 36.04 Favored 'General case' 0 C--O 1.249 1.07 0 CA-C-N 120.906 1.685 . . . . 3.8500000000000001 111.224 161.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . 0.406 ' HB ' HD12 ' B' ' 29' ' ' LEU . 33.6 mm -107.09 94.18 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 115.131 -0.94 . . . . 1.24 109.579 174.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -60.11 154.9 18.33 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.355 1.862 . . . . 2.96 112.262 168.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -46.55 -38.0 8.81 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.99 1.716 . . . . 2.6400000000000001 113.418 178.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -78.81 -38.22 38.79 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 120.648 -1.282 . . . . 3.2599999999999998 112.568 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -56.18 -52.56 63.93 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 119.237 0.926 . . . . 2.3399999999999999 108.749 168.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -52.09 -41.86 62.76 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.932 1.293 . . . . 2.5 113.454 174.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.7 -24.61 65.41 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.681 -1.262 . . . . 2.6000000000000001 113.514 176.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 79.7 t -73.67 -35.52 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 119.148 0.885 . . . . 1.76 110.666 172.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -59.98 -51.2 70.68 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.728 0.695 . . . . 1.8200000000000001 111.191 167.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 93.4 mt -58.87 -36.18 74.2 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 118.865 -0.588 . . . . 1.3600000000000001 112.329 176.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 95.1 m -59.88 -47.4 85.91 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.313 1.045 . . . . 0.75 111.109 173.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 57.4 mtm -58.17 -42.74 86.68 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.467 1.03 . . . . 1.5700000000000001 112.437 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 70.6 mt -65.6 -48.41 72.4 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.191 0.596 . . . . 1.6299999999999999 112.182 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 69.0 m -59.55 -43.14 93.63 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.284 0.634 . . . . 1.9299999999999999 111.839 176.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 23.8 mtp -64.97 -34.94 79.62 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.253 0.933 . . . . 2.0899999999999999 112.577 175.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.9 -45.51 77.74 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.808 0.731 . . . . 0.70999999999999996 112.154 176.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -67.65 -25.26 65.63 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.305 0.854 . . . . 2.4500000000000002 113.305 175.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -66.0 -47.25 75.12 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 119.066 0.848 . . . . 2.3799999999999999 111.058 176.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -67.2 -37.77 84.22 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.591 1.156 . . . . 2.71 112.23 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.16 -48.98 77.38 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.811 1.244 . . . . 2.1000000000000001 111.036 174.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -57.01 -33.03 66.75 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.07 0.948 . . . . 2.4199999999999999 113.008 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.86 -42.61 97.52 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.394 0.997 . . . . 3.5699999999999998 112.08 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -72.76 -32.25 65.51 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 114.777 1.399 . . . . 3.71 114.777 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 -75.22 -29.43 60.27 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.347 1.859 . . . . 4.3399999999999999 114.062 -177.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -105.83 10.1 32.67 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.362 1.065 . . . . 3.54 112.926 -172.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 3.3 ttpm? . . . . . 0 C--O 1.249 1.079 0 C-N-CA 129.584 3.154 . . . . 5.2000000000000002 116.69 -177.227 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 . . . . . 0 CA--C 1.549 0.905 0 N-CA-C 107.497 -1.298 . . . . 6.2199999999999998 107.497 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 35.3 p -70.94 166.88 33.37 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 126.441 1.896 . . . . 1.5800000000000001 111.835 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -59.61 -25.02 77.58 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 121.961 1.774 . . . . 1.3700000000000001 113.567 169.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tt -85.42 -38.07 19.09 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.521 1.055 . . . . 2.3999999999999999 112.272 178.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.2 tm-20 -54.34 -46.48 72.93 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.619 1.1 . . . . 4.7400000000000002 109.639 161.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.3 mtpt -64.91 -23.19 67.15 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 121.477 -0.765 . . . . 5.0999999999999996 111.991 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.06 -46.55 56.46 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.575 1.15 . . . . 0.91000000000000003 110.997 173.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -70.0 -39.61 75.78 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.793 1.237 . . . . 2.8900000000000001 112.942 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.3 m -58.88 -43.5 90.92 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.431 1.492 . . . . 1.95 110.793 168.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 53.5 m -60.32 -47.57 85.45 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.614 1.097 . . . . 1.3899999999999999 109.531 169.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.1 ttm -57.6 -49.61 75.85 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 117.316 -1.325 . . . . 2.9500000000000002 111.915 -175.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.9 p -69.68 -25.41 28.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 CA-C-N 119.992 1.269 . . . . 2.2799999999999998 112.978 174.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.8 m -66.58 -53.35 35.49 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 117.537 -1.221 . . . . 0.88 110.104 174.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -53.48 -42.78 67.61 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.822 0.737 . . . . 2.4900000000000002 109.113 167.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -63.31 -44.03 96.13 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 119.588 -0.845 . . . . 2.5 111.326 -170.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.3 m80 -73.19 -34.8 66.18 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 115.03 1.493 . . . . 1.98 115.03 171.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -67.86 -24.74 65.28 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.632 1.106 . . . . 4.9500000000000002 113.301 175.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -102.95 -42.66 5.75 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.769 1.628 . . . . 2.2999999999999998 113.048 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.0 m -67.58 -15.28 63.57 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 120.173 1.351 . . . . 2.7000000000000002 113.122 172.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.93 14.94 60.54 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 125.69 1.614 . . . . 1.8899999999999999 114.68 168.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.5 mmp_? -94.28 -3.16 51.08 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 119.627 1.714 . . . . 5.71 113.465 176.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 177.23 176.1 0.38 Allowed 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 129.39 3.076 . . . . 4.5599999999999996 110.558 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.65 -147.55 36.31 Favored Glycine 0 N--CA 1.47 0.944 0 C-N-CA 126.0 1.762 . . . . 2.0600000000000001 113.595 167.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.9 t -66.68 155.95 36.59 Favored 'General case' 0 C--O 1.25 1.085 0 O-C-N 120.718 -1.46 . . . . 3.6099999999999999 110.751 163.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.7 pttp -65.8 -24.11 66.84 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.745 1.218 . . . . 6.7000000000000002 112.165 169.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.3 tp -70.61 -52.54 20.74 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.192 1.397 . . . . 3.7200000000000002 109.339 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 65.4 p -96.12 155.97 16.53 Favored 'General case' 0 C--O 1.253 1.269 0 C-N-CA 124.719 1.208 . . . . 0.96999999999999997 112.948 -165.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -89.91 116.25 27.84 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 112.122 -2.308 . . . . 2.73 108.827 153.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.4 p -75.47 170.44 16.11 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.163 0.585 . . . . 2.1800000000000002 110.751 158.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.37 -45.31 3.03 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 125.51 1.524 . . . . 3.7599999999999998 113.195 178.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? -70.07 -45.01 67.94 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 119.943 -1.723 . . . . 6.2300000000000004 113.102 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -61.07 -41.46 96.65 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.951 0.9 . . . . 1.5900000000000001 110.693 -176.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.52 -40.86 98.16 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.303 1.841 . . . . 2.4500000000000002 112.077 -179.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.6 ttmt -64.74 -43.08 94.5 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.028 -1.045 . . . . 3.6099999999999999 112.277 171.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -64.24 -36.25 83.46 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.848 0.859 . . . . 4.1600000000000001 111.738 176.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.1 tp -65.88 -69.59 0.29 Allowed 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 128.058 2.543 . . . . 2.5699999999999998 111.608 177.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.3 mt -56.81 -51.35 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 CA-C-N 119.641 1.109 . . . . 1.03 110.32 -174.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -72.55 -4.35 30.09 Favored 'General case' 0 CA--C 1.555 1.156 0 O-C-N 121.279 -0.888 . . . . 4.0300000000000002 112.11 -173.458 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -96.56 -45.31 6.78 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-O 117.155 -1.402 . . . . 3.9300000000000002 112.715 159.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -51.81 -44.61 63.57 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 119.897 1.226 . . . . 4.2800000000000002 111.76 175.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.2 mt -139.19 66.5 1.41 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.632 2.773 . . . . 2.5499999999999998 108.798 -169.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.6 t -70.91 21.52 0.04 OUTLIER 'General case' 0 CA--C 1.559 1.304 0 O-C-N 120.534 -1.354 . . . . 4.29 114.556 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -83.51 162.2 20.99 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 120.186 -1.571 . . . . 4.0700000000000003 113.169 -174.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.38 -0.68 24.31 Favored Glycine 0 N--CA 1.477 1.381 0 N-CA-C 116.451 1.34 . . . . 3.3599999999999999 116.451 -171.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -75.4 -32.09 60.63 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 118.599 1.199 . . . . 7.1699999999999999 110.971 166.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.53 151.41 27.76 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.597 1.159 . . . . 3.0800000000000001 111.083 174.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.88 176.83 0.52 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 130.413 3.485 . . . . 4.5300000000000002 108.639 178.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -55.58 -51.4 67.26 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 120.942 1.701 . . . . 6.2199999999999998 110.344 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.0 m -67.34 60.26 0.06 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.799 2.04 . . . . 3.73 113.302 168.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.6 t 172.63 -54.53 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 129.311 3.045 . . . . 2.3399999999999999 108.877 -176.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 13.9 mm -61.72 -39.57 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.376 1.47 . . . . 1.54 111.802 174.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -69.9 -26.63 64.26 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.276 0.843 . . . . 3.3300000000000001 113.276 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -85.63 -32.25 22.13 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.286 0.948 . . . . 2.1800000000000002 112.266 173.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.54 -43.67 76.04 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.4 0.68 . . . . 2.9100000000000001 109.941 163.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.7 tpt -54.33 -29.71 48.88 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 119.526 1.057 . . . . 1.52 113.374 173.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.0 mttm -83.49 -31.71 26.35 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.617 1.167 . . . . 5.29 112.703 174.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 46.3 t -81.69 -32.94 31.49 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 126.217 1.807 . . . . 2.4199999999999999 113.699 -177.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -68.59 -39.04 81.1 Favored 'General case' 0 C--N 1.334 -0.065 0 C-N-CA 126.223 1.809 . . . . 2.2200000000000002 111.178 173.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -84.67 144.41 28.58 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.24 1.416 . . . . 2.2400000000000002 111.225 -176.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.7 ttmt -116.25 -27.75 6.75 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.256 1.206 . . . . 4.3499999999999996 114.256 -163.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -96.84 -67.42 0.85 Allowed 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.224 1.81 . . . . 3.0499999999999998 113.243 165.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 53.1 m 137.56 38.78 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.489 1 C-N-CA 133.071 4.548 . . . . 2.6699999999999999 110.71 -172.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.9 p30 -91.36 -15.8 28.44 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.205 -1.56 . . . . 2.3199999999999998 112.784 -177.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.4 5.49 1.18 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 128.324 2.65 . . . . 5.4800000000000004 115.287 -168.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -102.12 129.39 48.46 Favored 'General case' 0 C--O 1.24 0.599 0 C-N-CA 125.188 1.395 . . . . 3.6800000000000002 110.929 164.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 10.7 mm -99.69 105.91 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 124.467 1.107 . . . . 1.1000000000000001 110.908 175.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -79.94 154.1 28.51 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.721 2.409 . . . . 3.2000000000000002 109.366 166.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.02 -39.18 62.98 Favored 'General case' 0 CA--C 1.547 0.833 0 O-C-N 120.172 -1.58 . . . . 2.5899999999999999 113.867 -178.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.3 pttm -71.51 -12.96 61.65 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.393 1.257 . . . . 3.1099999999999999 114.393 175.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 73.2 mt-10 -79.67 -63.37 1.43 Allowed 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 108.299 -1.0 . . . . 1.72 108.299 158.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -49.97 -33.44 17.79 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 126.915 2.086 . . . . 2.3799999999999999 115.618 -171.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.2 t -58.14 -22.56 51.66 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.721 -1.237 . . . . 3.0 112.597 176.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 5.5 p -58.23 -46.22 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 CA-C-N 119.108 0.867 . . . . 2.2599999999999998 111.137 173.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -70.27 -48.23 57.71 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 125.783 1.633 . . . . 2.71 111.93 178.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.5 mt -53.85 -37.61 63.82 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 122.924 0.49 . . . . 1.8100000000000001 111.384 175.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 42.8 m -68.21 -51.31 46.99 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.733 1.213 . . . . 1.3 111.751 173.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 40.1 mtm -54.88 -42.58 72.26 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.803 1.183 . . . . 1.8 112.668 177.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.97 -47.53 82.77 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.403 0.681 . . . . 1.25 111.653 174.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 88.4 m -62.72 -35.7 80.59 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.511 0.93 . . . . 1.3999999999999999 113.511 175.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 58.9 mtp -62.25 -43.65 98.33 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 118.797 0.726 . . . . 2.4300000000000002 111.267 174.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.29 -41.26 85.72 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 122.844 0.458 . . . . 0.89000000000000001 111.522 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -72.3 -29.23 63.66 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.634 -0.666 . . . . 2.8599999999999999 111.868 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -65.15 -44.22 89.28 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.292 0.951 . . . . 1.8999999999999999 111.753 171.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -61.01 -45.31 95.31 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.258 1.023 . . . . 2.6800000000000002 111.515 174.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -53.29 -48.24 68.52 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.56 1.544 . . . . 2.4399999999999999 111.991 176.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -61.8 -34.47 75.97 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.78 1.232 . . . . 2.4399999999999999 112.275 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 79.9 mt -72.33 -16.86 61.88 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.62 0.97 . . . . 1.6000000000000001 113.62 178.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -95.16 -11.66 27.77 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.336 1.236 . . . . 3.1099999999999999 114.336 172.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.7 t70 . . . . . 0 N--CA 1.471 0.617 0 C-N-CA 125.818 1.647 . . . . 2.8399999999999999 113.034 -168.886 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.7 p . . . . . 0 N--CA 1.47 0.545 0 CA-C-O 119.516 -0.278 . . . . 1.8799999999999999 111.238 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -67.91 -16.69 45.98 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 122.211 1.941 . . . . 1.3899999999999999 111.742 173.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.26 -46.65 27.02 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-O 118.143 -0.932 . . . . 2.48 110.576 173.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -57.6 -48.13 80.26 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.708 1.14 . . . . 4.6600000000000001 109.612 172.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -62.5 -29.62 70.68 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.351 -0.843 . . . . 4.21 112.978 178.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.04 -43.31 79.02 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.491 1.117 . . . . 0.81999999999999995 111.822 171.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 32.8 mt -66.3 -40.83 90.26 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 119.346 0.975 . . . . 1.75 111.3 173.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 90.3 m -59.95 -42.51 94.21 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.993 1.317 . . . . 1.3100000000000001 111.686 172.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 92.2 m -59.47 -43.77 93.18 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.139 0.976 . . . . 1.3400000000000001 110.654 171.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -59.99 -51.82 68.04 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.605 0.762 . . . . 3.52 111.286 177.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 48.5 t -56.94 -31.6 36.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 125.078 1.351 . . . . 1.79 113.15 175.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 33.3 m -65.47 -55.26 18.92 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.406 1.082 . . . . 0.77000000000000002 110.491 175.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.8 -39.58 71.51 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.347 0.659 . . . . 1.6699999999999999 110.9 170.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -59.91 -53.84 53.11 Favored 'General case' 0 C--O 1.225 -0.196 0 O-C-N 123.778 0.674 . . . . 2.1200000000000001 109.285 -174.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 28.0 m80 -56.39 -49.25 75.01 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.598 -0.689 . . . . 2.4100000000000001 112.522 172.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.39 -26.44 67.84 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 114.13 1.159 . . . . 6.1399999999999997 114.13 -176.18 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -107.04 -32.42 7.86 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 120.438 -1.414 . . . . 2.2400000000000002 113.162 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 42.3 t -72.34 -38.22 68.67 Favored 'General case' 0 C--O 1.247 0.935 0 C-N-CA 125.191 1.396 . . . . 1.6699999999999999 113.167 176.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.69 2.86 81.63 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 125.58 1.562 . . . . 1.74 114.299 176.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -43.96 25.98 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.498 1.149 . . . . 3.1899999999999999 111.782 -171.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -159.97 -163.0 1.06 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.865 1.666 . . . . 3.9500000000000002 110.787 177.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 58.48 -135.94 51.48 Favored Glycine 0 N--CA 1.468 0.768 0 N-CA-C 109.301 -1.52 . . . . 2.3900000000000001 109.301 -171.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 5.3 t -82.84 162.08 21.74 Favored 'General case' 0 C--O 1.248 0.985 0 CA-C-O 124.4 2.048 . . . . 3.1600000000000001 112.105 152.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -91.65 143.31 26.69 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.543 1.537 . . . . 6.7000000000000002 108.674 171.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.3 tp 82.31 -15.04 0.72 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 128.174 2.59 . . . . 2.9500000000000002 112.868 -164.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 54.8 p -112.38 144.62 41.52 Favored 'General case' 0 C--O 1.246 0.874 0 C-N-CA 125.859 1.664 . . . . 1.0900000000000001 114.542 169.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 52.5 mt -94.11 101.41 13.43 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.069 2.148 . . . . 2.04 109.514 167.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.2 t -71.59 162.0 30.13 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 120.69 -1.257 . . . . 1.99 111.452 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 tmm_? -53.93 -14.28 0.97 Allowed 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 116.345 1.98 . . . . 5.0499999999999998 116.345 -174.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.01 -45.74 8.16 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.318 -1.488 . . . . 5.8700000000000001 113.302 164.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -52.36 -45.62 65.82 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.488 1.115 . . . . 1.6399999999999999 109.893 175.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -61.15 -56.62 18.74 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.5 1.52 . . . . 2.5299999999999998 111.924 -178.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -69.93 -27.45 64.78 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 119.933 -1.73 . . . . 3.5 112.935 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -70.78 -26.02 63.15 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.992 0.738 . . . . 3.3399999999999999 112.992 169.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 34.5 tp -72.66 -58.16 3.57 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-O 117.339 -1.315 . . . . 2.0299999999999998 110.813 172.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 38.2 mt -53.03 -49.24 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 CA-C-N 119.864 1.211 . . . . 1.1399999999999999 110.423 -178.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 22.6 mtpp -64.45 -12.15 40.64 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.262 1.208 . . . . 4.5099999999999998 114.262 -175.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -109.12 -27.15 9.76 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.524 1.53 . . . . 3.5899999999999999 113.256 172.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -72.22 -38.84 68.88 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 127.878 2.471 . . . . 4.96 113.22 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 43.1 mt -147.56 79.78 1.49 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.505 1.522 . . . . 3.6099999999999999 109.215 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 15.7 p -90.19 -16.48 29.38 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.397 1.258 . . . . 2.7799999999999998 114.397 -172.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -57.93 -2.24 0.15 Allowed 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 119.228 3.047 . . . . 3.71 119.228 -170.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 163.65 161.98 13.78 Favored Glycine 0 N--CA 1.472 1.056 0 CA-C-N 120.562 1.528 . . . . 3.9199999999999999 114.45 174.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 73.97 -45.69 0.6 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 127.504 2.321 . . . . 5.96 113.534 172.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 33.4 tpp -78.12 71.68 4.6 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 124.19 1.948 . . . . 2.1600000000000001 115.41 -148.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -84.84 168.77 14.79 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.555 2.342 . . . . 4.8799999999999999 111.879 170.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -52.96 -48.42 67.39 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.688 0.795 . . . . 3.54 112.085 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 53.3 p -68.14 -4.2 12.97 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.495 1.665 . . . . 4.3399999999999999 115.495 178.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 16.4 m -97.73 -26.71 14.64 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.641 1.11 . . . . 2.5699999999999998 112.229 165.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 81.2 mt -82.09 -49.0 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 125.27 1.428 . . . . 1.95 111.713 -177.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -75.82 -15.4 60.24 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.042 0.386 . . . . 4.04 112.042 -165.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -75.33 -41.95 55.55 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.436 0.695 . . . . 4.0300000000000002 112.021 160.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.34 -43.89 79.51 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.041 0.936 . . . . 3.1000000000000001 110.621 172.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 9.7 tpt -56.87 -47.87 79.43 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.951 2.1 . . . . 1.97 111.495 172.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.6 tmtt? -66.23 -24.91 66.69 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.409 1.084 . . . . 5.1799999999999997 113.487 173.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.7 t -84.06 -41.2 17.43 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 120.695 -1.253 . . . . 2.6000000000000001 112.086 -178.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 14.1 mt -57.01 -59.55 4.9 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 127.395 2.278 . . . . 2.71 111.155 164.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -85.64 56.29 3.89 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 123.139 1.447 . . . . 1.7 110.856 -171.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -58.05 -19.62 33.03 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.535 1.534 . . . . 6.5599999999999996 114.026 -169.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -95.55 -10.7 28.91 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 116.441 2.015 . . . . 1.75 116.441 174.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 23.0 t 62.2 32.69 17.17 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.2 1.4 . . . . 2.5499999999999998 114.4 -178.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 46.2 p30 -73.56 -18.5 61.07 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 121.106 -0.996 . . . . 2.2000000000000002 111.388 172.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 78.63 6.64 2.35 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 131.572 3.949 . . . . 4.3099999999999996 115.918 179.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -131.21 140.43 49.88 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.865 1.666 . . . . 2.3500000000000001 111.278 175.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 28.7 mt -110.15 118.96 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 O-C-N 121.152 -0.967 . . . . 1.23 111.988 -173.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -93.6 164.3 13.22 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 127.136 2.174 . . . . 3.1800000000000002 111.032 165.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -49.06 -32.52 9.72 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.016 1.726 . . . . 2.25 115.142 -176.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.92 -45.95 69.53 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.121 -0.987 . . . . 3.4399999999999999 111.164 179.34 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -58.25 -48.95 78.81 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.66 1.184 . . . . 1.76 109.326 171.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -56.54 -24.51 47.33 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 114.785 1.402 . . . . 2.1099999999999999 114.785 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 29.3 t -55.86 -27.83 53.53 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 120.422 -1.424 . . . . 2.6200000000000001 114.003 170.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 89.5 t -64.45 -50.53 75.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-N 119.244 0.929 . . . . 1.54 109.981 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -61.28 -45.58 93.9 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.107 0.963 . . . . 1.79 111.853 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 87.9 mt -56.26 -41.93 76.57 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 122.966 0.506 . . . . 2.0499999999999998 112.014 174.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 39.0 m -62.05 -46.72 87.89 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.91 0.884 . . . . 1.3700000000000001 111.34 174.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 88.5 mtp -61.17 -42.55 98.77 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.002 0.819 . . . . 2.3199999999999998 112.324 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 79.4 mt -61.36 -54.1 48.04 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.511 0.724 . . . . 1.8300000000000001 111.171 174.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 52.5 m -56.19 -40.95 74.76 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 114.048 1.129 . . . . 1.76 114.048 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 50.4 mtp -74.3 -31.06 62.34 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 118.666 -0.683 . . . . 2.5099999999999998 111.927 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.13 -36.46 72.1 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.73 0.696 . . . . 0.85999999999999999 111.411 172.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -65.23 -26.85 68.3 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 121.389 -0.82 . . . . 2.5299999999999998 112.784 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -61.53 -44.02 97.81 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 120.264 1.393 . . . . 2.5800000000000001 112.013 171.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -74.21 -35.16 63.9 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.92 0.888 . . . . 3.48 111.982 178.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -56.29 -45.9 79.99 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.829 1.251 . . . . 2.4100000000000001 111.094 170.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -63.38 -15.72 58.36 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.476 1.51 . . . . 2.1299999999999999 112.677 175.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 56.9 mt -98.92 -5.11 31.35 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.824 1.65 . . . . 2.6400000000000001 114.216 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -84.38 -32.72 24.04 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.655 1.182 . . . . 4.6200000000000001 112.809 161.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -75.35 -47.35 28.06 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.954 1.302 . . . . 3.0099999999999998 112.936 -174.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -83.44 28.65 0.54 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 125.255 1.422 . . . . 3.48 113.627 -176.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 44.1 mttp . . . . . 0 C--O 1.251 1.184 0 CA-C-O 115.01 -2.424 . . . . 5.5800000000000001 115.145 173.321 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 . . . . . 0 C--O 1.241 0.606 0 N-CA-C 106.658 -1.608 . . . . 4.96 106.658 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 75.9 p -55.9 161.33 3.58 Favored Pre-proline 0 N--CA 1.475 0.807 0 C-N-CA 126.657 1.983 . . . . 1.8300000000000001 112.166 175.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.44 -14.84 47.0 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 122.07 1.847 . . . . 1.9199999999999999 113.258 173.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -80.32 -48.37 13.09 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.893 1.224 . . . . 3.2599999999999998 111.375 173.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -55.55 -37.17 67.63 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 121.854 0.835 . . . . 4.2800000000000002 110.432 168.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.84 -37.51 87.86 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.719 -1.238 . . . . 3.3399999999999999 113.149 170.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.6 -44.05 91.82 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.228 1.011 . . . . 1.6399999999999999 112.026 174.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.0 mt -63.83 -45.31 90.14 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.692 0.797 . . . . 2.1099999999999999 110.711 175.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 49.2 m -52.61 -53.47 46.31 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.22 1.408 . . . . 2.0299999999999998 111.514 170.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.3 t -69.99 -31.52 69.24 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 118.051 -0.976 . . . . 2.8900000000000001 112.123 -177.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 37.8 mtt -60.59 -44.77 95.88 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.193 0.997 . . . . 3.0899999999999999 112.092 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 33.6 m -75.27 -25.7 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 119.571 1.078 . . . . 2.6499999999999999 112.812 175.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.3 m -69.29 -50.2 48.94 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.385 1.474 . . . . 1.23 111.555 177.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.4 p -60.53 -41.94 95.45 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.155 -0.684 . . . . 2.4100000000000001 109.155 172.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -65.0 -49.46 70.14 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 118.563 -0.732 . . . . 2.9700000000000002 111.236 -173.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.6 m80 -59.61 -43.96 93.59 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 120.301 1.409 . . . . 2.5099999999999998 113.276 172.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -63.45 -44.49 94.37 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.228 1.011 . . . . 3.7999999999999998 112.712 -175.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -76.55 -43.59 38.45 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.978 0.911 . . . . 2.1400000000000001 112.343 172.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.7 t -62.94 -26.0 68.61 Favored 'General case' 0 C--O 1.242 0.669 0 N-CA-C 115.347 1.61 . . . . 2.2200000000000002 115.347 -163.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.37 2.85 75.6 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 125.053 1.311 . . . . 2.2599999999999998 114.913 173.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.61 63.95 7.82 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.18 1.49 . . . . 6.7199999999999998 108.167 169.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 78.71 -171.37 0.06 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.927 1.691 . . . . 4.1200000000000001 112.984 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.84 -149.66 29.32 Favored Glycine 0 C--N 1.341 0.833 0 N-CA-C 109.363 -1.495 . . . . 2.5899999999999999 109.363 -159.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 63.7 m -76.98 166.83 22.79 Favored 'General case' 0 C--O 1.248 1.005 0 O-C-N 121.286 -1.126 . . . . 2.6499999999999999 112.017 151.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.8 ptmt -85.94 4.87 35.69 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 126.364 1.866 . . . . 4.9100000000000001 113.923 169.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 40.8 tp -96.93 -5.14 38.67 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.463 1.905 . . . . 3.4900000000000002 110.73 167.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.2 p -146.45 149.73 34.25 Favored 'General case' 0 C--O 1.253 1.263 0 N-CA-C 114.799 1.407 . . . . 0.97999999999999998 114.799 -161.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.2 mt -107.99 102.35 11.53 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 113.512 -1.676 . . . . 1.5600000000000001 110.137 173.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.3 t -75.85 173.24 11.42 Favored 'General case' 0 CA--C 1.552 1.031 0 O-C-N 120.884 -1.135 . . . . 2.79 112.764 173.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -55.52 -9.82 0.55 Allowed 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 127.615 2.366 . . . . 3.3900000000000001 117.272 -171.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.471 ' HG2' ' H ' ' A' ' 33' ' ' GLU . 7.0 ptmt -93.39 -50.39 5.47 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.741 1.385 . . . . 4.0300000000000002 114.741 164.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.471 ' H ' ' HG2' ' A' ' 32' ' ' LYS . 22.2 mt-10 -54.2 -41.12 68.26 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.663 1.985 . . . . 2.4199999999999999 108.933 176.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.455 ' CD1' HD11 ' A' ' 38' ' ' ILE . 0.9 OUTLIER -67.79 -47.94 67.72 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 114.333 -1.303 . . . . 2.3500000000000001 110.78 -175.635 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.632 ' HG2' HG21 ' A' ' 52' ' ' ILE . 68.3 mttt -55.24 -49.53 71.77 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.165 -0.959 . . . . 4.4000000000000004 112.108 171.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -66.78 -10.29 45.92 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.263 1.425 . . . . 3.4199999999999999 114.437 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.7 tt -94.27 -54.27 3.62 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.887 1.221 . . . . 1.9199999999999999 111.402 165.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.545 HD13 HD23 ' A' ' 55' ' ' LEU . 36.6 mt -53.52 -50.83 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 CA-C-N 119.978 1.263 . . . . 0.96999999999999997 110.999 -175.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.5 mtpt -71.99 -2.57 18.67 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.599 0.963 . . . . 3.9399999999999999 113.599 -177.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -101.97 -15.74 16.71 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.45 1.9 . . . . 3.1200000000000001 113.63 167.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -94.45 -55.07 3.29 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.423 1.489 . . . . 4.4199999999999999 112.544 178.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -68.69 91.04 0.42 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.806 2.042 . . . . 2.1899999999999999 110.332 -177.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.4 t -62.58 -17.04 59.26 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.876 1.27 . . . . 5.7599999999999998 112.5 173.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 28.0 mt -59.13 -25.74 64.12 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 127.908 2.483 . . . . 3.8500000000000001 113.765 171.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.67 -34.72 0.85 Allowed Glycine 0 CA--C 1.538 1.479 0 C-N-CA 125.233 1.397 . . . . 3.3700000000000001 116.456 170.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -67.17 -4.62 10.77 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.19 1.796 . . . . 5.25 114.762 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.5 tpt -69.89 78.71 0.47 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 123.514 1.626 . . . . 2.4500000000000002 109.795 167.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.6 ttmp? -94.53 147.65 23.06 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 127.894 2.478 . . . . 4.8499999999999996 111.658 -160.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -47.64 -44.39 26.92 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.984 2.113 . . . . 4.6100000000000003 115.463 -160.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.4 m -71.91 -35.46 69.7 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.002 1.274 . . . . 2.4700000000000002 113.36 176.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.7 m -74.36 -9.38 58.54 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.871 1.269 . . . . 2.3100000000000001 112.608 173.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.632 HG21 ' HG2' ' A' ' 35' ' ' LYS . 7.2 mm -79.75 -29.51 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-O 118.447 -0.787 . . . . 2.3700000000000001 110.908 166.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.36 -33.73 75.83 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.848 1.204 . . . . 2.5099999999999998 110.726 173.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -70.54 -43.42 69.57 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.174 0.897 . . . . 3.3100000000000001 112.507 168.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.545 HD23 HD13 ' A' ' 38' ' ' ILE . 37.1 tp -62.67 -46.42 88.29 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.387 -0.816 . . . . 1.95 111.559 178.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.09 -53.92 36.63 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 124.199 1.0 . . . . 2.7000000000000002 110.768 166.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 tmpt? -56.59 -28.81 61.16 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 120.243 1.383 . . . . 4.6100000000000003 113.25 177.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.2 m -83.76 -37.29 22.82 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.119 1.767 . . . . 1.8300000000000001 112.642 -177.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 11.0 mp -65.0 -49.87 68.54 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.538 0.735 . . . . 2.6000000000000001 110.661 163.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -88.97 59.69 5.13 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 127.406 2.283 . . . . 1.5700000000000001 112.139 -170.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.9 mtmp? -40.57 -32.69 0.22 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 127.456 2.302 . . . . 3.6499999999999999 115.764 -177.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -98.94 -6.51 28.66 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 115.651 1.722 . . . . 2.3599999999999999 115.651 -178.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.8 t 57.87 31.54 20.67 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.852 1.661 . . . . 2.7599999999999998 114.331 -178.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -69.07 -16.82 63.78 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.969 0.907 . . . . 2.2000000000000002 111.397 173.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.58 15.37 2.13 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 130.214 3.405 . . . . 3.98 114.368 178.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -131.18 133.84 45.92 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 127.841 2.456 . . . . 2.52 110.48 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.2 mm -107.34 99.45 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.129 0.972 . . . . 1.73 111.097 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -68.32 157.11 36.35 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.531 1.933 . . . . 2.8599999999999999 110.343 170.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.5 -35.23 52.56 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 120.13 1.332 . . . . 2.0299999999999998 113.001 179.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -63.91 -30.2 71.3 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.238 -0.914 . . . . 3.4100000000000001 113.182 174.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -83.56 -45.83 13.1 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.862 1.265 . . . . 2.6000000000000001 110.434 175.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -49.7 -44.16 47.97 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 126.19 1.796 . . . . 3.3900000000000001 111.812 176.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.5 t -60.56 -22.75 64.02 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 120.594 -1.317 . . . . 2.3500000000000001 114.121 176.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.7 t -68.89 -32.91 56.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 O-C-N 120.015 -1.678 . . . . 2.4399999999999999 110.882 176.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -60.55 -57.15 13.95 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.993 0.917 . . . . 1.8600000000000001 110.961 171.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -53.59 -43.49 68.61 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.965 0.906 . . . . 2.3599999999999999 111.344 176.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 58.9 m -51.97 -54.97 23.43 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.615 1.166 . . . . 0.93000000000000005 111.291 173.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 78.8 mtm -63.44 -43.04 98.57 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 118.817 -0.611 . . . . 1.72 112.412 -177.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 63.1 mt -63.21 -39.37 94.45 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.492 0.587 . . . . 1.3300000000000001 112.182 176.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.45 ' HB3' ' CZ ' ' B' ' 69' ' ' PHE . 87.9 m -65.06 -38.1 89.71 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 118.674 -0.679 . . . . 1.49 112.514 172.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 15.1 mtp -64.75 -36.07 83.13 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.453 1.024 . . . . 2.29 113.165 171.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.66 -53.08 53.06 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.295 0.952 . . . . 0.90000000000000002 111.946 174.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -65.04 -25.97 68.06 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.573 0.953 . . . . 2.46 113.573 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -60.31 -43.07 96.68 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.52 1.128 . . . . 3.0099999999999998 113.074 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -75.23 -45.02 42.97 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.014 1.326 . . . . 2.8100000000000001 111.358 178.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -49.76 -48.68 50.17 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.346 1.859 . . . . 2.0099999999999998 110.939 175.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -56.11 -27.12 52.67 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.462 1.505 . . . . 2.1099999999999999 113.386 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 43.6 mt -80.12 -27.87 39.08 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.184 -0.947 . . . . 1.53 112.432 178.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -87.36 -20.04 27.29 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.747 1.219 . . . . 2.73 113.888 175.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 26.6 t70 . . . . . 0 CA--C 1.54 0.572 0 C-N-CA 128.401 2.68 . . . . 2.8199999999999998 113.669 -178.741 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 41.3 p . . . . . 0 N--CA 1.471 0.607 0 CA-C-O 119.528 -0.272 . . . . 2.52 110.41 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -63.96 -23.9 67.68 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.341 2.027 . . . . 1.72 112.218 173.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 73.7 mt -75.07 -43.21 54.54 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.187 0.995 . . . . 3.3100000000000001 111.895 174.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -66.99 -28.57 68.36 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.011 1.278 . . . . 3.8700000000000001 112.086 168.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -36.07 82.88 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.188 -1.57 . . . . 4.9900000000000002 112.551 167.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.0 -44.79 68.64 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.287 1.035 . . . . 0.93000000000000005 112.371 171.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 50.2 mt -60.82 -42.36 97.54 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.86 1.209 . . . . 1.72 111.838 175.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 20.8 p -68.81 -37.48 79.25 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 117.776 -1.107 . . . . 2.0299999999999998 111.904 173.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 85.3 m -59.09 -42.81 91.37 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.944 1.247 . . . . 1.24 111.45 169.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 8.4 mtt -58.24 -51.44 69.77 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.678 0.791 . . . . 3.4300000000000002 110.61 175.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.32 -36.58 64.52 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 113.883 1.068 . . . . 1.76 113.883 173.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 90.7 m -63.22 -52.66 61.31 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.443 1.497 . . . . 0.70999999999999996 110.928 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.16 -39.1 65.92 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 114.878 -1.056 . . . . 2.5899999999999999 108.525 -175.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -57.53 -45.65 84.79 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.039 0.535 . . . . 2.1899999999999999 111.019 176.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 6.7 m80 -68.7 -29.46 67.9 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.776 1.028 . . . . 2.4100000000000001 113.776 177.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 18.7 ttmm -68.04 -28.31 67.28 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.35 1.06 . . . . 3.6099999999999999 113.475 176.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -85.79 -45.83 11.24 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.927 0.891 . . . . 2.7000000000000002 112.08 166.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 38.3 t -60.69 -27.25 67.73 Favored 'General case' 0 C--O 1.249 1.054 0 N-CA-C 114.524 1.305 . . . . 1.6699999999999999 114.524 -175.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.96 -2.25 90.28 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 116.637 -2.201 . . . . 1.46 115.268 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.4 mtp85 -75.11 -110.71 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.559 1.544 . . . . 3.75 110.207 172.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -44.37 129.55 6.49 Favored 'General case' 0 C--O 1.248 1.0 0 CA-C-N 120.48 1.491 . . . . 4.1699999999999999 111.201 171.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.43 -35.41 91.67 Favored Glycine 0 N--CA 1.469 0.848 0 CA-C-N 114.533 -1.212 . . . . 2.4300000000000002 115.64 -132.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 2.0 t -62.25 138.27 58.39 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.089 1.756 . . . . 4.1600000000000001 111.754 172.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -130.95 155.87 46.06 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.836 1.654 . . . . 6.1500000000000004 111.861 -169.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.0 mp 76.16 3.44 3.67 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 128.877 2.871 . . . . 4.1699999999999999 111.921 -157.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 10.9 p -143.47 149.03 36.98 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 131.322 3.849 . . . . 1.98 112.082 -166.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 50.4 mt -118.65 121.21 39.62 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.182 1.793 . . . . 2.0800000000000001 111.799 -176.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 4.7 t -91.77 -178.72 5.12 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.089 1.356 . . . . 2.2599999999999998 113.926 166.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 29.8 ttp85 -60.5 -23.91 64.9 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.144 2.177 . . . . 5.4299999999999997 116.597 -161.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 mptt -110.47 -19.44 12.93 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 115.095 1.517 . . . . 8.1199999999999992 115.095 172.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -54.8 -59.59 4.52 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.093 0.957 . . . . 2.3100000000000001 109.32 160.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -61.86 -39.66 92.64 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 127.101 2.16 . . . . 2.3300000000000001 110.963 -177.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -39.67 82.04 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.177 -1.577 . . . . 5.7699999999999996 113.993 178.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 32.7 tp10 -90.31 -21.46 22.04 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 118.003 -0.999 . . . . 4.0 112.611 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . 0.42 HD23 ' C ' ' B' ' 37' ' ' LEU . 5.7 tt -54.46 -62.37 1.7 Allowed 'General case' 0 C--N 1.343 0.315 0 CA-C-O 118.086 -0.959 . . . . 2.4300000000000002 109.499 164.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 35.1 mt -47.61 -57.62 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 C-N-CA 123.892 0.877 . . . . 1.29 110.479 -175.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -72.96 -2.39 20.78 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 113.894 1.072 . . . . 4.9900000000000002 113.894 -168.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 24.9 mttp -117.7 -33.6 4.48 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 120.358 -1.464 . . . . 3.1299999999999999 114.331 170.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -60.32 -41.32 93.24 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.839 1.255 . . . . 5.25 110.151 170.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -102.0 117.23 34.38 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 106.281 -1.748 . . . . 2.4500000000000002 106.281 158.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 9.2 t -110.1 -9.71 14.7 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.3 1.04 . . . . 3.8399999999999999 112.811 -171.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -54.61 -2.76 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 117.915 2.561 . . . . 3.9199999999999999 117.915 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.37 17.32 59.04 Favored Glycine 0 N--CA 1.476 1.307 0 CA-C-N 120.116 1.325 . . . . 4.6699999999999999 115.208 174.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.7 -163.4 1.02 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.359 1.464 . . . . 6.46 111.652 177.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 78.18 178.04 0.14 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.515 2.726 . . . . 3.2599999999999998 114.713 176.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -165.58 139.95 4.74 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.182 1.793 . . . . 7.3300000000000001 108.517 -175.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -61.56 -31.88 71.93 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 121.057 1.753 . . . . 4.7400000000000002 111.643 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.3 m -70.44 24.81 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.263 1.825 . . . . 3.0899999999999999 115.285 165.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -139.77 15.54 2.5 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.411 1.485 . . . . 2.6099999999999999 111.939 154.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 71.7 mt -112.28 -46.59 5.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.612 1.165 . . . . 1.3999999999999999 111.204 -176.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.83 -30.03 71.02 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.055 0.843 . . . . 3.71 111.586 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -78.6 -46.38 19.45 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 128.696 2.798 . . . . 5.3499999999999996 113.967 171.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 48.9 tp -58.25 -35.98 72.54 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.18 0.446 . . . . 2.5600000000000001 111.157 173.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.4 mmm -49.29 -46.24 46.24 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.899 1.28 . . . . 2.3199999999999998 111.194 171.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.3 mptt -68.72 -39.78 80.26 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.745 -1.222 . . . . 7.2000000000000002 112.129 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.5 t -64.98 -29.57 70.5 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-O 122.229 1.014 . . . . 1.8999999999999999 113.303 -176.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.2 mp -76.66 -21.35 55.56 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.594 1.158 . . . . 2.9399999999999999 112.717 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -89.14 127.67 35.74 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.968 1.307 . . . . 2.3399999999999999 110.133 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.32 11.53 21.05 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 120.616 -1.302 . . . . 3.8199999999999998 112.753 -170.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 33.4 p30 -163.45 -27.01 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.69 1.737 . . . . 2.3799999999999999 115.69 -165.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 29.9 t 70.38 51.96 0.36 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.436 1.495 . . . . 2.7999999999999998 110.603 -170.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 11.7 p30 -82.86 -54.57 5.0 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.48 1.512 . . . . 3.8999999999999999 109.871 -174.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 171.74 -25.5 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 131.656 3.982 . . . . 8.4299999999999997 113.881 169.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -154.96 154.54 32.74 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 125.331 1.452 . . . . 2.27 110.49 -163.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 3.1 mm -92.99 105.37 16.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 126.072 1.749 . . . . 1.6599999999999999 109.037 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.1 165.32 20.54 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.41 -0.806 . . . . 3.1499999999999999 110.631 167.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . 0.45 ' CZ ' ' HB3' ' A' ' 80' ' ' CYS . 0.4 OUTLIER -54.1 -38.57 65.51 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 120.421 -1.424 . . . . 3.73 112.997 178.642 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -76.67 -21.7 55.06 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.75 -1.219 . . . . 4.3899999999999997 113.69 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -69.75 -61.45 1.78 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.182 0.993 . . . . 2.2999999999999998 109.507 160.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.04 -32.85 70.13 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 128.504 2.721 . . . . 2.3100000000000001 114.866 -172.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 60.2 p -61.85 -14.75 36.34 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 119.482 -2.011 . . . . 1.76 113.299 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 5.1 p -60.67 -29.37 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 O-C-N 121.06 -1.025 . . . . 2.5499999999999998 112.486 170.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . 0.436 ' CZ ' HD11 ' B' ' 79' ' ' LEU . 67.7 t80 -75.77 -47.72 24.72 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.506 1.522 . . . . 2.25 111.33 175.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 93.8 mt -54.67 -35.7 63.82 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.225 0.61 . . . . 1.49 111.555 169.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 19.3 m -63.14 -53.81 47.5 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.199 0.999 . . . . 1.03 111.312 172.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 19.8 mtm -56.45 -49.7 73.85 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.93 0.892 . . . . 1.6599999999999999 112.191 177.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.436 HD11 ' CZ ' ' B' ' 75' ' ' PHE . 85.2 mt -60.94 -43.83 98.12 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.33 1.052 . . . . 1.5 111.589 178.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.6 t -72.59 -28.79 63.01 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 113.08 0.77 . . . . 2.1499999999999999 113.08 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 86.2 mtp -67.22 -42.74 83.57 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 118.996 0.816 . . . . 2.5499999999999998 111.074 170.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.06 -27.25 69.27 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 118.711 0.687 . . . . 1.1299999999999999 112.706 173.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -73.31 -28.62 62.18 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.311 1.226 . . . . 2.79 114.311 170.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -65.65 -44.79 85.28 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 120.275 1.398 . . . . 2.7599999999999998 109.804 170.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -67.67 -31.84 72.1 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.135 0.974 . . . . 2.9199999999999999 110.614 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.11 -50.88 70.14 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.763 1.225 . . . . 2.8700000000000001 111.852 167.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -59.61 -33.08 71.04 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.501 1.52 . . . . 2.0099999999999998 112.243 -177.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 94.2 mt -79.27 -18.62 52.39 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.836 1.254 . . . . 1.6799999999999999 113.782 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -95.13 -11.79 27.56 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 114.381 1.252 . . . . 3.54 114.381 176.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -94.23 -50.21 5.38 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.556 1.542 . . . . 3.1899999999999999 112.798 174.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -82.0 52.63 2.01 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.274 1.43 . . . . 2.6600000000000001 111.792 -174.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 57.2 mmtt . . . . . 0 C--O 1.248 1.021 0 C-N-CA 128.558 2.743 . . . . 4.9299999999999997 114.609 171.515 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 C--O 1.239 0.511 0 N-CA-C 106.126 -1.805 . . . . 3.7400000000000002 106.126 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.9 p -62.64 163.6 14.92 Favored Pre-proline 0 CA--C 1.54 0.561 0 C-N-CA 126.334 1.853 . . . . 1.4299999999999999 113.547 -167.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -67.86 -12.76 36.41 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 122.406 2.071 . . . . 1.29 113.342 169.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.08 -38.08 32.48 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.718 1.145 . . . . 2.3100000000000001 110.891 174.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -55.7 -53.97 49.98 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 108.473 -0.936 . . . . 4.7000000000000002 108.473 166.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.6 mttp -64.38 -25.08 67.87 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 112.316 0.488 . . . . 3.5099999999999998 112.316 -176.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.41 -47.02 58.65 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.203 0.91 . . . . 0.93000000000000005 111.722 171.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 43.5 mt -62.83 -44.53 95.9 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.02 0.928 . . . . 1.54 111.387 176.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 88.1 m -61.51 -46.4 90.14 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.459 1.903 . . . . 1.45 111.908 173.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.8 m -61.67 -45.48 93.83 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.215 0.916 . . . . 1.47 110.468 177.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -60.49 -52.61 64.46 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.618 0.645 . . . . 3.7599999999999998 110.937 -177.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.7 p -63.95 -23.63 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 O-C-N 120.96 -1.088 . . . . 2.2000000000000002 113.318 177.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.9 m -65.87 -58.3 5.91 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 117.721 -1.133 . . . . 1.03 109.826 172.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -40.3 66.57 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.822 0.849 . . . . 2.1299999999999999 110.291 175.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -57.31 -49.59 75.61 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 124.718 1.261 . . . . 2.1699999999999999 110.433 -174.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -61.97 -42.22 98.88 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.274 -0.892 . . . . 2.2200000000000002 112.633 175.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -69.5 -36.41 76.46 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.838 -1.164 . . . . 6.8899999999999997 112.764 -176.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -85.12 -20.08 30.85 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.414 1.486 . . . . 2.3700000000000001 114.567 172.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.7 p -55.84 -32.23 63.43 Favored 'General case' 0 N--CA 1.485 1.303 0 O-C-N 119.79 -1.819 . . . . 2.4399999999999999 113.509 171.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 109.72 -131.31 10.41 Favored Glycine 0 C--N 1.34 0.792 0 CA-C-N 114.255 -1.339 . . . . 2.6699999999999999 114.298 126.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -123.32 -14.64 7.39 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 127.112 2.165 . . . . 5.1200000000000001 111.85 -171.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -131.59 153.3 50.03 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 126.96 2.104 . . . . 4.2199999999999998 111.705 -170.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.64 -124.32 34.19 Favored Glycine 0 C--N 1.337 0.625 0 CA-C-N 113.302 -1.772 . . . . 2.1800000000000002 109.75 -169.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 42.2 t -98.08 168.99 9.93 Favored 'General case' 0 C--O 1.252 1.19 0 CA-C-O 122.651 1.215 . . . . 2.9700000000000002 111.434 160.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -107.95 22.37 16.06 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 129.594 3.157 . . . . 4.96 111.987 175.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.4 tp -96.0 -5.02 42.12 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.463 1.105 . . . . 3.4900000000000002 110.386 153.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.1 p -150.6 135.69 17.68 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 113.173 0.805 . . . . 1.0800000000000001 113.173 -151.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.5 mp -98.53 108.91 21.72 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.783 1.233 . . . . 2.21 112.297 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.1 p -64.26 158.15 24.03 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 124.562 1.145 . . . . 3.04 112.54 167.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.7 tpt180 -44.39 -43.52 7.7 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.479 0.918 . . . . 4.6900000000000004 113.479 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.77 -33.53 66.36 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.039 1.125 . . . . 4.0599999999999996 114.039 179.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -64.86 -51.46 61.91 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.518 1.527 . . . . 2.21 108.589 173.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.3 tp -58.34 -41.64 85.07 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.027 0.931 . . . . 2.3300000000000001 112.732 175.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tmpt? -53.79 -33.68 56.74 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.41 0.684 . . . . 6.9000000000000004 112.385 177.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -79.51 -48.76 13.33 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 118.538 -0.744 . . . . 3.9700000000000002 111.191 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.3 tp -49.15 -59.84 3.31 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.306 1.042 . . . . 1.95 111.263 177.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.5 mt -57.99 -35.0 50.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 123.242 0.617 . . . . 1.1799999999999999 110.556 -177.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -72.71 -2.88 21.99 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.563 1.32 . . . . 4.2199999999999998 114.563 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt -133.1 -28.34 1.54 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 127.124 2.17 . . . . 3.1400000000000001 112.476 -172.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -68.54 -123.29 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 107.701 -1.222 . . . . 4.1200000000000001 107.701 144.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -56.98 -53.12 61.69 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 115.869 1.803 . . . . 2.3999999999999999 115.869 -158.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 17.0 t 62.07 -4.06 0.22 Allowed 'General case' 0 CA--C 1.558 1.269 0 N-CA-C 116.59 2.07 . . . . 3.9199999999999999 116.59 172.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -42.82 -49.56 5.76 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 115.911 1.819 . . . . 4.9299999999999997 115.911 -151.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.81 -37.13 0.43 Allowed Glycine 0 N--CA 1.468 0.78 0 C-N-CA 124.781 1.181 . . . . 3.6899999999999999 112.98 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -61.87 -35.36 78.07 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.214 1.006 . . . . 7.3099999999999996 111.834 172.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -71.37 63.53 0.38 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 127.027 2.131 . . . . 2.3100000000000001 114.347 -178.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.6 mmmt -92.26 165.23 13.21 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 129.285 3.034 . . . . 7.7800000000000002 109.788 161.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.509 ' CD ' ' H ' ' A' ' 49' ' ' GLU . 3.0 mp0 -42.38 -51.41 4.91 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.106 1.762 . . . . 4.7599999999999998 114.654 -168.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.1 m -71.99 -28.21 63.26 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 114.964 1.468 . . . . 2.9300000000000002 114.964 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.4 t -76.22 -27.52 56.85 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 120.316 -1.49 . . . . 1.8899999999999999 111.004 170.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 74.8 mt -74.11 -22.94 18.39 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 O-C-N 121.327 -0.858 . . . . 1.74 111.039 169.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.27 -51.28 54.87 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.91 1.284 . . . . 3.73 110.488 168.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.472 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 3.4 t70 -69.15 -39.74 78.62 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.269 0.47 . . . . 2.3199999999999998 112.269 178.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 57.4 tp -63.78 -50.9 67.19 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 116.524 -1.703 . . . . 2.0499999999999998 110.757 173.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.1 ttt -53.81 -48.53 69.78 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-N 121.305 1.866 . . . . 1.5700000000000001 110.31 174.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.472 ' HE2' ' HA ' ' A' ' 54' ' ' ASP . 2.4 tmmm? -56.37 -29.47 61.47 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.191 0.996 . . . . 3.4100000000000001 113.502 174.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 24.4 t -77.24 -33.2 56.1 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 120.215 -1.553 . . . . 2.1200000000000001 112.912 174.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 18.9 mt -80.56 -47.57 14.0 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.793 0.724 . . . . 2.1299999999999999 111.821 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -79.14 79.07 5.58 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 127.964 2.505 . . . . 2.1800000000000002 111.918 -163.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -68.32 -18.35 64.48 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 116.516 2.043 . . . . 3.7999999999999998 116.516 -177.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.84 -26.99 49.77 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 120.641 1.564 . . . . 2.6699999999999999 111.669 161.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.3 m 58.77 76.21 0.36 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.79 2.036 . . . . 3.5 111.413 177.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -146.27 -109.0 0.1 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.305 -0.861 . . . . 3.2000000000000002 110.082 -151.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -139.49 -20.7 0.93 Allowed 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 115.522 1.675 . . . . 5.6100000000000003 115.522 168.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -130.82 153.08 49.46 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 122.95 1.357 . . . . 3.8500000000000001 113.651 174.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 27.3 mt -90.2 113.9 27.02 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 C-N-CA 126.863 2.065 . . . . 2.3500000000000001 110.55 173.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -64.77 156.99 28.77 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.579 1.151 . . . . 3.6299999999999999 110.662 163.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -57.15 -28.98 63.22 Favored 'General case' 0 CA--C 1.549 0.937 0 O-C-N 120.897 -1.127 . . . . 2.9100000000000001 110.859 165.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.81 -25.88 63.98 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 120.097 -1.627 . . . . 6.2599999999999998 113.746 174.2 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -80.97 -53.21 6.64 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.672 1.189 . . . . 2.4199999999999999 109.288 170.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -48.67 -23.93 1.19 Allowed 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 127.273 2.229 . . . . 2.46 114.573 176.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 47.0 m -52.9 -36.22 59.11 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.647 1.579 . . . . 2.27 112.537 171.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 p -79.65 -30.24 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 121.621 -0.674 . . . . 2.1899999999999999 111.696 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -60.23 -56.91 15.76 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.749 0.82 . . . . 1.79 110.611 173.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.1 mt -58.84 -34.62 71.76 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.678 0.791 . . . . 1.6100000000000001 112.625 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 84.1 m -62.71 -54.27 41.84 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.459 1.104 . . . . 0.87 111.173 173.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 46.6 mtp -54.58 -47.02 73.83 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.243 0.928 . . . . 1.78 111.364 177.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.74 -50.21 71.96 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.401 1.08 . . . . 1.46 112.392 178.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 93.1 m -63.82 -33.95 76.83 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.192 0.906 . . . . 1.72 113.429 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 92.5 mtp -64.16 -43.89 93.79 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.221 0.918 . . . . 1.8400000000000001 111.129 175.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.53 -39.73 92.13 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.07 0.548 . . . . 0.72999999999999998 112.272 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -62.44 -31.64 72.38 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.387 0.884 . . . . 2.2799999999999998 113.387 174.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 15.2 t30 -73.29 -37.18 66.31 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.631 1.105 . . . . 1.79 112.134 178.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.88 -37.99 89.48 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.195 0.998 . . . . 3.0600000000000001 112.123 167.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.05 -43.38 91.7 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.865 0.866 . . . . 1.95 111.267 174.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -63.35 -32.2 73.56 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.367 1.467 . . . . 2.3599999999999999 112.007 176.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 35.0 mt -74.94 -17.97 60.47 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.189 -0.944 . . . . 1.4199999999999999 113.025 175.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -94.61 4.24 54.09 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.969 1.707 . . . . 2.6299999999999999 113.779 169.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 11.0 t70 . . . . . 0 N--CA 1.474 0.753 0 C-N-CA 124.889 1.276 . . . . 4.04 110.975 164.068 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 2.6 p . . . . . 0 N--CA 1.476 0.871 0 CA-C-O 119.732 -0.175 . . . . 2.5600000000000001 111.175 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -73.93 -10.65 23.2 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.393 2.062 . . . . 1.8100000000000001 112.744 169.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -67.9 -54.58 17.69 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.693 1.197 . . . . 2.75 111.662 -177.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -57.37 -30.85 65.21 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 118.996 0.816 . . . . 4.0899999999999999 111.979 175.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -74.89 -33.92 62.12 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 120.522 -1.361 . . . . 5.4000000000000004 111.848 176.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.22 -46.19 65.01 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.472 1.509 . . . . 0.81999999999999995 111.304 173.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.3 mp -66.65 -36.73 83.26 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.14 0.882 . . . . 2.4399999999999999 111.381 176.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 54.5 m -56.21 -48.36 76.58 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 121.592 -0.692 . . . . 1.55 111.07 166.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 90.4 m -62.46 -35.46 79.38 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.629 1.172 . . . . 1.1699999999999999 111.766 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -54.84 -59.9 4.1 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 118.439 -0.791 . . . . 3.5600000000000001 110.607 166.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 17.8 m -67.83 -17.89 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 CA-C-N 120.332 1.424 . . . . 2.1800000000000002 113.588 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 62.3 m -71.83 -48.87 43.19 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.752 1.621 . . . . 0.78000000000000003 111.171 171.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 64.5 p -58.07 -33.35 68.95 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 118.202 -0.904 . . . . 2.1800000000000002 110.101 166.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -72.76 -49.54 30.23 Favored 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 119.713 1.142 . . . . 2.4900000000000002 111.834 -175.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -72.63 -17.45 61.67 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 120.171 -1.58 . . . . 2.4100000000000001 114.459 178.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -82.72 -66.46 0.89 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.392 0.677 . . . . 4.6100000000000003 111.77 166.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -69.69 -29.98 67.54 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.591 1.087 . . . . 1.97 113.633 -175.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 19.9 p -70.91 -19.31 62.61 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 122.445 2.384 . . . . 1.8 111.986 172.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -94.04 17.69 58.28 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 126.886 2.184 . . . . 2.2000000000000002 113.477 168.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 51.2 tpt85 -72.9 -28.89 62.74 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.207 1.004 . . . . 3.5499999999999998 111.193 169.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -157.63 153.81 27.38 Favored 'General case' 0 C--O 1.251 1.149 0 C-N-CA 125.866 1.667 . . . . 3.4900000000000002 111.952 170.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.66 -136.35 36.89 Favored Glycine 0 C--N 1.335 0.528 0 C-N-CA 125.559 1.552 . . . . 2.79 112.014 168.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 11.4 m -58.02 128.42 37.0 Favored 'General case' 0 C--O 1.246 0.915 0 O-C-N 122.292 -0.534 . . . . 3.0 111.181 174.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -76.46 111.79 12.3 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 126.134 1.773 . . . . 7.6799999999999997 107.315 148.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 35.4 tp 141.72 -41.69 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 130.038 3.335 . . . . 3.9700000000000002 106.925 -161.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 71.0 p -121.6 141.71 50.83 Favored 'General case' 0 C--O 1.255 1.36 0 CA-C-O 123.22 1.486 . . . . 1.53 112.903 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 22.0 mt -93.72 95.98 9.51 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 111.83 -2.441 . . . . 1.75 107.267 157.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 6.6 m -65.58 155.97 34.15 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 120.721 -1.237 . . . . 2.3399999999999999 110.441 169.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 25.2 ttt180 -41.54 -29.1 0.15 Allowed 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 117.43 2.381 . . . . 4.2400000000000002 117.43 -174.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -85.88 -38.04 18.49 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 115.229 1.566 . . . . 4.5800000000000001 115.229 172.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -56.78 -48.53 77.7 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.049 0.94 . . . . 1.77 108.918 167.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 14.4 tp -63.52 -43.9 95.83 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.055 0.942 . . . . 1.8999999999999999 111.899 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . 0.544 ' HE2' HG21 ' B' ' 52' ' ' ILE . 23.4 ttmt -56.5 -47.17 79.88 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 119.268 -0.396 . . . . 3.0800000000000001 111.738 179.084 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.438 ' HG2' ' CE ' ' B' ' 40' ' ' LYS . 33.8 tt0 -59.61 -44.2 93.49 Favored 'General case' 0 CA--C 1.553 1.08 0 N-CA-C 113.452 0.908 . . . . 3.3500000000000001 113.452 174.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 31.3 tp -61.18 -55.67 29.61 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.812 1.245 . . . . 1.9099999999999999 111.186 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 19.7 mt -59.07 -52.57 59.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 108.889 -0.782 . . . . 1.0600000000000001 108.889 -178.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.3 -27.15 67.07 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 113.937 1.088 . . . . 5.79 113.937 -173.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . 0.438 ' CE ' ' HG2' ' B' ' 36' ' ' GLU . 35.9 mtmt -85.49 -53.81 4.96 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 120.093 1.315 . . . . 3.9100000000000001 114.516 170.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -72.73 -31.21 64.8 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 118.245 0.475 . . . . 4.79 110.937 -171.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -110.27 72.56 0.8 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.078 1.351 . . . . 2.4300000000000002 108.911 161.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.7 t -71.39 61.81 0.34 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.971 1.308 . . . . 3.5899999999999999 112.306 174.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.25 166.84 11.21 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 127.337 2.255 . . . . 4.4400000000000004 112.402 -173.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -85.9 -72.64 1.29 Allowed Glycine 0 C--N 1.338 0.649 0 C-N-CA 125.291 1.424 . . . . 3.5800000000000001 109.676 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . 0.519 ' H ' ' CD ' ' B' ' 46' ' ' GLU . 1.2 pm0 -40.27 -30.61 0.11 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 128.831 2.852 . . . . 6.0499999999999998 115.258 164.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -72.99 53.37 0.35 Allowed 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.792 -1.193 . . . . 2.3999999999999999 111.431 163.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.465 ' HA ' ' HE2' ' B' ' 48' ' ' LYS . 2.7 mmpt? -59.09 159.81 6.91 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 123.157 1.456 . . . . 5.3200000000000003 111.443 172.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -76.87 -8.52 57.5 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.381 -0.825 . . . . 6.1299999999999999 113.103 -156.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 12.3 t -102.6 -14.76 16.62 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.022 1.729 . . . . 3.1600000000000001 113.872 162.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 4.5 m -62.44 -28.48 69.84 Favored 'General case' 0 N--CA 1.482 1.157 0 CA-C-N 121.259 1.845 . . . . 2.6200000000000001 110.493 166.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . 0.544 HG21 ' HE2' ' B' ' 35' ' ' LYS . 14.0 mm -52.36 -37.24 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 126.461 1.904 . . . . 1.3100000000000001 113.253 165.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -82.92 -27.22 30.75 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.164 0.985 . . . . 3.7200000000000002 112.592 -173.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.76 -46.94 67.49 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 118.428 -0.796 . . . . 2.5 110.461 161.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -54.56 -49.04 71.3 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.407 1.083 . . . . 2.46 110.558 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.42 -48.89 79.2 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.982 0.913 . . . . 1.9099999999999999 111.765 174.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -18.58 62.13 Favored 'General case' 0 CA--C 1.555 1.144 0 N-CA-C 114.634 1.346 . . . . 3.4700000000000002 114.634 172.123 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.9 m -94.13 -29.79 14.97 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.41 1.884 . . . . 2.7999999999999998 112.483 -179.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 96.2 mt -74.91 -49.14 21.3 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.475 1.11 . . . . 2.1499999999999999 111.082 165.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -82.84 63.92 7.19 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 125.998 1.719 . . . . 2.3100000000000001 111.643 -172.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 27.7 mttm -56.09 -20.47 17.35 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.084 1.754 . . . . 4.04 112.194 175.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -72.42 -32.58 66.46 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.511 1.924 . . . . 2.1600000000000001 113.877 174.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 21.2 t 62.93 29.38 16.51 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.675 1.19 . . . . 3.04 113.227 -161.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 10.0 p30 -86.44 -14.53 43.0 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.4 1.48 . . . . 2.1699999999999999 112.462 -177.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 69.46 2.06 3.58 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 128.979 2.911 . . . . 5.0300000000000002 116.923 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -100.53 147.34 26.03 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 127.783 2.433 . . . . 2.8300000000000001 110.923 167.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 43.3 mm -106.4 103.52 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 108.128 -1.064 . . . . 1.1200000000000001 108.128 160.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.26 165.51 23.51 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.578 1.551 . . . . 2.5 110.738 165.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -52.59 -26.21 12.78 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 115.222 1.564 . . . . 2.2400000000000002 115.222 -175.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.3 -43.84 16.99 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 120.649 -1.282 . . . . 3.3700000000000001 111.647 177.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -55.92 -35.53 66.71 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.29 1.036 . . . . 2.3100000000000001 110.133 169.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -76.87 -38.55 53.45 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.365 1.866 . . . . 3.3199999999999998 113.498 176.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 51.9 p -73.05 -34.61 66.39 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 119.767 -1.833 . . . . 1.8600000000000001 111.72 176.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.8 p -69.28 -29.81 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.143 0.883 . . . . 2.46 112.352 172.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . 0.568 ' CZ ' HD11 ' B' ' 79' ' ' LEU . 15.8 t80 -59.06 -57.79 11.5 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.179 -0.951 . . . . 1.7 111.382 166.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 96.6 mt -62.03 -29.47 70.3 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.462 0.705 . . . . 1.8899999999999999 112.321 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 45.5 m -63.37 -53.34 53.99 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.856 1.262 . . . . 1.46 111.622 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 74.1 mtm -59.41 -39.74 84.44 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 119.173 0.897 . . . . 2.0499999999999998 111.471 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.568 HD11 ' CZ ' ' B' ' 75' ' ' PHE . 95.8 mt -61.83 -56.43 19.54 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.12 0.568 . . . . 2.02 111.608 173.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 5.1 t -60.3 -32.45 71.22 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.218 0.917 . . . . 1.6599999999999999 112.592 -177.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 76.9 mtp -71.63 -33.15 68.7 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.841 1.052 . . . . 2.46 113.841 170.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.19 -35.51 81.03 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 120.535 1.516 . . . . 1.0900000000000001 112.391 172.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -64.25 -19.6 65.49 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.215 -0.928 . . . . 2.8100000000000001 112.947 171.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.72 -45.21 79.45 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.771 1.169 . . . . 1.8899999999999999 112.063 170.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.88 -46.3 78.87 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.565 1.146 . . . . 3.8500000000000001 110.244 177.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -53.08 -47.38 68.56 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.942 1.697 . . . . 2.73 112.19 175.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -61.15 -27.74 68.61 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.476 1.51 . . . . 2.3399999999999999 113.163 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 43.8 mt -79.38 -13.57 59.53 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.208 1.003 . . . . 1.98 112.949 178.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . 0.419 ' OE2' ' HE2' ' B' ' 92' ' ' LYS . 44.7 mm-40 -108.21 8.53 27.95 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.161 1.785 . . . . 3.6499999999999999 113.081 168.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -107.03 -54.77 2.42 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.849 1.259 . . . . 3.6800000000000002 112.145 174.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.28 31.75 0.51 Allowed 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 124.904 1.282 . . . . 3.0600000000000001 112.678 176.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . 0.419 ' HE2' ' OE2' ' B' ' 89' ' ' GLU . 2.1 ptmm? . . . . . 0 C--O 1.257 1.469 0 N-CA-C 117.314 2.338 . . . . 4.5599999999999996 117.314 -157.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 . . . . . 0 N--CA 1.461 0.101 0 N-CA-C 113.267 0.84 . . . . 5.4900000000000002 113.267 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 44.2 p -111.62 160.02 31.08 Favored Pre-proline 0 N--CA 1.468 0.474 0 CA-C-N 116.002 -0.545 . . . . 1.3799999999999999 111.845 -156.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -59.37 -21.22 59.94 Favored 'Trans proline' 0 CA--C 1.536 0.588 0 C-N-CA 121.771 1.648 . . . . 1.23 111.63 166.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.79 -49.9 14.78 Favored 'General case' 0 C--N 1.344 0.361 0 CA-C-O 118.333 -0.842 . . . . 2.4300000000000002 110.525 174.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -62.93 -33.02 74.47 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 120.792 1.633 . . . . 3.4700000000000002 111.875 176.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -67.92 -25.12 65.32 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.665 -1.272 . . . . 4.25 113.04 172.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.49 -44.53 34.99 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.827 0.851 . . . . 0.96999999999999997 111.936 172.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.7 mt -64.13 -40.53 96.37 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 121.107 -0.996 . . . . 1.48 111.962 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.6 p -61.97 -45.16 94.87 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 117.511 -1.233 . . . . 2.4700000000000002 111.162 171.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 54.3 m -53.91 -38.22 64.6 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 119.16 0.891 . . . . 1.29 111.54 173.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.1 tpp -56.3 -48.46 76.62 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 118.766 -0.635 . . . . 3.25 111.89 175.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.7 m -72.27 -29.53 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 119.462 1.028 . . . . 2.2200000000000002 112.67 175.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.8 m -57.43 -57.87 10.77 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.827 1.194 . . . . 0.93999999999999995 111.472 175.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.92 -24.51 58.52 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.62 0.768 . . . . 2.6600000000000001 110.311 -178.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -65.33 -59.23 4.26 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-O 117.982 -1.008 . . . . 2.0699999999999998 111.535 170.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 63.2 m-70 -58.78 -42.23 88.51 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 120.782 1.628 . . . . 3.1800000000000002 112.656 -175.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.5 tttt -39.55 -53.71 2.06 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.246 2.218 . . . . 5.7300000000000004 113.937 168.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -95.95 -29.47 14.14 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.31 1.226 . . . . 2.5099999999999998 114.31 -178.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.8 t -73.43 -34.12 65.28 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 127.073 2.149 . . . . 2.0 113.181 -177.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -73.57 -22.04 78.86 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 124.319 0.961 . . . . 2.04 112.338 170.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -86.21 68.74 10.36 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.188 1.395 . . . . 5.0199999999999996 110.206 -177.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.493 ' HG2' ' H ' ' A' ' 24' ' ' GLY . 8.8 tt0 102.78 -176.76 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 129.638 3.175 . . . . 3.9900000000000002 111.588 173.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.493 ' H ' ' HG2' ' A' ' 23' ' ' GLU . . . 57.93 -145.12 40.87 Favored Glycine 0 N--CA 1.47 0.926 0 C-N-CA 124.895 1.236 . . . . 2.0899999999999999 110.7 -170.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -79.51 169.49 17.96 Favored 'General case' 0 CA--C 1.553 1.066 0 O-C-N 121.504 -0.998 . . . . 2.4900000000000002 111.054 153.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.5 ptpp? -94.66 -5.65 45.11 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.66 1.584 . . . . 5.5499999999999998 115.161 -173.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 25.8 tp -100.96 4.54 42.6 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.609 1.564 . . . . 3.5800000000000001 111.012 169.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 55.0 p -142.6 144.94 33.06 Favored 'General case' 0 C--O 1.246 0.911 0 C-N-CA 125.991 1.717 . . . . 0.92000000000000004 112.397 -165.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 26.1 tp -113.72 88.12 2.77 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.787 1.635 . . . . 2.8199999999999998 108.891 -172.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -59.93 160.98 7.07 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.531 1.533 . . . . 2.0 114.922 -176.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.59 -20.32 1.16 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 128.374 2.669 . . . . 3.21 114.744 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.81 -26.09 13.89 Favored 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 119.98 1.264 . . . . 3.6899999999999999 113.629 167.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -66.16 -53.7 34.41 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.499 1.045 . . . . 1.6799999999999999 109.348 175.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 35.6 tp -50.82 -44.54 59.22 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.712 2.005 . . . . 2.0299999999999998 113.363 -176.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tmpt? -56.17 -34.99 66.72 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.137 1.375 . . . . 5.4000000000000004 113.012 -177.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -99.77 13.53 33.38 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.951 1.3 . . . . 4.3200000000000003 114.32 177.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.9 tp -96.69 -56.04 2.71 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.096 0.862 . . . . 2.6800000000000002 110.296 152.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 23.5 mt -60.46 -61.97 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 119.194 0.906 . . . . 0.93000000000000005 110.161 -168.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -68.31 -11.05 58.86 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.354 1.062 . . . . 4.54 111.982 -177.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.64 -42.12 29.58 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.741 1.616 . . . . 4.9900000000000002 111.303 173.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -103.28 -72.53 0.69 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.956 0.902 . . . . 6.9500000000000002 109.283 -178.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.1 mt -72.91 22.61 0.06 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 128.637 2.775 . . . . 3.6899999999999999 114.84 -171.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 26.6 p -51.8 -35.7 45.03 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.637 1.975 . . . . 3.5899999999999999 115.151 -175.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -62.03 -19.59 63.04 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.301 1.84 . . . . 4.29 114.941 -173.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -78.58 25.25 2.47 Favored Glycine 0 CA--C 1.532 1.12 0 CA-C-O 118.869 -0.962 . . . . 5.0199999999999996 113.308 172.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 56.93 20.33 5.24 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 126.54 1.936 . . . . 5.46 113.004 -170.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.4 ttm -82.21 37.88 0.52 Allowed 'General case' 0 N--CA 1.471 0.609 0 O-C-N 120.521 -1.362 . . . . 2.5099999999999998 113.151 -174.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.9 pttt -73.27 162.88 28.86 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.147 1.379 . . . . 4.8799999999999999 111.714 170.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -25.44 -60.8 0.07 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 128.677 2.791 . . . . 5.1500000000000004 116.39 -162.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.2 t -70.86 -10.11 58.95 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 115.029 1.492 . . . . 3.1699999999999999 115.029 -173.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.3 t -84.13 -13.83 51.91 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.593 1.157 . . . . 2.2000000000000002 112.594 168.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 12.3 mm -79.64 -32.59 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 O-C-N 120.212 -1.555 . . . . 1.5800000000000001 112.794 -173.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.18 -44.03 85.15 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.854 0.862 . . . . 3.0600000000000001 111.736 -175.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -72.12 -38.44 69.27 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 122.77 0.428 . . . . 2.3900000000000001 111.387 176.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.98 -49.18 78.68 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 118.679 -0.677 . . . . 2.52 110.134 174.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.42 -44.44 89.07 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.396 1.478 . . . . 1.8700000000000001 111.753 177.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -55.93 -30.82 62.25 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.033 0.933 . . . . 4.0800000000000001 112.751 172.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.65 -23.57 42.46 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.52 1.128 . . . . 1.6899999999999999 113.181 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.5 mt -89.19 -34.14 16.78 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 114.866 1.432 . . . . 1.9099999999999999 114.866 -173.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -82.07 154.65 25.49 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 120.787 1.631 . . . . 1.74 112.582 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -127.84 10.65 6.55 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.067 1.747 . . . . 3.5600000000000001 113.137 175.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -121.69 -33.28 3.63 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.699 1.2 . . . . 2.4300000000000002 114.151 -165.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.5 t 76.66 23.07 1.1 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.938 2.495 . . . . 3.96 112.602 -167.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.9 p30 -76.91 -24.57 52.48 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.833 1.653 . . . . 2.3799999999999999 111.59 177.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 67.39 19.82 10.04 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 128.652 2.781 . . . . 4.3099999999999996 113.784 -166.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . 0.432 25.9 pt-20 -132.61 132.36 42.41 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 126.207 2.908 . . . . 2.1099999999999999 115.978 167.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 20.1 mm -74.59 107.31 5.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-N 112.072 -2.331 . . . . 1.0900000000000001 106.868 177.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -62.15 152.57 32.68 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.478 -1.237 . . . . 4.5099999999999998 108.899 172.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -58.38 -25.88 62.56 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 120.652 -1.28 . . . . 2.1499999999999999 113.371 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -69.69 -34.65 74.22 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.1 0.96 . . . . 3.9700000000000002 113.403 171.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -79.22 -36.91 39.33 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.318 1.447 . . . . 1.8799999999999999 110.229 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -53.69 -35.71 61.4 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.012 1.325 . . . . 2.04 112.201 174.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.9 m -56.03 -30.09 61.36 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 120.799 -1.188 . . . . 2.0699999999999998 113.458 170.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.5 t -71.37 -35.92 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.924 0.889 . . . . 2.1600000000000001 110.565 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -59.95 -50.29 74.32 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.75 0.82 . . . . 1.75 111.925 176.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.03 -49.98 74.14 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.28 0.632 . . . . 2.7000000000000002 110.544 175.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.9 m -52.9 -52.65 56.88 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.302 1.441 . . . . 0.69999999999999996 112.091 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 40.4 mtp -55.41 -48.27 74.65 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.388 1.075 . . . . 1.9099999999999999 112.284 178.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.3 mt -66.6 -43.28 85.24 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.461 0.704 . . . . 1.47 111.721 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 68.6 m -60.73 -33.72 73.34 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 118.293 -0.86 . . . . 1.8100000000000001 113.013 173.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 89.9 mtp -68.11 -34.97 77.38 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.627 1.103 . . . . 1.9199999999999999 112.481 172.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.47 -43.85 84.34 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 119.645 1.111 . . . . 1.21 111.818 170.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -64.49 -24.03 67.48 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.555 0.946 . . . . 2.2999999999999998 113.555 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -67.41 -44.71 78.12 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.309 0.959 . . . . 2.7000000000000002 112.333 174.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -70.67 -46.01 63.99 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.584 1.554 . . . . 2.7799999999999998 111.393 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -51.55 -50.07 60.78 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.998 1.719 . . . . 2.1099999999999999 110.763 174.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -60.09 -29.02 68.31 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.197 1.399 . . . . 2.3700000000000001 112.906 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.8 mt -76.59 -15.47 59.84 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 118.207 -0.902 . . . . 1.52 113.12 178.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -104.31 -20.32 13.8 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 114.849 1.425 . . . . 3.0099999999999998 114.849 172.154 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 7.3 t70 . . . . . 0 N--CA 1.472 0.644 0 C-N-CA 126.973 2.109 . . . . 3.6200000000000001 113.45 -171.998 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.9 p . . . . . 0 C--O 1.238 0.488 0 CA-C-O 120.624 0.25 . . . . 1.9399999999999999 110.405 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -62.64 -20.85 72.05 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 121.784 1.656 . . . . 1.54 111.943 167.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -76.47 -50.89 12.9 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.262 0.937 . . . . 2.6499999999999999 111.143 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -52.89 -45.81 67.69 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 122.327 1.06 . . . . 4.5099999999999998 110.398 169.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 13.8 ttpt -63.0 -25.12 68.24 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.594 0.961 . . . . 5.1600000000000001 113.594 176.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.6 -49.8 43.9 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.938 1.245 . . . . 1.3 110.953 177.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 6.4 mp -61.65 -39.16 90.35 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.81 0.844 . . . . 2.6099999999999999 111.263 174.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 58.9 m -59.18 -50.76 72.79 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.412 1.485 . . . . 1.24 110.954 174.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 89.1 m -61.43 -36.31 80.01 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.218 1.407 . . . . 1.3400000000000001 110.706 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 1.6 ttp -56.24 -59.22 5.26 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.608 1.163 . . . . 3.77 111.82 167.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 78.2 t -60.89 -31.79 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 CA-C-N 120.828 1.649 . . . . 1.9399999999999999 112.684 178.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 87.4 m -72.0 -49.87 33.46 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.337 1.455 . . . . 0.83999999999999997 111.895 -176.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 7.4 p -62.8 -38.09 89.32 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 118.377 -0.82 . . . . 1.8799999999999999 109.302 169.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -58.3 -57.77 11.42 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 118.936 -0.554 . . . . 2.2000000000000002 110.74 -176.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -63.2 -36.67 84.42 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.582 1.083 . . . . 2.1600000000000001 112.599 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -76.77 -24.08 52.91 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.506 1.299 . . . . 5.0599999999999996 114.506 -176.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -91.34 -37.88 12.97 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 120.024 1.284 . . . . 2.0299999999999998 112.167 166.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 34.3 t -65.09 -28.64 69.59 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.416 -1.428 . . . . 1.8100000000000001 112.53 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.2 6.92 82.49 Favored Glycine 0 CA--C 1.534 1.252 0 C-N-CA 125.615 1.579 . . . . 1.3600000000000001 114.828 176.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 45.7 mmt-85 -57.57 -41.98 82.18 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 119.455 1.627 . . . . 5.1900000000000004 111.76 170.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -145.12 136.93 25.56 Favored 'General case' 0 C--O 1.256 1.418 0 C-N-CA 126.568 1.947 . . . . 4.2199999999999998 111.405 178.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.03 -118.45 6.56 Favored Glycine 0 C--N 1.34 0.802 0 C-N-CA 127.479 2.466 . . . . 2.6099999999999999 113.148 162.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.5 m -47.72 122.45 4.92 Favored 'General case' 0 C--O 1.246 0.878 0 C-N-CA 125.093 1.357 . . . . 3.48 112.057 170.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 15.1 pttm -106.64 4.14 27.61 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.023 1.729 . . . . 7.2699999999999996 114.811 -178.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.493 ' H ' HD23 ' B' ' 27' ' ' LEU . 1.6 pt? -102.19 -2.09 29.97 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.589 1.555 . . . . 3.9700000000000002 113.011 169.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . 0.438 HG22 ' HA ' ' B' ' 68' ' ' ASP . 7.7 p -137.89 147.02 44.06 Favored 'General case' 0 C--O 1.244 0.812 0 C-N-CA 128.677 2.791 . . . . 1.3600000000000001 111.539 -173.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -96.64 107.94 20.47 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.505 0.722 . . . . 2.4199999999999999 109.936 166.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.75 145.01 55.14 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.144 -0.687 . . . . 2.71 109.144 167.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 5.9 ttt-85 -41.69 -40.54 2.0 Allowed 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.654 1.581 . . . . 3.77 114.748 -173.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.427 ' HG2' ' H ' ' B' ' 33' ' ' GLU . 2.9 ptmt -61.07 -43.56 98.7 Favored 'General case' 0 CA--C 1.555 1.148 0 N-CA-C 115.247 1.573 . . . . 4.9699999999999998 115.247 173.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.427 ' H ' ' HG2' ' B' ' 32' ' ' LYS . 17.8 mt-10 -65.13 -49.6 69.3 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 127.58 2.352 . . . . 1.6299999999999999 107.697 176.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -55.04 -49.37 71.76 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.103 1.361 . . . . 2.3500000000000001 111.214 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -13.91 61.95 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 114.904 1.446 . . . . 4.7599999999999998 114.904 -175.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -84.21 -40.84 17.6 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 112.475 0.546 . . . . 3.1800000000000002 112.475 169.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 tt -50.9 -57.93 7.26 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.04 1.336 . . . . 1.8899999999999999 110.498 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 24.2 mt -59.1 -48.16 87.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 123.994 0.918 . . . . 1.1799999999999999 110.038 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.464 ' HZ3' ' CD ' ' B' ' 46' ' ' GLU . 16.4 tppt? -57.67 -21.51 40.56 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.966 1.306 . . . . 3.8300000000000001 112.986 -175.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 mttm -98.74 -42.62 7.13 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 114.32 1.23 . . . . 3.4199999999999999 114.32 165.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -50.83 -48.75 59.82 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 126.348 1.859 . . . . 5.0999999999999996 112.191 -177.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 73.1 mt -125.17 120.22 30.73 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.291 1.437 . . . . 2.54 109.213 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 44.2 t -84.21 -76.0 0.32 Allowed 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 107.733 -1.21 . . . . 4.4199999999999999 107.733 160.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 76.6 mt 52.68 -105.14 0.22 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.468 1.107 . . . . 3.3300000000000001 111.531 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -102.05 7.22 54.6 Favored Glycine 0 N--CA 1.484 1.851 0 C-N-CA 125.537 1.541 . . . . 3.1600000000000001 114.828 172.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . 0.464 ' CD ' ' HZ3' ' B' ' 39' ' ' LYS . 0.7 OUTLIER 70.34 110.95 0.06 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 130.965 3.706 . . . . 8.4299999999999997 109.736 -170.942 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 84.6 mmm -58.73 -38.87 79.3 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.497 1.295 . . . . 2.8300000000000001 114.497 -174.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.412 ' HB2' ' HZ3' ' B' ' 48' ' ' LYS . 1.4 ttpm? 71.16 141.27 0.05 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.481 1.912 . . . . 3.8399999999999999 114.428 157.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -58.57 -31.47 68.03 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 119.922 -1.736 . . . . 3.73 112.043 -172.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 22.7 t -70.18 1.46 4.74 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 115.409 1.633 . . . . 3.3399999999999999 115.409 173.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 2.7 p -124.71 -41.62 2.12 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.259 0.936 . . . . 2.2599999999999998 111.959 157.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 84.6 mt -54.22 -41.91 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 124.434 1.094 . . . . 1.5 112.696 -176.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -63.53 -34.54 78.01 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 119.429 1.013 . . . . 3.2000000000000002 111.733 -173.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -93.82 -35.13 12.88 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.878 1.671 . . . . 4.6900000000000004 113.585 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 7.1 tt -53.37 -42.4 66.83 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.702 1.201 . . . . 2.6499999999999999 110.146 169.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.7 -48.42 72.48 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.639 1.576 . . . . 1.6399999999999999 111.44 171.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 13.4 mttm -59.73 -37.32 78.63 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 119.527 1.058 . . . . 7.0300000000000002 111.641 173.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 5.0 t -65.66 -22.62 66.66 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.018 0.927 . . . . 1.95 113.154 175.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 29.0 mt -77.64 -42.96 32.98 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.981 0.913 . . . . 2.0600000000000001 110.845 168.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -76.2 78.57 3.0 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.886 2.474 . . . . 1.8100000000000001 114.527 -162.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 65.6 mmtt -61.15 -13.1 15.21 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 115.505 1.669 . . . . 3.75 115.505 -170.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -120.05 2.62 10.96 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.862 1.43 . . . . 2.3399999999999999 114.862 176.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 23.0 t 62.96 18.94 11.28 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.702 1.371 . . . . 2.5699999999999998 114.702 172.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 47.5 p-10 -79.7 -11.29 59.86 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.924 1.689 . . . . 2.1400000000000001 112.337 -177.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 67.43 16.98 10.09 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 130.565 3.546 . . . . 4.8700000000000001 113.613 -175.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -111.51 141.5 45.0 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.653 1.981 . . . . 2.27 107.846 165.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 50.4 mm -108.33 102.59 14.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 O-C-N 120.152 -1.592 . . . . 1.25 107.791 172.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . 0.526 ' HB3' ' H ' ' B' ' 70' ' ' LYS . 88.9 m-20 -47.38 153.78 0.48 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.074 0.549 . . . . 3.3300000000000001 110.661 168.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -47.47 -25.8 1.19 Allowed 'General case' 0 CA--C 1.555 1.138 0 CA-C-O 121.839 0.828 . . . . 2.3100000000000001 112.75 158.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.526 ' H ' ' HB3' ' B' ' 68' ' ' ASP . 6.7 ttpm? -86.85 -25.31 24.58 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 129.108 2.963 . . . . 4.0300000000000002 114.952 176.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -80.81 -43.71 19.64 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 119.935 1.243 . . . . 1.8200000000000001 108.57 169.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -50.65 -31.32 15.87 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 129.812 3.245 . . . . 1.9299999999999999 115.659 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 30.9 t -53.23 -38.38 62.9 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.98 -1.075 . . . . 2.0299999999999998 112.124 171.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 57.4 t -67.24 -34.13 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 O-C-N 121.378 -0.826 . . . . 1.52 111.294 -177.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -59.76 -62.74 1.65 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 118.35 0.523 . . . . 1.8200000000000001 110.892 175.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 52.4 mt -62.31 -30.53 71.21 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.202 0.601 . . . . 1.8100000000000001 112.327 -176.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 91.1 m -58.32 -47.8 82.57 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.741 0.816 . . . . 0.81999999999999995 111.029 172.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 79.6 mtm -62.99 -38.21 90.26 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.017 0.826 . . . . 1.55 112.803 177.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 62.9 mt -61.28 -46.09 91.77 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.422 0.555 . . . . 1.55 110.503 173.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 97.1 m -60.84 -38.47 85.63 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.692 0.797 . . . . 1.8700000000000001 112.858 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 28.1 mmt -60.22 -41.41 93.02 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 118.854 0.752 . . . . 3.2799999999999998 111.941 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.91 -38.37 79.55 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.409 0.55 . . . . 0.87 112.054 177.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -71.84 -24.28 61.67 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.025 1.12 . . . . 3.1600000000000001 114.025 177.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -65.05 -46.13 82.51 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.509 0.724 . . . . 2.77 112.015 170.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.33 -44.49 91.38 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.58 1.552 . . . . 3.29 112.149 177.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -50.39 -48.96 55.71 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.025 1.73 . . . . 2.3500000000000001 111.734 177.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -64.83 -21.04 66.71 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.336 1.454 . . . . 2.5299999999999998 113.653 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 44.3 mt -84.24 -20.57 32.02 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.199 1.0 . . . . 1.6899999999999999 112.057 173.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -97.41 -10.15 26.02 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 115.074 1.509 . . . . 3.7599999999999998 115.074 174.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -88.36 -33.44 17.95 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.34 1.456 . . . . 2.8900000000000001 113.652 -177.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -80.05 -6.59 57.89 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 115.086 1.513 . . . . 5.25 115.086 -174.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 114.902 -2.475 . . . . 5.0499999999999998 117.469 -158.189 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 . . . . . 0 N--CA 1.432 -1.334 0 N-CA-C 106.982 -1.488 . . . . 4.0999999999999996 106.982 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.543 HG21 ' O ' ' B' ' 40' ' ' LYS . 70.6 p -49.03 149.38 3.37 Favored Pre-proline 0 N--CA 1.47 0.537 0 C-N-CA 125.989 1.716 . . . . 1.4199999999999999 111.467 178.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -64.68 -23.13 63.73 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.25 1.966 . . . . 1.28 111.939 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.29 -44.25 46.69 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.858 1.263 . . . . 2.3799999999999999 111.865 174.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -53.24 -53.05 56.37 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.998 1.272 . . . . 4.7000000000000002 110.083 174.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 33.9 mtmt -61.98 -21.11 64.56 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 113.186 0.81 . . . . 4.3700000000000001 113.186 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.54 -45.24 31.51 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.82 0.848 . . . . 0.90000000000000002 111.369 170.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.6 mt -58.23 -47.28 84.02 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.474 1.033 . . . . 1.54 110.832 173.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -66.81 -37.49 84.62 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 116.348 -1.787 . . . . 2.2999999999999998 112.462 175.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 42.1 m -55.65 -42.97 75.79 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 121.415 1.916 . . . . 1.29 110.875 170.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 57.5 mtp -63.88 -47.03 82.27 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.996 1.319 . . . . 3.1499999999999999 112.033 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.517 HG21 ' HB3' ' B' ' 83' ' ' TYR . 58.3 t -65.69 -31.65 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 O-C-N 121.075 -1.016 . . . . 2.25 111.531 175.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 93.3 m -67.42 -56.58 9.07 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.565 1.146 . . . . 1.01 110.617 -179.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.0 p -57.97 -42.54 85.26 Favored 'General case' 0 CA--C 1.512 -0.512 0 O-C-N 123.737 0.648 . . . . 2.3399999999999999 109.461 178.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -67.74 -55.29 13.67 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.779 0.674 . . . . 2.54 111.412 -176.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -65.48 -29.7 70.39 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.382 -0.824 . . . . 2.27 112.353 -177.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp -70.76 -57.08 5.02 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.33 0.968 . . . . 5.6799999999999997 112.493 171.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 -67.71 -23.25 65.25 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.623 1.101 . . . . 2.1600000000000001 113.135 -178.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.3 t -62.99 -19.77 64.65 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.402 1.26 . . . . 2.0800000000000001 114.402 172.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.04 33.55 6.35 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 126.709 2.099 . . . . 1.3600000000000001 113.428 171.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -114.05 28.92 8.39 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.821 1.648 . . . . 6.1900000000000004 112.57 173.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.408 ' HG2' ' H ' ' A' ' 24' ' ' GLY . 4.1 tt0 126.8 -159.83 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.091 1 C-N-CA 132.666 4.387 . . . . 4.3399999999999999 110.26 171.968 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.408 ' H ' ' HG2' ' A' ' 23' ' ' GLU . . . 51.26 -141.24 21.84 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 124.876 1.227 . . . . 2.21 111.622 -170.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.8 t -86.86 179.7 6.68 Favored 'General case' 0 C--O 1.249 1.04 0 CA-C-O 122.203 1.001 . . . . 2.3500000000000001 111.786 158.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -104.44 140.88 37.31 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.434 2.294 . . . . 4.5899999999999999 108.705 166.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 9.7 tp 90.72 -18.26 0.17 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 131.063 3.745 . . . . 3.6699999999999999 110.98 -159.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.6 p -112.45 152.94 28.12 Favored 'General case' 0 C--O 1.246 0.898 0 C-N-CA 125.745 1.618 . . . . 1.3 114.957 177.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.9 mt -107.58 105.83 15.91 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.177 1.391 . . . . 1.45 111.687 163.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.9 t -62.0 160.98 11.42 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.78 1.232 . . . . 2.0899999999999999 111.227 163.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.4 ttm-85 -46.56 -21.88 0.23 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 126.465 1.906 . . . . 3.4700000000000002 114.906 -178.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.88 -38.65 10.18 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.126 1.37 . . . . 3.9900000000000002 112.854 -178.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -61.11 -46.46 90.51 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.693 1.197 . . . . 1.4399999999999999 109.559 172.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.7 tp -66.38 -49.43 66.9 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.53 0.732 . . . . 1.9399999999999999 111.398 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.1 ttmt -61.66 -37.17 83.06 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 113.15 0.796 . . . . 3.4900000000000002 113.15 -177.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -57.63 -58.53 7.94 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.764 0.825 . . . . 3.75 112.317 164.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.4 tp -53.29 -54.67 33.01 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.744 1.217 . . . . 2.1699999999999999 112.909 -174.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.3 mt -60.17 -33.65 54.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 118.332 0.515 . . . . 1.0700000000000001 110.896 -174.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.497 ' HZ2' ' CD ' ' A' ' 46' ' ' GLU . 23.9 mmmt -67.52 -12.27 59.94 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 121.096 -1.002 . . . . 3.3900000000000001 113.138 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 59.3 mmtt -92.66 -19.65 21.64 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.12 1.368 . . . . 2.6200000000000001 111.757 173.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -91.69 -93.12 0.14 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.632 1.973 . . . . 4.3600000000000003 106.589 178.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -75.52 24.99 0.11 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 128.901 2.88 . . . . 2.5299999999999998 114.544 -161.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 18.4 t -54.81 -25.68 29.83 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.64 -1.287 . . . . 3.0699999999999998 113.237 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.11 -21.43 66.35 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.83 1.652 . . . . 4.2400000000000002 115.332 178.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -108.51 -28.28 4.64 Favored Glycine 0 N--CA 1.476 1.305 0 C-N-CA 124.752 1.168 . . . . 3.79 112.236 163.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.497 ' CD ' ' HZ2' ' A' ' 39' ' ' LYS . 0.2 OUTLIER 83.72 139.59 0.06 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 129.411 3.085 . . . . 7.9299999999999997 111.644 170.001 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.6 mmt -109.07 105.51 15.03 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.51 1.524 . . . . 2.8500000000000001 111.151 -173.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -89.91 164.18 14.68 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.146 1.378 . . . . 4.9900000000000002 110.891 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.25 -50.06 51.22 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 120.997 -1.064 . . . . 5.9100000000000001 111.41 167.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.1 t -72.23 41.13 0.08 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.438 1.495 . . . . 3.6699999999999999 113.136 168.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.0 m -160.29 -41.42 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.884 1.674 . . . . 2.3199999999999998 112.66 177.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 33.8 mt -72.3 -38.73 62.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 119.367 0.985 . . . . 2.2999999999999998 112.086 -174.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -80.56 -23.1 40.18 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.757 0.823 . . . . 3.8100000000000001 112.016 -175.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -78.62 -38.99 38.51 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.283 0.633 . . . . 2.7000000000000002 111.673 165.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.79 -44.97 86.65 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.601 -0.714 . . . . 2.6800000000000002 109.509 169.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.2 ttt -58.94 -41.97 88.65 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.306 0.957 . . . . 1.53 112.039 173.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.98 -24.63 67.79 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 119.363 0.983 . . . . 4.2699999999999996 112.77 172.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 t -74.06 -33.18 63.61 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 120.48 -1.388 . . . . 2.3199999999999998 112.37 170.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.7 mp -80.75 -51.75 8.3 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 125.111 1.365 . . . . 2.73 112.816 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -72.69 135.55 45.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.753 0.787 . . . . 1.72 111.886 -178.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.51 -40.45 5.11 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.568 1.547 . . . . 3.5 111.939 178.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 43.4 p-10 -92.93 -11.16 34.06 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 116.389 1.996 . . . . 2.5499999999999998 116.389 -169.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.7 t 76.02 29.96 0.75 Allowed 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.881 1.672 . . . . 3.02 113.556 174.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.9 p-10 -90.31 -14.28 33.51 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 126.578 1.951 . . . . 2.3500000000000001 112.691 -176.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 76.27 13.08 2.61 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 128.71 2.804 . . . . 4.3099999999999996 115.674 -174.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -133.91 132.08 39.84 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.557 2.343 . . . . 2.8199999999999998 109.355 -176.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 18.1 mm -98.99 107.84 21.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 120.572 -1.33 . . . . 1.1599999999999999 109.979 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -63.59 161.53 14.55 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.97 0.805 . . . . 3.8100000000000001 112.782 170.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -48.78 -37.39 18.98 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 122.519 1.152 . . . . 2.48 112.21 169.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.17 -22.84 48.06 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 116.181 1.919 . . . . 6.71 116.181 174.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -78.91 -51.12 10.11 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.398 1.454 . . . . 1.8799999999999999 109.07 170.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -50.25 -22.58 1.81 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 128.055 2.542 . . . . 1.8799999999999999 113.418 175.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.3 m -53.59 -32.51 51.34 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.58 -1.325 . . . . 2.6200000000000001 113.309 170.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 p -75.46 -25.79 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 122.967 0.507 . . . . 2.1400000000000001 111.856 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -63.36 -60.65 3.1 Favored 'General case' 0 C--N 1.343 0.299 0 CA-C-O 118.426 -0.797 . . . . 1.9299999999999999 109.968 172.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -51.93 -46.65 64.76 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.999 0.92 . . . . 2.7799999999999998 111.328 -178.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 56.3 m -55.06 -58.81 6.12 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.906 1.282 . . . . 1.0900000000000001 112.239 176.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 61.0 ttp -59.07 -43.82 91.81 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.633 0.773 . . . . 2.3999999999999999 111.217 -178.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.22 -46.59 80.01 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.535 1.134 . . . . 2.6699999999999999 111.647 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 67.8 m -63.92 -40.92 97.58 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.157 0.583 . . . . 1.8700000000000001 112.307 176.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 59.5 mtp -62.88 -39.33 94.12 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.631 0.65 . . . . 1.8600000000000001 112.029 172.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.01 -37.04 86.31 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.373 0.669 . . . . 1.22 112.554 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -64.03 -28.03 69.52 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.847 1.054 . . . . 2.3199999999999998 113.847 173.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -65.86 -40.5 91.73 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 120.167 1.349 . . . . 2.2400000000000002 111.971 172.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -72.7 -39.52 66.92 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.687 0.795 . . . . 3.2999999999999998 111.697 178.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -52.78 -46.16 67.46 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.037 1.335 . . . . 3.8700000000000001 111.298 172.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -62.97 -27.25 69.27 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.488 1.515 . . . . 2.9399999999999999 113.228 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 37.5 mt -80.96 -21.43 40.38 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.543 1.137 . . . . 3.0699999999999998 112.452 176.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -91.12 -10.24 42.66 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 115.142 1.534 . . . . 3.77 115.142 172.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.9 t70 . . . . . 0 N--CA 1.47 0.566 0 C-N-CA 125.737 1.615 . . . . 3.7799999999999998 112.719 169.344 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . 0.413 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 6.4 p . . . . . 0 C--O 1.237 0.417 0 CA-C-O 119.09 -0.481 . . . . 2.8799999999999999 110.26 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . 0.413 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 42.1 Cg_endo -69.83 -33.14 16.93 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 121.215 1.277 . . . . 1.8799999999999999 112.907 -172.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.01 -39.88 68.88 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.085 0.857 . . . . 2.5699999999999998 112.222 -172.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.93 -33.78 67.34 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.595 1.089 . . . . 4.1100000000000003 112.279 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -68.51 -32.28 72.13 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 120.678 -1.264 . . . . 4.7699999999999996 112.522 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -69.04 -51.58 37.55 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.421 1.088 . . . . 0.89000000000000001 110.201 175.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 57.5 mt -54.28 -46.19 72.66 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.584 1.154 . . . . 1.9199999999999999 111.769 174.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 64.4 m -56.65 -52.39 65.08 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.04 0.936 . . . . 1.28 111.181 172.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 51.7 m -55.49 -44.23 76.33 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.659 1.184 . . . . 1.22 111.471 -175.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 9.7 mtt -57.68 -51.77 68.18 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.062 0.945 . . . . 3.27 111.731 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 76.3 t -64.29 -43.59 97.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 124.204 1.001 . . . . 2.0 112.067 178.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 31.3 m -55.6 -58.04 9.44 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.787 1.635 . . . . 1.21 110.248 178.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . 0.403 ' HG1' ' HE2' ' B' ' 19' ' ' TYR . 0.7 OUTLIER -70.48 -37.85 74.29 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 117.406 -1.283 . . . . 2.6800000000000002 109.571 -174.747 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -57.34 -48.0 80.11 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 118.945 0.793 . . . . 2.1499999999999999 111.003 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.12 -31.97 71.92 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 118.684 0.674 . . . . 2.8300000000000001 111.337 178.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 39.0 tttm -69.74 -32.67 71.34 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.304 1.224 . . . . 4.6200000000000001 114.304 173.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.403 ' HE2' ' HG1' ' B' ' 15' ' ' THR . 69.5 m-85 -71.52 -31.55 67.19 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.763 1.225 . . . . 3.3999999999999999 111.569 166.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 40.3 t -70.82 -35.16 72.37 Favored 'General case' 0 C--O 1.244 0.785 0 C-N-CA 125.793 1.637 . . . . 1.97 114.86 -176.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.17 7.41 67.47 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 125.375 1.464 . . . . 2.2000000000000002 113.774 167.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.43 -14.9 59.6 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.224 1.512 . . . . 3.8700000000000001 113.496 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . 0.563 ' HG2' ' H ' ' B' ' 24' ' ' GLY 0.281 3.5 tm-20 164.0 -167.46 0.01 OUTLIER 'General case' 0 CA--C 1.564 1.502 0 C-N-CA 130.666 3.586 . . . . 3.46 109.712 -176.868 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . 0.563 ' H ' ' HG2' ' B' ' 23' ' ' GLU . . . 58.47 -149.07 36.8 Favored Glycine 0 N--CA 1.467 0.751 0 C-N-CA 126.17 1.843 . . . . 3.1200000000000001 112.316 -174.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 41.4 t -66.92 154.73 40.32 Favored 'General case' 0 C--O 1.249 1.071 0 O-C-N 121.27 -1.135 . . . . 2.98 110.274 153.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.0 1.09 37.19 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.415 1.486 . . . . 6.2800000000000002 112.67 177.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 57.8 tp -92.61 -30.11 15.78 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.365 1.466 . . . . 3.6400000000000001 112.239 174.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 16.6 p -128.32 167.38 17.02 Favored 'General case' 0 C--O 1.252 1.202 0 C-N-CA 128.703 2.801 . . . . 1.48 113.679 -163.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 10.5 mt -101.35 114.03 27.64 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.07 1.748 . . . . 1.5700000000000001 110.972 167.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 2.0 p -69.58 165.58 20.79 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.138 -0.976 . . . . 2.9300000000000002 112.935 166.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -41.8 -30.4 0.25 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.905 1.282 . . . . 3.8900000000000001 114.271 169.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.1 -42.96 10.8 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 119.92 -1.738 . . . . 6.1500000000000004 113.082 178.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -52.65 -44.17 65.96 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.621 0.769 . . . . 1.8899999999999999 110.663 167.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.93 -42.99 97.22 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.427 1.891 . . . . 2.3300000000000001 112.404 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -56.45 -40.94 75.64 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 120.274 -1.516 . . . . 3.02 112.457 170.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -68.28 -43.53 77.53 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 117.974 -1.012 . . . . 3.1400000000000001 112.127 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.0 tp -51.41 -61.22 2.38 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 125.294 1.438 . . . . 2.4199999999999999 108.665 173.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 24.5 mt -54.3 -45.23 67.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 CA-C-N 118.739 0.7 . . . . 1.25 109.85 -173.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -72.65 -31.72 65.32 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.223 0.609 . . . . 4.9400000000000004 111.751 -172.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . 0.543 ' O ' HG21 ' A' ' 3' ' ' THR . 36.6 mttp -89.25 -28.16 20.11 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 120.624 -1.298 . . . . 3.4199999999999999 113.696 178.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -65.83 -61.42 2.07 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.768 1.627 . . . . 5.7199999999999998 110.654 166.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.49 101.46 5.63 Favored 'General case' 0 C--N 1.342 0.253 0 C-N-CA 124.601 1.16 . . . . 2.23 108.454 -178.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 5.2 t -70.4 30.82 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 114.557 1.318 . . . . 4.5899999999999999 114.557 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 70.1 mt -118.25 -15.53 9.76 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.158 1.783 . . . . 3.4300000000000002 112.959 -163.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 104.24 -118.84 6.08 Favored Glycine 0 C--N 1.34 0.761 0 C-N-CA 124.454 1.026 . . . . 4.6600000000000001 112.62 177.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -92.5 111.3 22.84 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 113.328 0.862 . . . . 8.4299999999999997 113.328 -164.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 84.0 mmm -65.5 -28.52 69.25 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.823 0.82 . . . . 4.1900000000000004 112.07 155.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 tptt 72.3 144.09 0.07 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.875 2.87 . . . . 6.1200000000000001 111.303 -174.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 20.4 tp10 -49.61 -43.84 46.8 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.268 1.027 . . . . 4.5 113.55 -168.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 24.8 t -66.95 -7.95 25.98 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.316 1.598 . . . . 3.4300000000000002 115.316 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 12.3 t -105.5 -6.49 19.37 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 120.072 1.306 . . . . 2.2400000000000002 113.228 167.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 45.0 mm -73.55 -44.4 53.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 CA-C-N 120.172 1.351 . . . . 1.8500000000000001 110.718 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -71.13 -29.88 65.79 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.812 0.845 . . . . 2.98 112.632 -178.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -71.81 -44.58 63.69 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.847 1.203 . . . . 3.6899999999999999 111.396 167.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.78 -49.61 70.5 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.832 0.742 . . . . 2.1800000000000002 109.266 176.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 14.8 tpt -54.01 -51.32 64.35 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.794 1.638 . . . . 1.8 112.806 173.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -55.8 -39.33 71.17 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.571 1.548 . . . . 5.3099999999999996 112.195 173.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 30.5 m -74.48 -22.72 58.94 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.466 1.506 . . . . 2.04 110.664 -177.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 9.1 mt -83.17 -56.68 3.64 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.317 0.962 . . . . 1.75 113.212 169.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -70.82 139.57 50.96 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.877 0.695 . . . . 1.6599999999999999 112.877 -165.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 37.6 mmtm -135.02 -9.72 2.3 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.623 1.569 . . . . 3.8999999999999999 114.35 -175.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.23 -20.83 50.97 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.913 0.779 . . . . 2.5800000000000001 110.884 164.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 22.7 t 72.48 41.13 0.6 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.563 1.945 . . . . 2.7000000000000002 110.82 -178.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -114.43 -125.52 0.28 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.421 1.488 . . . . 3.2400000000000002 108.54 -167.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -144.04 -2.52 0.91 Allowed 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 116.753 2.131 . . . . 4.4500000000000002 116.753 165.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -113.66 141.82 46.76 Favored 'General case' 0 C--O 1.244 0.812 0 C-N-CA 125.853 1.661 . . . . 2.8500000000000001 111.291 177.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 45.1 mm -89.9 111.17 22.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 127.948 2.499 . . . . 1.04 109.846 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.94 159.27 33.01 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 128.092 2.557 . . . . 2.54 111.278 162.061 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -54.08 -35.39 62.03 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.256 1.206 . . . . 2.1299999999999999 114.256 -176.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -71.85 -36.38 70.12 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.71 -1.244 . . . . 3.6200000000000001 111.42 177.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -64.11 -51.78 62.32 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 124.344 1.058 . . . . 1.6799999999999999 109.259 171.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -52.05 -43.4 63.78 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.531 1.532 . . . . 2.23 113.309 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 35.8 m -62.91 -21.08 65.77 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.354 -0.841 . . . . 2.6400000000000001 113.098 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 21.2 t -64.24 -40.11 87.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 CA-C-N 119.496 1.044 . . . . 1.6599999999999999 110.661 170.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -59.19 -55.43 35.02 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 118.753 0.706 . . . . 1.8899999999999999 110.665 177.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 66.9 mt -57.77 -38.28 75.16 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.581 1.152 . . . . 1.3899999999999999 110.781 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 99.8 m -61.91 -50.06 73.71 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.179 0.992 . . . . 0.81000000000000005 112.303 173.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.9 mtm -64.57 -37.39 87.4 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 119.559 1.072 . . . . 1.52 112.18 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -60.93 -52.63 64.23 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.63 0.772 . . . . 2.6600000000000001 111.953 172.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 93.8 m -63.86 -35.89 82.14 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.389 0.514 . . . . 1.8300000000000001 112.389 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 49.2 mmm -60.73 -42.92 98.27 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.721 0.808 . . . . 2.1600000000000001 112.834 170.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.6 -33.64 71.26 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.518 1.053 . . . . 0.77000000000000002 112.003 176.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . 0.517 ' HB3' HG21 ' A' ' 13' ' ' VAL . 4.4 m-85 -69.82 -23.67 63.35 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.022 1.119 . . . . 2.1699999999999999 114.022 175.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -55.29 -49.6 71.71 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 120.561 1.528 . . . . 2.4399999999999999 111.056 166.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.16 -36.44 58.72 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.103 1.761 . . . . 3.04 112.196 -174.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -54.82 -47.14 74.44 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.217 1.407 . . . . 2.3700000000000001 111.281 166.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -67.18 -25.82 66.33 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.474 1.11 . . . . 2.0299999999999998 112.941 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 71.6 mt -78.2 -26.83 47.71 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 118.112 -0.947 . . . . 1.72 112.824 174.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -97.39 10.94 38.34 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.561 1.544 . . . . 3.71 114.263 174.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -93.56 -54.36 3.69 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.739 1.215 . . . . 3.1200000000000001 112.047 162.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -82.66 37.73 0.54 Allowed 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 125.866 1.666 . . . . 3.1400000000000001 112.721 -176.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.26 1.607 0 N-CA-C 118.896 2.924 . . . . 5.25 118.896 -145.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 . . . . . 0 C--O 1.238 0.48 0 N-CA-C 105.787 -1.931 . . . . 4.0 105.787 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 79.4 p -60.93 162.7 11.68 Favored Pre-proline 0 C--N 1.325 -0.483 0 C-N-CA 126.077 1.751 . . . . 1.4399999999999999 113.869 -170.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -61.8 -18.52 61.19 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.421 2.081 . . . . 1.3400000000000001 112.504 164.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.12 -45.37 34.05 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.508 1.049 . . . . 2.3199999999999998 110.562 175.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -61.32 -37.9 84.93 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.905 -1.122 . . . . 4.5599999999999996 111.148 172.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -69.79 -31.54 69.52 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.019 -1.05 . . . . 3.4199999999999999 112.971 172.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.67 -48.52 66.41 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.743 1.217 . . . . 0.90000000000000002 111.603 173.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 74.6 mt -57.85 -47.38 82.86 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.89 1.276 . . . . 1.5800000000000001 110.66 172.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 89.2 m -54.13 -48.48 70.76 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.113 1.365 . . . . 1.6200000000000001 111.8 172.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 92.1 m -66.55 -35.82 81.16 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.968 1.307 . . . . 1.3300000000000001 111.553 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -45.69 66.94 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.717 0.807 . . . . 4.0599999999999996 111.699 176.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.2 p -65.31 -29.72 48.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 119.355 0.98 . . . . 2.1000000000000001 112.234 171.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 55.3 m -63.83 -54.77 29.88 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 117.654 -1.165 . . . . 0.87 111.074 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.6 p -60.01 -36.64 77.66 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 119.525 1.057 . . . . 2.1299999999999999 110.481 174.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -68.06 -54.55 17.47 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 119.379 -0.928 . . . . 2.1800000000000002 110.928 -175.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -64.67 -29.44 70.44 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.921 0.888 . . . . 2.5 113.276 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 58.4 tttt -62.95 -70.84 0.18 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 127.537 2.335 . . . . 5.04 112.579 166.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -65.68 -24.85 67.11 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.136 -0.978 . . . . 2.0899999999999999 112.099 -172.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.7 t -60.21 -26.68 66.58 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 114.9 1.444 . . . . 1.8700000000000001 114.9 170.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -95.37 5.86 67.99 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 125.802 1.668 . . . . 1.3600000000000001 114.083 175.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.43 -44.74 92.83 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.96 1.38 . . . . 3.8999999999999999 111.462 172.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -146.69 161.05 41.4 Favored 'General case' 0 C--O 1.253 1.28 0 CA-C-O 123.49 1.614 . . . . 4.6799999999999997 113.24 176.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.18 -128.57 47.73 Favored Glycine 0 C--N 1.34 0.77 0 C-N-CA 126.944 2.211 . . . . 2.04 111.733 164.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.0 m -52.72 125.27 16.17 Favored 'General case' 0 C--O 1.245 0.822 0 C-N-CA 123.189 0.595 . . . . 2.8799999999999999 110.33 166.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -83.33 -2.88 56.79 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.223 1.009 . . . . 5.3200000000000003 113.328 176.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 9.8 mp -89.88 -34.13 16.2 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.878 2.071 . . . . 4.2000000000000002 111.691 174.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -126.98 163.52 23.51 Favored 'General case' 0 C--O 1.254 1.313 0 C-N-CA 127.661 2.384 . . . . 1.3 114.874 -167.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -109.35 105.63 15.1 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 127.582 2.353 . . . . 2.5899999999999999 112.097 -171.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.7 t -84.42 164.45 18.87 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.789 2.036 . . . . 1.96 112.057 175.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.1 tmm_? -60.96 -22.15 64.16 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 116.509 2.04 . . . . 4.8600000000000003 116.509 -161.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.62 -41.27 16.54 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 120.635 -1.291 . . . . 6.0 111.901 166.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -54.46 -49.97 68.81 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 120.302 1.41 . . . . 1.4299999999999999 110.532 175.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -65.64 -45.84 81.5 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.956 1.703 . . . . 2.6400000000000001 112.452 -177.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.255 1.1 ptmt -73.0 -32.69 65.31 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 118.111 -1.436 . . . . 3.6800000000000002 112.67 176.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -61.9 -44.34 96.99 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.434 1.47 . . . . 3.5299999999999998 112.97 171.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.9 tp -51.64 -64.96 0.65 Allowed 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 126.292 1.837 . . . . 2.1099999999999999 110.161 170.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 84.6 mt -55.44 -45.56 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-O 118.349 -0.834 . . . . 0.94999999999999996 111.641 -176.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.428 ' HZ3' ' CD ' ' A' ' 49' ' ' GLU . 24.2 mmmt -55.32 -28.74 55.68 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 118.69 0.677 . . . . 3.7400000000000002 112.69 -174.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -97.52 -34.42 11.0 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.472 1.909 . . . . 3.4399999999999999 113.286 -173.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -85.28 -50.43 7.36 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.357 0.663 . . . . 5.3399999999999999 111.616 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.9 mp -92.76 54.89 2.31 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.678 1.591 . . . . 3.3100000000000001 109.518 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.5 t -79.67 35.92 0.31 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.506 1.122 . . . . 2.9900000000000002 113.586 -166.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -91.9 -8.59 45.93 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 116.76 2.133 . . . . 3.9199999999999999 116.76 -161.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 97.86 1.71 58.55 Favored Glycine 0 N--CA 1.474 1.202 0 CA-C-N 119.179 0.899 . . . . 2.9199999999999999 114.437 -176.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.7 -152.4 0.29 Allowed 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 107.941 -1.133 . . . . 6.6500000000000004 107.941 143.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.88 39.48 20.35 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 124.165 1.936 . . . . 2.0499999999999998 110.736 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -74.52 141.71 44.83 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 112.396 -2.184 . . . . 4.6500000000000004 109.586 174.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.428 ' CD ' ' HZ3' ' A' ' 39' ' ' LYS . 2.0 mm-40 -52.1 -39.92 60.51 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.799 1.778 . . . . 4.46 115.799 -148.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.1 p -78.4 -28.87 46.95 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 115.337 1.606 . . . . 2.6600000000000001 115.337 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.3 t -56.25 -30.77 62.85 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.999 1.32 . . . . 1.8300000000000001 110.99 172.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 3.1 mt -74.68 -25.56 19.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 C-N-CA 124.141 0.976 . . . . 1.8 112.497 -176.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -86.81 -30.33 21.59 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.627 0.649 . . . . 3.6099999999999999 111.642 178.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -71.82 -34.51 69.38 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.193 0.906 . . . . 2.8199999999999998 111.621 167.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 53.8 tp -61.28 -52.59 64.1 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 117.34 -1.314 . . . . 1.72 110.15 165.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.2 ttt -53.33 -48.87 68.1 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 121.421 1.919 . . . . 1.54 112.112 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.69 -29.83 8.14 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.779 1.632 . . . . 3.52 113.361 174.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 50.2 m -93.49 -29.01 15.76 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.278 1.831 . . . . 2.6899999999999999 112.486 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.4 mt -78.66 -30.45 46.25 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.253 1.021 . . . . 2.2999999999999998 112.596 175.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -73.02 70.63 1.05 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.394 1.477 . . . . 1.3799999999999999 110.769 175.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.3 ttmp? -50.97 -29.61 12.74 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 115.602 1.705 . . . . 4.2199999999999998 115.602 -162.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -95.15 -18.98 20.47 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 115.495 1.665 . . . . 3.0899999999999999 115.495 175.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 59.96 108.94 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.363 1.465 . . . . 3.8500000000000001 112.221 -153.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.4 p30 -140.0 -78.73 0.31 Allowed 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.962 -1.086 . . . . 2.8399999999999999 110.405 173.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -166.81 -28.79 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 130.615 3.566 . . . . 5.8399999999999999 112.218 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -154.4 166.79 32.13 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.564 1.145 . . . . 2.2599999999999998 112.81 -173.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 6.9 mm -98.07 108.78 22.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 125.275 1.43 . . . . 0.98999999999999999 112.376 -170.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -74.67 159.13 32.47 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.814 1.646 . . . . 2.7000000000000002 111.665 165.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -46.38 -45.99 18.17 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.124 -1.61 . . . . 2.6400000000000001 113.281 170.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.4 pttm -72.53 -6.59 45.01 Favored 'General case' 0 CA--C 1.55 0.964 0 O-C-N 121.329 -0.857 . . . . 3.1800000000000002 113.282 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -91.42 -61.26 1.69 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.359 1.464 . . . . 1.5900000000000001 109.34 163.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -54.84 -22.96 16.23 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 128.019 2.528 . . . . 2.8500000000000001 115.497 -175.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.45 -30.68 20.51 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 124.986 1.315 . . . . 2.6400000000000001 112.484 167.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.2 p -69.16 -36.26 72.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 119.083 0.856 . . . . 2.4199999999999999 112.184 176.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -60.98 -48.14 83.2 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 118.966 0.803 . . . . 2.1299999999999999 111.317 174.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 73.0 mt -63.21 -36.13 82.61 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.78 0.832 . . . . 1.9399999999999999 111.573 177.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 57.8 m -66.2 -47.12 74.93 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.573 1.149 . . . . 0.83999999999999997 111.228 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.9 mtp -57.41 -43.35 83.7 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.826 1.25 . . . . 1.79 111.705 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 72.8 mt -67.8 -45.02 75.95 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.595 0.758 . . . . 1.4099999999999999 111.725 178.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 5.4 m -59.84 -34.79 73.56 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.547 1.067 . . . . 1.3400000000000001 113.749 174.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 56.3 mtp -72.44 -34.19 67.62 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.438 0.563 . . . . 2.27 112.026 174.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.34 -47.07 68.47 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.591 -0.693 . . . . 0.80000000000000004 112.499 175.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -68.83 -26.63 65.26 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.361 -0.837 . . . . 2.3100000000000001 113.147 176.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -63.86 -49.75 71.54 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.679 0.791 . . . . 2.73 111.902 168.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -60.84 -46.4 90.72 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.319 1.048 . . . . 3.29 111.878 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -50.26 -50.87 48.81 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.559 1.544 . . . . 2.1800000000000002 111.494 175.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -64.28 -26.58 68.56 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.197 1.399 . . . . 2.0600000000000001 113.201 -177.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 32.5 mt -78.01 -18.91 55.35 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.812 0.845 . . . . 1.5 111.926 175.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -91.9 -36.76 13.29 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.165 1.386 . . . . 3.4100000000000001 113.811 173.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 . . . . . 0 CA--C 1.542 0.636 0 C-N-CA 126.399 1.88 . . . . 3.46 113.607 177.021 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . 0.414 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 80.5 p . . . . . 0 N--CA 1.472 0.656 0 N-CA-C 113.733 1.012 . . . . 1.6599999999999999 113.733 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . 0.414 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 17.6 Cg_endo -52.0 -23.14 16.09 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 124.529 3.486 . . . . 1.53 114.954 163.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 56.1 tp -70.41 -48.64 55.13 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 120.092 1.314 . . . . 2.7200000000000002 110.29 174.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.09 -30.65 70.48 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.308 0.504 . . . . 4.8399999999999999 111.203 172.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 21.9 mmtt -66.27 -25.57 66.93 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 119.717 -1.864 . . . . 4.5199999999999996 113.126 169.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.28 -45.32 73.42 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 119.9 1.227 . . . . 0.98999999999999999 111.613 172.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -60.56 -43.2 97.51 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.711 1.204 . . . . 2.8999999999999999 111.655 170.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 25.9 m -57.32 -47.15 82.29 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.192 1.397 . . . . 1.28 111.496 173.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 87.0 m -58.68 -44.29 90.18 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.223 1.009 . . . . 1.3799999999999999 109.867 175.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 3.0 tpp -53.83 -51.47 63.44 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.292 1.037 . . . . 3.3700000000000001 112.61 177.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 10.6 m -67.6 -27.65 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 CA-C-N 118.801 0.728 . . . . 2.1800000000000002 112.511 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 66.2 m -68.34 -47.13 68.31 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.538 1.135 . . . . 0.75 110.93 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.91 -40.63 89.5 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.159 0.584 . . . . 1.73 110.007 166.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -63.66 -55.75 21.06 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 120.276 -0.57 . . . . 1.95 111.355 -169.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 18.7 m170 -62.35 -35.39 78.97 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.454 0.701 . . . . 3.5800000000000001 112.344 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -74.59 -29.85 61.48 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.489 0.922 . . . . 4.1900000000000004 113.489 -175.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -94.95 -37.55 11.1 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.994 1.318 . . . . 2.1099999999999999 112.426 175.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 84.1 p -57.65 -33.27 68.11 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.777 1.171 . . . . 1.9099999999999999 112.666 176.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.88 -3.4 73.75 Favored Glycine 0 CA--C 1.528 0.901 0 CA-C-O 116.378 -2.345 . . . . 1.3400000000000001 116.282 -170.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -65.29 -39.65 92.83 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.779 2.29 . . . . 4.9500000000000002 112.338 178.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -122.0 126.87 49.5 Favored 'General case' 0 C--O 1.254 1.298 0 C-N-CA 129.074 2.949 . . . . 3.3599999999999999 110.46 176.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.98 -128.55 42.6 Favored Glycine 0 C--N 1.337 0.61 0 C-N-CA 126.059 1.79 . . . . 2.1899999999999999 113.646 166.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -52.04 148.11 6.52 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.373 2.669 . . . . 3.3599999999999999 114.194 172.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -106.82 -6.32 17.79 Favored 'General case' 0 CA--C 1.553 1.059 0 N-CA-C 114.45 1.278 . . . . 6.4299999999999997 114.45 -175.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 97.0 mt -99.49 3.56 45.66 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.926 1.29 . . . . 3.3900000000000001 113.005 175.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 2.0 p -145.64 137.95 25.6 Favored 'General case' 0 C--O 1.246 0.871 0 C-N-CA 125.667 1.587 . . . . 1.23 111.938 -166.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 48.4 mt -84.45 126.97 33.74 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 114.605 -1.18 . . . . 1.97 109.926 173.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 3.1 m -105.92 150.34 25.75 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 127.037 2.135 . . . . 3.4500000000000002 110.291 -168.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . 0.494 HH11 ' HG3' ' B' ' 31' ' ' ARG . 5.6 mmm-85 -37.61 -46.69 0.88 Allowed 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 117.095 2.258 . . . . 4.3300000000000001 117.095 -165.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.71 -34.23 22.97 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 119.604 1.093 . . . . 4.0300000000000002 112.635 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -50.02 -36.54 29.07 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.386 0.994 . . . . 1.8300000000000001 111.087 165.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.404 ' CD1' HD11 ' B' ' 38' ' ' ILE . 0.3 OUTLIER -70.34 -37.98 74.77 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 112.606 0.595 . . . . 2.2999999999999998 112.606 -174.827 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 26.7 mmtm -63.91 -44.08 94.02 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.646 1.178 . . . . 5.6399999999999997 111.777 171.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 36.2 tp10 -74.5 -15.24 60.88 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 125.56 1.544 . . . . 3.0600000000000001 112.812 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 44.7 tp -96.85 -52.17 3.99 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 120.964 1.711 . . . . 2.1299999999999999 111.831 175.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 0.404 HD11 ' CD1' ' B' ' 34' ' ' LEU . 36.6 mt -52.03 -52.04 26.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 CA-C-N 121.306 1.866 . . . . 1.2 109.995 -179.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 tttp -71.8 10.96 0.58 Allowed 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 125.394 1.478 . . . . 4.7999999999999998 113.528 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -128.43 -39.7 1.66 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.43 2.292 . . . . 3.4399999999999999 113.941 175.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -70.98 -13.7 62.1 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 119.505 1.048 . . . . 5.1100000000000003 112.514 169.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -134.45 114.46 12.91 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.925 1.69 . . . . 2.3199999999999998 108.292 175.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 12.3 p -85.66 -11.37 53.98 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.548 1.684 . . . . 4.5899999999999999 115.548 -166.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -58.49 -11.99 3.5 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 117.659 2.466 . . . . 3.9399999999999999 117.659 -163.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.36 -49.56 2.67 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 125.188 1.375 . . . . 3.5600000000000001 113.617 177.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -71.13 66.64 0.42 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.7 2.4 . . . . 5.3300000000000001 110.24 174.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.58 -26.3 8.72 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.866 1.666 . . . . 4.0800000000000001 111.558 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 20.0 mtpp 72.54 84.5 0.12 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.869 2.068 . . . . 4.6900000000000004 113.287 159.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -27.76 -52.2 0.08 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 128.856 2.862 . . . . 5.0199999999999996 116.445 -178.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 3.0 m -57.83 -28.8 64.42 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.857 1.208 . . . . 2.8199999999999998 114.215 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 15.0 t -77.75 -8.2 57.64 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.368 1.067 . . . . 3.1400000000000001 113.765 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 49.3 mt -85.2 -40.06 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 120.322 1.419 . . . . 1.8700000000000001 113.804 -165.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.24 -23.41 61.22 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 118.981 0.81 . . . . 3.1899999999999999 111.221 172.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -76.15 -44.52 37.92 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.451 0.7 . . . . 2.73 111.504 169.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 51.4 tp -55.01 -45.65 75.13 Favored 'General case' 0 C--N 1.344 0.355 0 O-C-N 121.039 -1.038 . . . . 2.21 110.045 168.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . 0.415 ' SD ' ' HD2' ' B' ' 31' ' ' ARG . 4.6 ttt -58.26 -51.12 71.12 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.951 0.796 . . . . 1.9199999999999999 111.463 175.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -54.97 -28.39 51.2 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.649 1.179 . . . . 4.0999999999999996 113.311 173.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.0 t -81.2 -30.3 34.34 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.31 1.044 . . . . 2.0 112.933 177.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 96.1 mt -86.25 -35.89 19.71 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.0 1.32 . . . . 2.3100000000000001 112.798 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -75.94 70.99 2.72 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.489 1.915 . . . . 1.6599999999999999 111.129 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.91 -8.91 2.49 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.475 1.51 . . . . 3.21 114.996 -173.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -110.07 -0.63 17.93 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 120.05 1.295 . . . . 2.5800000000000001 113.71 172.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 73.8 m 55.81 33.93 22.46 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.176 1.39 . . . . 2.7799999999999998 113.628 -178.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -102.37 3.8 38.27 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 129.799 3.24 . . . . 2.46 112.033 -168.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 67.26 -10.3 0.35 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 131.117 3.767 . . . . 4.0599999999999996 115.454 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -109.74 144.88 37.52 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 126.163 1.785 . . . . 2.6499999999999999 110.391 175.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 19.8 mt -114.22 106.7 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 O-C-N 121.161 -0.962 . . . . 1.25 111.241 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -68.91 159.99 31.59 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.989 2.116 . . . . 2.8799999999999999 110.923 172.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.6 -35.48 54.42 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 120.145 -1.597 . . . . 2.5800000000000001 112.829 170.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -63.53 -25.05 68.07 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.623 0.769 . . . . 3.8999999999999999 113.059 173.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -89.47 -54.77 3.94 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 125.835 1.654 . . . . 1.8300000000000001 110.17 174.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -58.42 -32.19 68.42 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 127.0 2.12 . . . . 1.76 113.908 -176.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 9.1 p -53.88 -28.01 33.69 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.199 -1.563 . . . . 1.8999999999999999 113.587 168.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 59.7 t -72.31 -31.23 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 120.265 1.393 . . . . 1.6399999999999999 111.25 177.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -63.43 -54.51 35.47 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.556 -0.715 . . . . 2.4399999999999999 110.192 173.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 72.1 mt -54.33 -40.1 67.68 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.552 1.141 . . . . 1.3300000000000001 111.366 174.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.4 m -59.94 -53.97 51.58 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.047 0.939 . . . . 0.80000000000000004 111.544 176.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.9 mtm -60.55 -40.04 90.15 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.373 0.533 . . . . 1.6000000000000001 112.222 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 98.1 mt -59.27 -52.43 65.68 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.356 0.662 . . . . 1.5 110.685 174.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 93.2 m -59.28 -33.55 71.19 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.537 1.31 . . . . 1.6399999999999999 114.537 177.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 81.6 mtp -70.19 -33.72 72.07 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.71 0.804 . . . . 1.99 112.74 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.73 -34.76 58.09 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.42 1.009 . . . . 0.92000000000000004 112.079 171.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -62.03 -27.53 68.95 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.133 0.973 . . . . 2.29 112.926 175.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -60.9 -51.72 68.08 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.738 0.815 . . . . 2.23 111.154 170.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.7 -30.64 64.39 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 126.142 1.777 . . . . 3.2200000000000002 111.913 -176.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.68 -51.19 70.43 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.492 1.517 . . . . 2.1299999999999999 110.793 166.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -61.29 -28.32 69.11 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.786 0.834 . . . . 2.2799999999999998 112.336 178.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 63.8 mt -70.64 -39.72 73.5 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.5 -0.75 . . . . 2.1499999999999999 112.083 171.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -75.55 -19.13 59.51 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 115.087 1.514 . . . . 3.3500000000000001 115.087 177.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -78.43 -32.61 48.66 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.143 1.377 . . . . 4.1200000000000001 112.547 171.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -83.6 -8.55 59.29 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.696 0.999 . . . . 3.75 113.696 -173.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.892 0 CA-C-O 116.335 -1.793 . . . . 5.96 115.462 -167.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 106.856 -1.535 . . . . 4.0 106.856 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 81.2 p -113.12 155.09 44.85 Favored Pre-proline 0 N--CA 1.466 0.343 0 C-N-CA 124.661 1.184 . . . . 2.0299999999999998 110.316 165.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -67.7 -16.23 46.05 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 121.95 1.766 . . . . 2.27 111.339 165.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.37 -50.44 65.55 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 123.871 0.868 . . . . 2.3700000000000001 111.02 -178.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -58.95 -43.58 91.3 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 118.778 0.717 . . . . 3.6299999999999999 111.777 173.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.37 -24.16 65.67 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.246 -0.909 . . . . 5.6900000000000004 111.428 -175.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.52 -49.94 23.97 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.789 0.836 . . . . 1.8 111.094 166.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.5 mt -53.64 -32.11 50.05 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.48 1.036 . . . . 2.4399999999999999 112.176 175.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.27 -40.8 62.21 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 117.571 -1.204 . . . . 2.4500000000000002 112.137 173.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.5 t -61.81 -26.09 67.89 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 120.288 1.403 . . . . 3.0899999999999999 112.187 -177.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 13.4 mtm -65.23 -37.43 87.23 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.798 0.839 . . . . 3.1299999999999999 111.026 174.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 67.1 t -76.81 -32.7 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.076 1.351 . . . . 1.98 111.357 173.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 51.6 m -64.04 -49.41 72.48 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.295 1.038 . . . . 1.1799999999999999 110.65 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.4 p -64.72 -33.31 75.66 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.691 0.678 . . . . 2.3999999999999999 110.108 173.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.41 -56.5 19.61 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 118.411 0.55 . . . . 2.3300000000000001 109.627 178.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -45.67 84.37 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 120.48 -1.387 . . . . 2.6099999999999999 111.68 -178.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -68.23 -49.1 62.94 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.151 -0.968 . . . . 6.29 113.373 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -76.97 -28.17 55.04 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.875 1.216 . . . . 2.1600000000000001 112.427 178.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.8 p -68.97 -25.57 64.6 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-N 120.955 1.707 . . . . 2.1600000000000001 112.274 170.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -82.91 3.7 82.85 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 125.96 1.743 . . . . 1.9299999999999999 114.298 167.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.6 ttt-85 -64.21 -31.7 73.0 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.865 1.832 . . . . 6.2300000000000004 111.25 171.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -157.41 147.39 20.61 Favored 'General case' 0 C--O 1.249 1.075 0 C-N-CA 124.226 1.01 . . . . 3.8900000000000001 112.878 178.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.49 -123.63 30.78 Favored Glycine 0 C--N 1.338 0.694 0 C-N-CA 126.129 1.823 . . . . 2.7000000000000002 112.636 160.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.0 m -47.13 112.5 0.53 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.83 1.252 . . . . 3.3599999999999999 110.752 169.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.16 24.85 2.36 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.582 1.553 . . . . 4.6399999999999997 114.372 -169.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.5 tp -143.44 -43.23 0.28 Allowed 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 124.971 1.308 . . . . 4.1200000000000001 110.559 -177.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 16.9 p -79.83 144.52 33.42 Favored 'General case' 0 C--O 1.248 0.996 0 CA-C-O 122.859 1.314 . . . . 0.93000000000000005 110.849 172.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 28.0 mt -88.26 92.17 9.06 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 105.916 -1.883 . . . . 1.7 105.916 165.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.1 t -60.5 149.77 33.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 119.009 -0.52 . . . . 2.04 109.994 169.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -37.61 -49.7 1.11 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.507 1.923 . . . . 3.9199999999999999 113.26 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.492 ' H ' ' HD3' ' A' ' 32' ' ' LYS . 0.8 OUTLIER -70.06 -28.58 65.56 Favored 'General case' 0 CA--C 1.554 1.121 0 O-C-N 119.51 -1.994 . . . . 5.4900000000000002 115.032 -179.837 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -74.91 -38.37 61.84 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.42 1.488 . . . . 1.5800000000000001 109.921 174.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.7 tp -63.4 -39.63 95.02 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.878 0.871 . . . . 1.8300000000000001 111.462 173.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.2 ttmt -55.25 -40.41 70.88 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 119.094 0.861 . . . . 3.8199999999999998 112.005 175.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -60.6 -59.03 6.04 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.963 0.905 . . . . 3.5099999999999998 111.647 170.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.7 tp -56.34 -48.77 76.09 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.412 1.485 . . . . 2.0699999999999998 113.641 -172.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.2 mt -53.57 -61.32 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 CA-C-N 118.64 0.655 . . . . 0.93000000000000005 110.246 -174.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.87 1.04 28.59 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 113.608 0.966 . . . . 5.1299999999999999 113.608 -172.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 43.6 mmtt -91.77 -33.58 14.94 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.012 1.325 . . . . 2.9300000000000002 112.859 174.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -89.24 -51.66 5.46 Favored 'General case' 0 CA--C 1.532 0.25 0 O-C-N 124.265 0.978 . . . . 5.2400000000000002 110.303 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 46.7 mt -78.96 67.27 4.62 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.714 1.206 . . . . 2.6899999999999999 111.33 -176.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 98.9 m -63.78 -12.95 39.82 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.349 1.611 . . . . 3.8799999999999999 115.349 -163.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.503 HD23 ' H ' ' A' ' 44' ' ' LEU . 1.6 pt? -99.69 0.59 42.21 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 126.789 2.036 . . . . 3.5099999999999998 114.733 178.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -82.51 121.77 5.54 Favored Glycine 0 CA--C 1.531 1.088 0 O-C-N 121.595 -0.691 . . . . 3.79 114.109 -168.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -72.78 60.17 0.5 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.008 1.723 . . . . 6.2599999999999998 111.347 165.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.3 mmt -78.19 68.99 4.33 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 124.054 1.883 . . . . 3.4199999999999999 110.793 173.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -58.84 113.87 2.27 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 113.083 -1.871 . . . . 5.04 108.301 174.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -52.35 -35.98 52.48 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 117.097 2.258 . . . . 4.7199999999999998 117.097 -136.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.9 t -57.62 -25.56 60.29 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 120.541 1.519 . . . . 3.6600000000000001 113.597 177.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.1 t -69.34 -17.92 63.75 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.991 -1.068 . . . . 2.98 113.611 174.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 17.8 mm -61.08 -41.74 90.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 119.897 1.226 . . . . 1.55 109.679 168.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -77.59 -39.05 46.9 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.61 1.164 . . . . 3.4300000000000002 111.89 -169.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.46 ' CG ' ' HE2' ' A' ' 57' ' ' LYS . 1.2 m-20 -79.33 -26.93 42.1 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.589 1.156 . . . . 3.9700000000000002 112.888 175.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 43.9 tp -59.88 -52.99 63.07 Favored 'General case' 0 C--N 1.344 0.326 0 CA-C-N 118.858 0.754 . . . . 1.97 109.116 159.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -55.99 -48.62 75.52 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.295 1.038 . . . . 2.1899999999999999 111.544 -176.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.46 ' HE2' ' CG ' ' A' ' 54' ' ' ASP . 16.3 mtmm -51.92 -36.98 50.89 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.838 1.255 . . . . 5.0 114.304 171.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 50.8 m -84.27 -18.82 35.17 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.177 1.391 . . . . 2.5699999999999998 113.882 -178.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 97.8 mt -83.93 -54.54 4.8 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 124.412 1.085 . . . . 2.1299999999999999 109.973 170.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -78.72 90.22 4.61 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.438 1.095 . . . . 1.6799999999999999 112.482 175.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -78.91 -2.39 39.72 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.95 0.722 . . . . 3.2200000000000002 112.95 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -83.03 -30.46 28.06 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 114.299 1.222 . . . . 2.0800000000000001 114.299 173.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 28.6 t 64.63 23.93 12.9 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.998 0.919 . . . . 3.02 113.131 -159.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 55.3 p-10 -81.8 -10.41 59.34 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.039 1.336 . . . . 2.3999999999999999 111.813 176.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 63.57 4.61 1.85 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 129.545 3.138 . . . . 3.6899999999999999 114.247 -171.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -106.52 131.03 54.17 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 128.508 2.723 . . . . 2.5099999999999998 110.002 175.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 35.0 mm -87.9 113.97 25.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 O-C-N 120.62 -1.3 . . . . 1.51 108.936 168.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -76.87 162.37 27.67 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.462 1.505 . . . . 2.6499999999999999 109.485 167.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.37 -43.3 79.06 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 119.91 -1.744 . . . . 3.1000000000000001 112.944 -176.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.1 pttm -70.19 -14.51 62.66 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.023 1.329 . . . . 3.1099999999999999 114.435 174.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -85.41 -41.76 15.14 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.506 1.123 . . . . 1.9399999999999999 110.666 168.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -57.48 -29.85 64.59 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.637 -1.289 . . . . 2.3100000000000001 112.637 174.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.0 m -51.49 -32.42 27.37 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.678 1.191 . . . . 1.6699999999999999 113.738 166.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 32.7 t -70.06 -39.91 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-N 119.652 1.115 . . . . 1.8700000000000001 109.597 179.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -64.76 -54.13 36.21 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 123.458 0.703 . . . . 2.1000000000000001 109.368 177.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.1 mt -58.58 -35.43 72.4 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.232 1.013 . . . . 1.8500000000000001 112.075 178.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 86.3 m -63.99 -55.65 20.82 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.378 0.99 . . . . 0.80000000000000004 110.509 175.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 77.2 mtm -59.75 -43.88 94.09 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 118.921 0.782 . . . . 1.51 112.193 -175.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.01 -51.97 64.76 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.928 0.891 . . . . 2.4300000000000002 112.215 174.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 8.9 t -63.06 -32.3 73.64 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.38 0.511 . . . . 1.3899999999999999 112.38 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 80.6 mtp -69.55 -32.67 71.61 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.11 0.782 . . . . 1.54 113.11 171.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.64 -43.09 94.78 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.81 1.186 . . . . 0.90000000000000002 111.776 172.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -63.68 -28.17 69.72 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.077 1.14 . . . . 2.2400000000000002 114.077 176.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -61.12 -47.56 85.68 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.805 0.73 . . . . 1.77 111.673 171.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -66.85 -43.94 82.36 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.322 0.649 . . . . 3.1899999999999999 111.414 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -51.08 61.71 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.73 1.612 . . . . 2.1400000000000001 111.609 175.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -66.55 -35.03 79.22 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.192 -0.942 . . . . 3.5299999999999998 111.789 -178.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.1 mt -68.55 -33.05 73.43 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.299 0.64 . . . . 2.3799999999999999 112.092 175.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -75.87 -35.62 59.83 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 114.054 1.131 . . . . 2.8199999999999998 114.054 177.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 . . . . . 0 CA--C 1.543 0.686 0 C-N-CA 126.17 1.788 . . . . 3.6299999999999999 112.678 178.367 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . 0.486 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 72.3 p . . . . . 0 N--CA 1.482 1.168 0 N-CA-C 113.677 0.992 . . . . 1.6399999999999999 113.677 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . 0.486 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 24.6 Cg_endo -59.07 -31.02 94.81 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.47 2.113 . . . . 1.5 113.404 167.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.99 -48.41 71.31 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 119.642 1.11 . . . . 2.6600000000000001 111.409 178.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -64.77 -39.65 93.96 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 118.773 0.715 . . . . 3.7200000000000002 111.891 174.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -58.09 -31.14 66.83 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.354 -1.466 . . . . 4.6200000000000001 112.632 172.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.35 -31.36 72.1 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.977 0.808 . . . . 1.02 112.631 175.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 58.0 mt -65.82 -52.32 51.56 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.334 1.054 . . . . 2.1400000000000001 110.033 175.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 90.4 m -52.46 -43.64 65.06 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.998 1.319 . . . . 1.8799999999999999 111.51 172.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 59.7 m -64.58 -40.67 95.95 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.764 1.226 . . . . 1.5800000000000001 112.534 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 1.5 tmm? -74.48 -43.81 54.32 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 118.624 0.647 . . . . 3.75 112.598 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 16.4 m -61.76 -20.48 23.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 O-C-N 120.636 -1.29 . . . . 2.3999999999999999 112.065 174.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 98.4 m -63.59 -55.5 23.27 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 117.388 -1.291 . . . . 1.6599999999999999 111.782 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 17.0 p -66.79 -33.46 75.67 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 120.048 1.295 . . . . 1.9399999999999999 110.188 175.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -65.0 -46.52 81.06 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 120.803 -0.359 . . . . 2.1099999999999999 111.917 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 23.8 m-70 -64.21 -49.56 71.48 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.096 0.958 . . . . 4.3799999999999999 111.343 171.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -56.15 -43.5 78.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.664 0.785 . . . . 4.5300000000000002 112.763 -175.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -91.66 -31.42 15.85 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.611 1.164 . . . . 2.71 113.174 -177.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 72.9 m -65.81 -42.07 91.09 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 121.271 1.85 . . . . 1.8999999999999999 111.469 172.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.74 -3.39 90.35 Favored Glycine 0 CA--C 1.531 1.073 0 C-N-CA 126.632 2.063 . . . . 1.7 114.555 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -26.18 67.42 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.871 1.668 . . . . 3.3500000000000001 112.053 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . 0.561 ' HG2' ' HE3' ' B' ' 32' ' ' LYS . 0.0 OUTLIER -149.91 167.53 26.38 Favored 'General case' 0 C--O 1.245 0.846 0 C-N-CA 125.676 1.59 . . . . 5.3200000000000003 113.107 159.673 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.11 -105.14 0.42 Allowed Glycine 0 N--CA 1.473 1.161 0 O-C-N 126.227 2.204 . . . . 3.2799999999999998 115.698 128.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -61.4 89.92 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 107.056 -1.461 . . . . 4.9100000000000001 107.056 163.198 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 37.7 mttm -93.09 -26.53 17.42 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 120.315 -1.491 . . . . 6.71 114.695 -158.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.429 ' H ' HD23 ' B' ' 27' ' ' LEU . 2.0 pt? -80.62 -26.2 37.9 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.904 0.882 . . . . 4.4400000000000004 112.242 172.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.1 p -103.76 151.23 23.28 Favored 'General case' 0 C--O 1.246 0.903 0 C-N-CA 126.932 2.093 . . . . 1.1399999999999999 113.18 -177.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 20.7 mt -76.65 101.54 5.79 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 106.189 -1.782 . . . . 1.6399999999999999 106.189 154.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.422 ' HB3' ' HE2' ' B' ' 32' ' ' LYS . 17.9 t -62.61 147.41 49.36 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.777 -0.823 . . . . 2.0899999999999999 108.777 165.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -41.75 -41.68 2.39 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.801 1.64 . . . . 4.1500000000000004 113.674 -174.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.561 ' HE3' ' HG2' ' B' ' 23' ' ' GLU . 0.2 OUTLIER -60.37 -49.26 78.3 Favored 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 117.167 2.284 . . . . 6.2699999999999996 117.167 168.439 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -64.69 -35.67 81.8 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.801 1.637 . . . . 2.3599999999999999 110.86 173.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 40.3 tp -62.6 -51.09 68.67 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.179 0.592 . . . . 2.0899999999999999 110.531 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . 0.511 ' HA ' HG21 ' B' ' 52' ' ' ILE . 20.4 mmtt -52.32 -39.77 61.02 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.782 1.233 . . . . 4.0800000000000001 113.183 177.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -68.29 -57.64 5.64 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.147 1.379 . . . . 3.73 111.855 172.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 24.4 tp -52.6 -58.93 5.21 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.457 1.903 . . . . 2.5299999999999998 111.585 -174.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 0.417 ' CD1' HG23 ' B' ' 52' ' ' ILE . 54.0 mt -53.98 -42.82 55.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 CA-C-O 121.626 0.727 . . . . 1.3300000000000001 110.46 -177.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 65.2 tttt -64.15 -18.26 64.27 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 113.145 0.794 . . . . 4.5899999999999999 113.145 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 19.6 mmtp -97.44 -45.57 6.39 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.178 1.391 . . . . 4.1699999999999999 112.294 167.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -61.76 -35.97 79.67 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.605 1.962 . . . . 4.0899999999999999 112.038 -170.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -110.96 -70.52 0.81 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.72 1.208 . . . . 2.1800000000000002 109.766 167.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 2.2 t 67.24 -64.91 0.24 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.18 1.792 . . . . 5.4400000000000004 113.118 -169.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.4 ' HB3' ' H ' ' B' ' 45' ' ' GLY . 4.2 mm? 30.36 -135.06 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 127.942 2.497 . . . . 3.6299999999999999 112.33 -171.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . 0.4 ' H ' ' HB3' ' B' ' 44' ' ' LEU . . . -89.0 -35.79 8.02 Favored Glycine 0 CA--C 1.528 0.874 0 O-C-N 120.303 -1.498 . . . . 3.21 111.057 165.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -89.72 -27.77 19.85 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.369 1.868 . . . . 6.79 114.632 -159.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.77 68.69 7.11 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 123.951 1.834 . . . . 2.73 111.92 -175.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp -134.3 161.22 35.56 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 129.12 2.968 . . . . 6.8499999999999996 108.487 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -40.57 -64.29 0.54 Allowed 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 116.619 2.081 . . . . 3.3999999999999999 116.619 -131.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 13.5 m -65.83 -25.62 67.29 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.272 1.212 . . . . 2.46 114.272 -173.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 5.3 m -62.41 -5.25 2.34 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.611 1.165 . . . . 2.27 112.898 170.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . 0.511 HG21 ' HA ' ' B' ' 35' ' ' LYS . 62.9 mt -110.33 -22.69 4.86 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 125.606 1.562 . . . . 1.3100000000000001 112.042 175.058 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -80.06 -48.76 12.77 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.262 0.937 . . . . 3.3100000000000001 112.313 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -68.67 -33.05 73.31 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 118.917 0.781 . . . . 2.7999999999999998 110.252 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 8.3 tt -62.12 -44.3 96.94 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 117.269 -1.348 . . . . 2.3300000000000001 111.073 172.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ttt -58.44 -48.91 79.17 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 121.943 2.156 . . . . 2.1499999999999999 112.133 169.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.23 -20.96 20.6 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 120.09 1.313 . . . . 5.4100000000000001 113.47 174.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 31.0 t -89.25 -38.1 14.47 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.967 1.707 . . . . 2.3799999999999999 112.738 176.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 7.3 mp -71.72 -59.7 2.62 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 126.504 1.921 . . . . 2.3500000000000001 111.809 174.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -78.66 95.15 5.2 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 127.869 2.468 . . . . 1.4199999999999999 110.748 -170.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.2 -39.89 84.02 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 114.418 1.266 . . . . 2.8399999999999999 114.418 -169.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 53.2 p-10 -99.91 -6.21 27.07 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.045 1.498 . . . . 1.9399999999999999 115.045 -173.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 17.9 t 64.02 26.41 14.06 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.776 1.23 . . . . 2.3700000000000001 113.742 -177.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 50.8 p30 -68.16 -15.98 63.81 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.406 1.482 . . . . 2.1000000000000001 111.493 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 64.58 22.32 12.62 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 129.273 3.029 . . . . 4.3799999999999999 113.563 -175.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -131.74 123.76 28.35 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 127.775 2.43 . . . . 2.98 107.562 175.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 18.8 mm -90.81 110.72 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 O-C-N 120.993 -1.067 . . . . 1.3700000000000001 111.662 -173.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -76.13 150.54 37.18 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.881 1.273 . . . . 2.6600000000000001 110.167 161.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.04 -33.11 72.77 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 119.96 -1.713 . . . . 2.8399999999999999 112.333 -174.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 19.1 pttm -74.32 -9.12 58.29 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.326 1.232 . . . . 3.5299999999999998 114.326 173.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -81.82 -53.19 6.39 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 108.011 -1.107 . . . . 1.78 108.011 157.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -61.37 -25.56 67.25 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 116.518 2.044 . . . . 3.6699999999999999 116.518 -172.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 94.4 p -65.53 -19.69 66.03 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.207 -1.558 . . . . 1.6399999999999999 111.886 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 1.2 p -69.36 -27.78 35.83 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 N-CA-C 113.0 0.741 . . . . 2.48 113.0 170.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 45.8 t80 -61.03 -51.25 69.99 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 120.822 -1.174 . . . . 2.4300000000000002 110.454 170.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 33.5 mt -59.71 -38.4 81.51 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.419 1.088 . . . . 1.3799999999999999 110.658 177.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.4 m -59.86 -54.21 48.82 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.725 1.21 . . . . 0.91000000000000003 111.417 174.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -55.31 -42.81 74.2 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.708 1.14 . . . . 2.1699999999999999 112.942 177.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 93.7 mt -63.83 -48.64 75.99 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.604 0.762 . . . . 1.73 111.52 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 75.1 m -67.58 -32.93 74.03 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 113.038 0.755 . . . . 1.6799999999999999 113.038 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 88.6 mtp -68.71 -36.04 77.95 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.643 0.656 . . . . 2.0499999999999998 112.082 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.91 -42.98 72.63 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 119.068 0.849 . . . . 1.1000000000000001 112.049 172.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -63.0 -25.76 68.54 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 119.686 1.13 . . . . 3.0099999999999998 113.77 176.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -62.54 -51.51 67.11 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 120.0 1.273 . . . . 2.0600000000000001 111.854 168.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -71.65 -29.34 64.52 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.578 1.151 . . . . 3.4100000000000001 112.456 -174.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -58.86 -56.5 21.41 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.584 1.554 . . . . 3.3199999999999998 110.678 164.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -60.17 -27.18 66.91 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.684 1.194 . . . . 2.2000000000000002 113.152 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 68.7 mt -66.37 -40.9 90.01 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 117.507 -1.235 . . . . 2.29 112.021 171.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -86.89 -1.73 58.04 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.782 1.401 . . . . 4.0899999999999999 114.782 176.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -76.43 -33.58 58.78 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 120.79 -1.194 . . . . 3.3199999999999998 111.605 159.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -102.86 7.96 39.31 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.506 1.523 . . . . 2.8799999999999999 113.918 -170.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 N-CA-C 118.844 2.905 . . . . 4.9000000000000004 118.844 -161.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 17.6 mp0 . . . . . 0 N--CA 1.445 -0.725 0 N-CA-C 106.887 -1.524 . . . . 3.4100000000000001 106.887 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.663 HG21 ' HA ' ' B' ' 41' ' ' GLU . 3.9 p -151.03 162.73 25.98 Favored Pre-proline 0 N--CA 1.472 0.628 0 N-CA-C 113.828 1.048 . . . . 1.6699999999999999 113.828 -138.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -63.65 -39.17 36.46 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.312 2.675 . . . . 2.9300000000000002 113.131 179.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.2 tp -71.29 -49.98 37.27 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.136 1.335 . . . . 4.0300000000000002 111.423 -177.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -63.55 -37.57 87.83 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.546 0.738 . . . . 5.3899999999999997 109.868 -177.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -67.53 -35.71 79.6 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 120.878 -1.139 . . . . 4.8700000000000001 112.55 171.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.16 -41.7 85.57 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.832 1.196 . . . . 1.4099999999999999 112.428 173.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.4 mt -62.74 -44.6 95.77 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.154 1.382 . . . . 1.76 110.211 172.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 68.4 m -53.45 -50.98 64.13 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.444 1.097 . . . . 1.6599999999999999 110.649 172.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 99.2 m -56.08 -48.96 75.11 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.727 0.811 . . . . 1.55 110.866 175.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 40.3 ttm -60.85 -45.85 92.9 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.99 1.316 . . . . 2.9500000000000002 112.432 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.3 t -62.65 -41.15 91.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 126.157 1.783 . . . . 2.1000000000000001 110.021 175.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 88.2 m -64.37 -50.7 66.67 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 124.24 1.016 . . . . 0.83999999999999997 111.138 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.3 p -63.66 -36.67 84.62 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.153 0.888 . . . . 2.1600000000000001 110.603 174.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -66.05 -53.18 41.6 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.328 -0.549 . . . . 2.3599999999999999 111.094 -177.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -69.81 -37.24 76.19 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.073 -1.017 . . . . 3.9300000000000002 112.887 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -70.74 -48.48 54.25 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 119.637 1.108 . . . . 4.0999999999999996 112.355 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -69.56 -23.54 63.57 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.17 0.896 . . . . 2.3799999999999999 111.601 172.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.0 t -64.5 -21.37 66.66 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 120.126 1.33 . . . . 2.0699999999999998 112.973 169.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.9 -3.76 79.62 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.128 1.347 . . . . 1.6399999999999999 114.946 174.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -67.11 -33.4 75.39 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.723 1.762 . . . . 5.1200000000000001 111.871 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -146.89 141.01 26.11 Favored 'General case' 0 C--O 1.249 1.03 0 C-N-CA 125.039 1.336 . . . . 3.9199999999999999 111.096 -178.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 45.53 -124.3 6.69 Favored Glycine 0 C--N 1.338 0.689 0 C-N-CA 126.232 1.873 . . . . 2.9900000000000002 112.131 165.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.4 m -41.77 114.33 0.52 Allowed 'General case' 0 C--O 1.245 0.857 0 C-N-CA 125.643 1.577 . . . . 2.6899999999999999 111.949 173.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 44.7 mtpt -86.75 109.94 19.58 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.518 1.527 . . . . 4.75 107.648 151.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.8 mt 152.03 -61.12 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 130.971 3.709 . . . . 3.8100000000000001 107.431 -164.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.3 p -111.64 160.07 17.58 Favored 'General case' 0 C--O 1.246 0.918 0 C-N-CA 127.022 2.129 . . . . 1.02 112.685 -171.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.2 mt -92.15 108.31 19.85 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 114.285 -1.325 . . . . 1.72 108.382 160.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.85 162.48 24.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.25 0.547 . . . . 2.1099999999999999 111.908 167.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.1 tpt85 -45.87 -27.69 0.93 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 127.682 2.393 . . . . 3.3500000000000001 114.829 -169.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.1 -28.89 12.07 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.552 1.141 . . . . 4.9699999999999998 113.244 177.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -58.0 -50.06 74.69 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.455 0.702 . . . . 2.6099999999999999 109.288 171.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.3 tp -62.42 -51.31 68.03 Favored 'General case' 0 C--N 1.344 0.369 0 C-N-CA 123.709 0.804 . . . . 2.1400000000000001 111.223 175.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.3 ttmm -55.77 -38.84 70.42 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 118.547 0.612 . . . . 3.4100000000000001 112.261 -176.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -70.79 -41.8 71.18 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 117.724 -1.132 . . . . 3.7599999999999998 113.228 176.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.02 -54.09 50.07 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.709 1.604 . . . . 2.3199999999999998 111.065 177.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.7 mt -53.25 -47.39 56.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 CA-C-O 122.167 0.984 . . . . 0.81000000000000005 109.221 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -67.59 -8.49 34.76 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 125.246 1.418 . . . . 5.6699999999999999 113.522 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -94.22 -50.33 5.32 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 119.848 -1.782 . . . . 3.6200000000000001 110.646 160.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 73.5 tt0 -52.25 -65.79 0.5 Allowed 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 128.999 2.92 . . . . 4.6200000000000001 111.862 -171.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -77.81 115.61 17.69 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 125.777 1.631 . . . . 2.2799999999999998 108.397 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 21.6 p -83.24 1.1 42.52 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.988 1.107 . . . . 5.9900000000000002 113.988 171.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -150.54 -172.56 4.22 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.07 0.948 . . . . 4.04 112.7 -155.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.71 9.1 50.8 Favored Glycine 0 N--CA 1.472 1.099 0 C-N-CA 124.207 0.908 . . . . 4.9800000000000004 114.996 170.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 54.32 32.61 16.65 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.431 1.492 . . . . 6.1100000000000003 112.703 -169.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.87 23.85 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.034 1.734 . . . . 2.8100000000000001 114.899 -177.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.0 mtpt -78.94 -168.09 1.34 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 127.895 2.478 . . . . 5.0899999999999999 112.133 -175.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -44.5 -62.32 1.23 Allowed 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 116.649 2.092 . . . . 4.8600000000000003 116.649 -161.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.6 t -71.77 -25.44 62.03 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.592 1.087 . . . . 2.4900000000000002 112.788 -175.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.3 m -68.41 -21.53 64.67 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.025 1.33 . . . . 2.7400000000000002 112.045 174.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 81.8 mt -80.9 -31.75 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 123.857 0.863 . . . . 1.51 111.939 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -73.56 -33.03 64.48 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.762 1.165 . . . . 3.5899999999999999 113.67 -174.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -70.77 -40.86 72.38 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 118.708 0.685 . . . . 2.3700000000000001 111.185 163.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.12 -47.82 82.12 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 118.474 -0.774 . . . . 1.8 110.296 178.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.5 mtp -53.42 -50.27 65.56 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 120.114 1.325 . . . . 2.2200000000000002 111.332 177.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.65 -35.11 67.99 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.245 1.418 . . . . 3.5099999999999998 113.064 174.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.7 m -84.58 -32.71 23.64 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.949 1.3 . . . . 3.27 112.656 -175.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 88.8 mt -76.34 -46.93 25.29 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 125.848 1.659 . . . . 2.5600000000000001 112.271 175.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -70.31 141.18 52.37 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.842 1.657 . . . . 1.6100000000000001 112.984 -172.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -112.44 -26.29 8.78 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 126.295 1.838 . . . . 3.7999999999999998 113.468 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.28 -23.02 57.35 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 120.349 1.431 . . . . 2.4300000000000002 111.652 175.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.8 t 70.53 41.64 0.94 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.701 2.4 . . . . 2.23 111.862 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -116.09 -117.24 0.32 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.94 1.296 . . . . 3.0600000000000001 109.249 -160.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -146.63 -10.35 0.47 Allowed 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 116.269 1.951 . . . . 4.4800000000000004 116.269 163.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -105.99 140.01 39.66 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 127.682 2.393 . . . . 2.75 110.937 177.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.2 mm -94.24 112.93 27.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 113.018 -1.901 . . . . 1.1699999999999999 109.938 177.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -61.21 157.08 16.98 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.674 1.19 . . . . 3.5099999999999998 111.01 163.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.76 -27.74 60.04 Favored 'General case' 0 CA--C 1.553 1.063 0 O-C-N 120.518 -1.364 . . . . 2.0899999999999999 111.697 164.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -69.93 -38.81 76.32 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.32 1.848 . . . . 3.7400000000000002 111.983 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 64.4 mt-10 -73.16 -51.86 16.31 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.761 1.624 . . . . 1.6699999999999999 109.246 173.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -49.98 -32.36 14.86 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.647 1.579 . . . . 2.1000000000000001 113.289 174.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.1 m -62.3 -30.81 71.41 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.466 -1.396 . . . . 1.6499999999999999 113.743 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.6 m -79.71 -25.05 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 CA-C-N 120.897 1.68 . . . . 2.5099999999999998 112.282 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -65.72 -64.07 0.95 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.329 0.651 . . . . 1.8700000000000001 111.279 172.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -53.82 -44.83 70.55 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 125.319 1.447 . . . . 2.4700000000000002 111.139 -178.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 48.6 m -59.2 -41.41 88.46 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 118.233 -0.889 . . . . 1.04 113.082 176.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 67.1 mtm -64.24 -36.04 82.8 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.12 1.327 . . . . 1.9399999999999999 112.204 175.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 78.3 mt -64.77 -43.65 92.58 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 118.866 0.757 . . . . 1.3799999999999999 111.752 173.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 79.8 m -58.57 -42.43 87.96 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 112.903 0.705 . . . . 1.9399999999999999 112.903 171.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 80.2 mtp -64.42 -32.97 74.81 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.687 0.676 . . . . 2.1499999999999999 112.559 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.09 -43.51 57.42 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.769 1.168 . . . . 0.81000000000000005 112.514 173.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -61.47 -31.82 71.8 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.298 0.954 . . . . 2.4399999999999999 113.152 175.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -57.41 -49.68 75.42 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.572 0.749 . . . . 1.97 112.866 169.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.93 -32.68 65.46 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.149 0.58 . . . . 3.3999999999999999 111.697 -174.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.81 -48.65 79.11 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.388 1.475 . . . . 2.48 111.152 166.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -63.65 -36.59 84.32 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.551 1.54 . . . . 2.7200000000000002 111.959 176.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 19.8 mt -72.33 -13.05 61.39 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.635 1.174 . . . . 1.99 114.029 -178.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -93.87 -1.75 54.37 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 114.782 1.401 . . . . 3.6699999999999999 114.782 168.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 16.6 t70 . . . . . 0 CA--C 1.543 0.682 0 C-N-CA 124.11 0.964 . . . . 4.4100000000000001 110.568 165.408 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 64.3 p . . . . . 0 N--CA 1.469 0.518 0 N-CA-C 111.797 0.295 . . . . 2.02 111.797 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -66.39 -9.16 22.94 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.507 2.138 . . . . 1.5600000000000001 112.576 165.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tt -75.45 -58.64 3.16 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.186 -1.388 . . . . 2.7200000000000002 109.586 169.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -48.1 -52.39 20.6 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.864 1.211 . . . . 4.3499999999999996 110.613 170.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 2.2 tptm -64.7 -31.69 73.02 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 113.645 0.98 . . . . 4.3700000000000001 113.645 -175.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.34 -31.29 72.4 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.775 0.83 . . . . 1.01 112.418 170.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 22.3 mt -75.15 -34.62 61.64 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.818 0.735 . . . . 1.8200000000000001 111.255 173.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.4 m -59.52 -46.67 88.18 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.326 0.65 . . . . 1.4099999999999999 110.959 166.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 30.1 m -60.56 -42.0 95.72 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.921 1.289 . . . . 1.6599999999999999 111.463 174.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 41.6 ttm -57.66 -49.98 74.67 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.372 0.669 . . . . 2.8999999999999999 111.331 172.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 10.5 t -59.52 -35.9 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 124.675 1.19 . . . . 1.7 112.389 174.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 89.0 m -65.68 -47.75 74.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.72 1.608 . . . . 0.80000000000000004 111.819 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.55 -50.21 73.85 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.769 0.713 . . . . 1.79 109.579 167.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -62.19 -46.01 90.83 Favored 'General case' 0 N--CA 1.463 0.218 0 O-C-N 124.192 0.933 . . . . 2.4100000000000001 111.489 -164.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -74.23 -34.77 63.76 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.131 0.789 . . . . 2.5600000000000001 113.131 176.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 16.6 ttmm -69.8 -23.96 63.41 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.021 -1.049 . . . . 4.5300000000000002 113.218 177.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 49.4 m-85 -77.73 -39.61 43.88 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.59 1.156 . . . . 2.0499999999999998 112.235 160.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 17.5 t -59.78 -19.23 49.23 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 116.032 1.864 . . . . 1.8300000000000001 116.032 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.85 -13.3 83.56 Favored Glycine 0 CA--C 1.54 1.649 0 CA-C-O 118.759 -1.023 . . . . 1.53 114.803 170.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -86.67 73.81 9.96 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.067 1.934 . . . . 5.4000000000000004 110.83 176.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 88.72 -178.16 0.02 OUTLIER 'General case' 0 C--O 1.247 0.946 0 C-N-CA 127.378 2.271 . . . . 3.0099999999999998 111.624 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.51 -150.54 21.08 Favored Glycine 0 C--N 1.339 0.718 0 C-N-CA 124.994 1.283 . . . . 2.1600000000000001 111.538 -177.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 2.3 m -80.3 170.15 16.79 Favored 'General case' 0 C--O 1.251 1.155 0 O-C-N 121.967 -0.725 . . . . 3.2999999999999998 111.412 166.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 61.5 mttt -63.9 162.48 13.68 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 125.082 1.353 . . . . 7.1699999999999999 109.5 144.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 9.3 tp 66.61 -24.77 0.11 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.702 2.001 . . . . 3.46 114.486 -174.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 57.7 p -110.01 152.85 25.4 Favored 'General case' 0 C--O 1.245 0.845 0 C-N-CA 124.445 1.098 . . . . 1.28 113.673 178.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 51.9 mt -107.48 99.22 8.75 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.868 -1.06 . . . . 1.71 110.717 163.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 35.0 t -55.67 160.16 2.66 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.578 1.151 . . . . 1.8200000000000001 113.381 161.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -45.59 -24.77 0.37 Allowed 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 117.302 2.334 . . . . 3.8100000000000001 117.302 -175.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.29 -50.53 5.77 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-N 120.392 1.451 . . . . 4.0199999999999996 114.096 174.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -54.64 -37.18 65.35 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.314 0.646 . . . . 2.04 110.68 179.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 49.9 tp -76.05 -47.19 25.65 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.322 0.86 . . . . 2.3399999999999999 113.322 172.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 17.4 ttmt -52.54 -47.55 66.66 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 120.693 1.588 . . . . 2.9900000000000002 110.986 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.6 tp10 -67.5 -36.0 80.24 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 116.871 -1.538 . . . . 3.7200000000000002 114.253 -178.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 tt -57.82 -54.81 42.69 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 125.672 1.589 . . . . 2.0899999999999999 111.86 173.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 mt -56.67 -39.92 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 N-CA-C 108.849 -0.797 . . . . 1.2 108.849 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 52.8 tttt -70.97 3.13 3.57 Favored 'General case' 0 CA--C 1.559 1.316 0 N-CA-C 114.7 1.37 . . . . 4.21 114.7 177.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 17.5 mmtm -112.24 -57.98 2.2 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 126.097 1.759 . . . . 3.9399999999999999 110.487 166.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . 0.663 ' HA ' HG21 ' A' ' 3' ' ' THR . 3.8 mp0 -53.5 -49.96 66.4 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.211 1.805 . . . . 4.5099999999999998 111.894 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -84.22 53.48 2.64 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 120.255 -1.528 . . . . 2.2400000000000002 111.182 176.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 13.1 t -58.81 -13.34 5.91 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.837 1.255 . . . . 3.2200000000000002 113.531 171.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.415 ' CD2' ' H ' ' B' ' 44' ' ' LEU . 2.8 mm? -48.12 -36.78 13.94 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 127.747 2.419 . . . . 2.9100000000000001 112.57 164.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.77 9.27 81.38 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.127 0.87 . . . . 2.9399999999999999 115.058 166.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -63.59 -49.12 74.63 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.218 1.009 . . . . 7.3899999999999997 110.696 170.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.92 110.64 1.61 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.74 0.816 . . . . 2.3399999999999999 112.097 172.224 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -128.57 146.7 50.77 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.444 1.498 . . . . 3.5099999999999998 109.616 172.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -6.0 -87.96 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 128.243 2.617 . . . . 3.8900000000000001 116.762 -158.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.9 m -57.59 -23.05 48.74 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.297 1.592 . . . . 3.0600000000000001 115.297 -173.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 29.2 t -66.94 -18.62 65.47 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.121 -0.987 . . . . 1.8500000000000001 113.133 173.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 13.8 mm -72.78 -37.3 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 123.923 0.889 . . . . 1.3700000000000001 110.534 171.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -80.13 -37.87 32.65 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.215 1.006 . . . . 3.9399999999999999 111.859 -170.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -67.16 -35.45 79.72 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.492 0.553 . . . . 2.2999999999999998 112.492 167.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 9.6 tt -63.64 -44.78 92.85 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 118.01 -0.995 . . . . 2.4700000000000002 111.035 171.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 26.9 mtp -56.94 -45.59 82.67 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 120.127 1.33 . . . . 2.8900000000000001 110.936 175.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.3 tttm -52.06 -38.02 55.69 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.425 1.09 . . . . 3.8500000000000001 113.001 168.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.8 t -67.36 -33.61 75.58 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 120.818 -1.176 . . . . 2.0299999999999998 112.731 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 20.6 mt -83.03 -45.52 13.94 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 120.943 -1.098 . . . . 1.8799999999999999 113.486 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -79.39 87.8 5.02 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.51 1.924 . . . . 1.8100000000000001 111.33 -156.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.88 -30.33 70.08 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 115.05 1.5 . . . . 3.1699999999999999 115.05 178.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . 0.286 0.0 OUTLIER -78.41 -22.86 47.13 Favored 'General case' 0 CA--C 1.558 1.274 0 CA-C-N 119.273 0.942 . . . . 2.6699999999999999 111.959 167.183 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 8.1 m 53.21 62.71 2.53 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 126.82 2.048 . . . . 3.4100000000000001 113.146 175.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -141.05 -60.53 0.49 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 118.512 -0.756 . . . . 2.6200000000000001 112.171 -140.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 161.73 -35.81 0.0 OUTLIER 'General case' 0 C--N 1.345 0.374 0 C-N-CA 131.511 3.924 . . . . 6.3300000000000001 115.004 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -106.87 135.85 47.7 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 126.358 1.863 . . . . 2.29 108.888 -178.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . 0.43 ' HA ' ' OE1' ' B' ' 71' ' ' GLU 0.257 14.6 mt -99.7 109.85 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.599 0.76 . . . . 1.27 111.47 169.98 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . 0.433 ' HB2' ' H ' ' B' ' 71' ' ' GLU . 41.1 m-20 -54.23 153.44 5.25 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.491 1.916 . . . . 3.6099999999999999 111.049 166.198 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.33 -35.13 62.37 Favored 'General case' 0 CA--C 1.552 1.03 0 O-C-N 120.533 -1.354 . . . . 2.1800000000000002 110.942 165.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.471 ' HE3' ' HA ' ' B' ' 70' ' ' LYS . 0.1 OUTLIER -70.19 -35.81 74.19 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 120.548 -1.345 . . . . 7.0199999999999996 113.122 176.965 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . 0.433 ' H ' ' HB2' ' B' ' 68' ' ' ASP . 57.1 mt-10 -65.03 -51.23 62.71 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 119.143 0.883 . . . . 1.71 108.734 168.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -56.8 -32.78 66.02 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 120.396 -1.44 . . . . 1.8999999999999999 113.898 -177.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 63.9 p -57.45 -21.95 40.31 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 119.748 -1.845 . . . . 1.99 114.466 171.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 59.6 t -64.94 -36.88 78.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 119.71 1.141 . . . . 1.6000000000000001 111.547 171.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -61.83 -47.26 85.87 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.809 0.843 . . . . 1.5800000000000001 109.86 173.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 47.1 mt -58.54 -50.53 73.46 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 117.406 -1.283 . . . . 1.74 110.698 178.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 98.6 m -58.66 -46.92 86.13 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.983 1.265 . . . . 1.0700000000000001 111.333 176.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 59.1 ttp -58.01 -47.74 82.14 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.547 0.739 . . . . 2.6400000000000001 112.321 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 94.4 mt -69.84 -46.75 64.92 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.869 0.692 . . . . 1.4299999999999999 112.869 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.76 -33.79 76.45 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.503 1.047 . . . . 1.53 111.646 -178.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 61.5 mtp -75.11 -30.39 60.84 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 118.054 -0.974 . . . . 2.21 113.1 172.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.0 -39.46 94.16 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 120.7 1.591 . . . . 1.1100000000000001 111.863 171.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -67.98 -13.08 61.9 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.491 1.293 . . . . 2.3100000000000001 114.491 173.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -69.43 -45.53 68.92 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.268 0.94 . . . . 2.98 111.912 170.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.0 -44.13 93.57 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.108 1.763 . . . . 3.71 111.643 174.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -54.26 -45.27 72.35 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.646 1.578 . . . . 2.1000000000000001 112.242 175.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -66.23 -27.33 67.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.756 1.223 . . . . 3.2999999999999998 112.804 176.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 49.0 mt -74.32 -21.62 59.63 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 120.893 -1.129 . . . . 2.1200000000000001 112.235 175.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -88.8 3.21 51.85 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.488 1.515 . . . . 3.4100000000000001 114.411 168.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -92.89 -46.2 7.62 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.74 1.216 . . . . 4.5099999999999998 111.027 162.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.35 20.73 0.52 Allowed 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 125.29 1.436 . . . . 4.3099999999999996 114.234 -178.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.256 1.444 0 C-N-CA 128.06 2.544 . . . . 4.7599999999999998 117.736 -166.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 . . . . . 0 CA--C 1.542 0.646 0 CA-C-O 123.463 1.601 . . . . 4.0499999999999998 109.26 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.498 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 6.2 p -99.12 175.54 2.4 Favored Pre-proline 0 C--N 1.316 -0.864 1 C-N-CA 132.644 4.378 . . . . 2.1200000000000001 111.011 -151.71 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.498 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 74.4 Cg_endo -77.07 -29.91 4.78 Favored 'Trans proline' 0 C--N 1.351 0.668 0 CA-C-N 121.076 1.42 . . . . 1.5800000000000001 112.886 -168.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 18.0 tp -85.71 -39.2 17.46 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 117.007 -1.473 . . . . 2.6000000000000001 112.519 -174.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -58.28 -37.93 75.98 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 120.487 1.494 . . . . 4.6799999999999997 109.915 172.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 ttmp? -65.41 -39.1 91.76 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.532 1.133 . . . . 3.5600000000000001 112.663 171.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.71 -40.66 69.32 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.043 0.937 . . . . 0.91000000000000003 113.106 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.3 mt -62.34 -42.78 99.67 Favored 'General case' 0 C--O 1.238 0.486 0 O-C-N 121.286 -0.884 . . . . 1.73 109.969 170.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 92.5 m -56.05 -44.35 78.77 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 117.042 -1.456 . . . . 1.5 110.748 170.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.0 m -56.54 -52.13 65.96 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 121.481 1.946 . . . . 1.48 112.329 178.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.08 -29.08 69.93 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 113.994 1.109 . . . . 3.0299999999999998 113.994 178.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 80.2 t -76.19 -32.22 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 123.954 0.901 . . . . 2.6299999999999999 112.741 171.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 56.8 m -61.34 -55.37 32.44 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.423 1.489 . . . . 0.85999999999999999 110.176 175.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.33 -25.26 64.12 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.862 1.265 . . . . 2.6200000000000001 111.504 -177.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -59.77 -37.65 79.64 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.256 -0.902 . . . . 1.7 111.675 167.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -76.99 -27.9 54.89 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 120.196 -1.565 . . . . 2.0499999999999998 112.954 175.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -56.44 -59.62 4.71 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.725 1.148 . . . . 5.4000000000000004 110.715 164.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -86.51 -45.71 10.85 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 114.298 1.222 . . . . 2.1400000000000001 114.298 -167.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.3 m -67.02 -31.03 71.3 Favored 'General case' 0 C--O 1.249 1.056 0 CA-C-N 120.605 1.548 . . . . 3.27 111.362 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.39 2.07 88.21 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 126.873 2.178 . . . . 1.6799999999999999 114.582 173.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.4 ttt85 -74.69 -46.08 40.18 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.749 1.775 . . . . 5.0199999999999996 111.264 175.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -133.0 147.98 52.27 Favored 'General case' 0 C--O 1.252 1.224 0 CA-C-O 122.663 1.22 . . . . 5.5199999999999996 112.845 -174.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.49 -122.96 14.07 Favored Glycine 0 C--N 1.343 0.936 0 C-N-CA 128.308 2.861 . . . . 2.3799999999999999 112.395 168.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.7 m -44.27 109.18 0.14 Allowed 'General case' 0 C--O 1.246 0.877 0 C-N-CA 125.065 1.346 . . . . 4.0700000000000003 110.995 161.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 40.4 tptt -72.71 -27.57 62.15 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.606 1.562 . . . . 5.9299999999999997 112.949 -172.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.445 ' H ' HD23 ' A' ' 27' ' ' LEU . 1.9 pt? -90.29 -17.3 27.65 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.503 1.521 . . . . 4.9299999999999997 114.253 178.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.8 p -106.26 152.6 23.31 Favored 'General case' 0 C--O 1.254 1.326 0 C-N-CA 123.921 0.888 . . . . 2.0800000000000001 111.293 178.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 12.2 mt -82.98 107.28 15.47 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 113.306 -1.77 . . . . 1.8600000000000001 106.912 148.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.2 t -66.56 162.69 20.34 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.552 -0.717 . . . . 2.0800000000000001 109.969 162.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -46.74 -36.62 7.42 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.89 1.223 . . . . 3.3900000000000001 113.226 -177.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -79.74 -30.79 40.95 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 120.728 -1.233 . . . . 5.79 113.858 177.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -69.36 -33.95 73.84 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.867 1.212 . . . . 1.5700000000000001 110.887 170.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -64.75 -53.47 46.64 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.606 1.162 . . . . 3.1699999999999999 109.597 174.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.1 mttm -50.87 -47.15 60.52 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.406 -0.809 . . . . 4.1699999999999999 112.49 170.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -53.91 -66.72 0.34 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.575 1.55 . . . . 3.2599999999999998 112.257 173.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.4 tp -49.09 -51.38 31.97 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.571 1.948 . . . . 2.0699999999999998 111.466 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 84.2 mt -61.21 -57.83 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 N-CA-C 109.321 -0.622 . . . . 1.21 109.321 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -60.53 -30.99 70.1 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 121.491 -0.755 . . . . 4.0499999999999998 112.399 -174.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.2 mmtm -76.11 -57.95 3.57 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.25 1.82 . . . . 3.6299999999999999 112.761 176.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -108.66 6.6 25.95 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 113.519 0.933 . . . . 6.25 113.519 -163.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.8 mt -142.91 50.21 1.44 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 127.557 2.343 . . . . 3.6099999999999999 108.171 168.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 24.7 t -73.19 51.34 0.31 Allowed 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 127.394 2.278 . . . . 3.75 115.9 -166.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -86.74 151.62 23.23 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.579 -1.325 . . . . 4.1100000000000003 111.67 178.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.11 -23.51 73.03 Favored Glycine 0 N--CA 1.48 1.625 0 N-CA-C 116.219 1.248 . . . . 3.21 116.219 -167.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -98.26 0.69 46.16 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.558 1.143 . . . . 6.3300000000000001 112.37 174.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.9 tpt -82.65 78.38 9.28 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.679 1.591 . . . . 2.0699999999999998 107.808 171.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.8 ttpt -143.87 167.9 21.21 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.849 1.66 . . . . 4.0700000000000003 110.577 -151.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -60.67 -42.37 96.92 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 119.44 -2.037 . . . . 3.6699999999999999 114.504 -161.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.9 m -72.37 -3.78 26.07 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.268 1.581 . . . . 3.1600000000000001 115.268 176.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.8 p -109.3 -34.81 6.45 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.688 1.131 . . . . 2.0600000000000001 112.106 166.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.1 mt -76.29 -38.98 34.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.409 1.484 . . . . 1.55 113.498 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -71.02 -34.46 71.34 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 120.114 1.324 . . . . 2.5899999999999999 112.898 -173.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -87.42 -26.34 23.34 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.815 1.646 . . . . 4.7800000000000002 113.068 175.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 62.3 tp -59.24 -44.57 92.35 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 118.312 -0.852 . . . . 2.2000000000000002 109.846 158.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -48.18 81.35 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 119.795 1.18 . . . . 1.8 110.06 179.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.2 mttp -58.11 -33.26 68.92 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.123 0.969 . . . . 5.6799999999999997 113.172 172.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.8 t -79.17 -27.02 42.65 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 114.368 1.247 . . . . 1.8300000000000001 114.368 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.5 mt -81.56 -25.87 35.49 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.734 2.014 . . . . 2.1299999999999999 111.373 174.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.517 ' C ' ' HE2' ' A' ' 61' ' ' LYS . 36.8 t0 -69.12 120.65 15.3 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.478 1.111 . . . . 1.8600000000000001 109.748 166.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.534 ' HE3' HG11 ' A' ' 74' ' ' VAL . 0.8 OUTLIER -84.38 6.3 23.74 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 119.909 -1.745 . . . . 3.23 114.29 -172.635 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -153.03 -86.06 0.07 Allowed 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 124.83 1.252 . . . . 3.3399999999999999 110.516 -170.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.0 m 156.82 92.73 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 130.191 3.396 . . . . 2.3700000000000001 108.004 -174.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.3 p30 -152.23 -6.45 0.22 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.976 1.31 . . . . 2.21 113.399 -177.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 63.91 1.71 1.2 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 128.238 2.615 . . . . 4.3799999999999999 114.288 -170.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -106.19 138.3 42.62 Favored 'General case' 0 C--O 1.246 0.872 0 C-N-CA 127.319 2.248 . . . . 3.3599999999999999 110.435 178.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 41.2 mm -103.85 98.37 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 113.709 -1.587 . . . . 1.1899999999999999 107.894 159.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.99 157.33 25.36 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.612 1.165 . . . . 2.73 111.64 163.583 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -55.95 -25.26 42.73 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 115.159 1.54 . . . . 2.6000000000000001 115.159 -178.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 mtmp? -87.35 -35.17 18.53 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 117.267 -1.349 . . . . 3.4300000000000002 111.893 170.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.421 ' O ' HG12 ' A' ' 74' ' ' VAL . 40.1 mt-10 -54.2 -49.84 68.44 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 120.382 1.446 . . . . 1.98 108.979 166.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -49.93 -32.3 14.48 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 128.09 2.556 . . . . 2.7000000000000002 114.953 -178.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 72.5 p -57.93 -27.4 63.34 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.041 -1.037 . . . . 2.5 112.809 174.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.534 HG11 ' HE3' ' A' ' 61' ' ' LYS . 2.0 p -73.99 -30.0 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.217 -0.927 . . . . 2.3500000000000001 112.015 179.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -64.98 -49.96 68.24 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.944 -0.762 . . . . 1.9199999999999999 108.944 169.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.0 mt -61.04 -36.6 79.99 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.177 0.591 . . . . 2.0600000000000001 111.695 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.2 m -59.99 -53.16 61.12 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.714 1.206 . . . . 1.05 111.402 174.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.9 mtm -66.94 -37.64 84.69 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 119.121 -0.466 . . . . 1.8899999999999999 112.192 -177.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 92.9 mt -60.53 -47.52 85.82 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 119.095 -0.479 . . . . 1.8899999999999999 111.331 171.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 19.6 m -55.47 -39.79 70.84 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.691 0.796 . . . . 2.0 112.795 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 36.1 mtp -70.12 -33.54 71.95 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 119.003 -0.523 . . . . 1.8899999999999999 112.235 176.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.53 -46.76 68.69 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 119.211 0.914 . . . . 0.95999999999999996 113.176 -178.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -68.34 -24.25 64.79 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.333 -0.854 . . . . 2.9300000000000002 112.613 175.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -71.8 -33.37 68.5 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 114.036 1.124 . . . . 1.78 114.036 174.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.0 -32.27 51.08 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.131 0.572 . . . . 3.1000000000000001 111.324 179.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -54.73 29.33 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.804 0.842 . . . . 2.3399999999999999 110.782 161.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -59.22 -14.96 12.58 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.277 1.431 . . . . 2.3199999999999998 113.89 177.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 41.0 mt -90.42 -12.54 37.15 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 117.273 -1.346 . . . . 2.04 114.624 172.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -102.41 -38.28 7.66 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.738 1.215 . . . . 2.8399999999999999 113.931 167.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 . . . . . 0 N--CA 1.474 0.76 0 C-N-CA 126.274 1.829 . . . . 4.1200000000000001 113.287 -177.222 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 119.211 -0.423 . . . . 2.6200000000000001 111.792 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -63.54 -26.62 69.73 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 121.643 1.562 . . . . 2.27 112.94 178.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.91 -37.71 39.23 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.174 0.897 . . . . 2.8799999999999999 111.08 174.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -58.76 -42.04 87.98 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.314 0.961 . . . . 3.9300000000000002 111.369 170.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -62.56 -36.69 83.44 Favored 'General case' 0 N--CA 1.463 0.188 0 O-C-N 121.433 -0.792 . . . . 3.9900000000000002 111.714 176.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.29 -47.12 71.56 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 118.937 0.789 . . . . 1.2 112.554 172.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -55.84 -50.0 71.75 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.769 1.628 . . . . 2.7400000000000002 113.346 173.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 22.0 p -66.95 -35.91 81.04 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 117.461 -1.257 . . . . 2.1600000000000001 110.821 178.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 95.9 m -59.59 -43.41 93.68 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 119.688 1.131 . . . . 1.5600000000000001 110.641 170.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -60.58 -55.08 37.63 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.073 0.549 . . . . 3.8199999999999998 111.248 175.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 51.7 t -58.33 -31.79 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 CA-C-N 118.698 0.681 . . . . 1.95 111.879 178.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 92.5 m -65.73 -57.6 7.64 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 117.614 -1.184 . . . . 1.05 110.876 175.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.7 p -57.04 -37.55 71.93 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 119.744 1.157 . . . . 1.9099999999999999 111.611 175.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -66.8 -57.9 6.13 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 123.661 0.601 . . . . 1.98 109.969 -176.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.23 -33.62 67.69 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.65 -0.656 . . . . 2.1800000000000002 112.67 -175.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -64.55 -34.38 78.11 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.585 1.084 . . . . 5.3600000000000003 112.198 174.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -85.85 -30.11 23.2 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.077 0.853 . . . . 2.1299999999999999 111.833 176.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 35.3 t -69.45 -25.6 64.18 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 114.206 1.187 . . . . 1.6599999999999999 114.206 174.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.66 12.19 67.87 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.853 1.692 . . . . 2.0600000000000001 114.702 172.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -75.66 -36.73 60.05 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 118.757 1.278 . . . . 4.9699999999999998 111.935 172.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -157.34 156.87 33.07 Favored 'General case' 0 C--O 1.248 0.985 0 CA-C-O 121.637 0.732 . . . . 2.9900000000000002 111.519 -163.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.94 -128.13 46.46 Favored Glycine 0 C--N 1.338 0.689 0 N-CA-C 109.185 -1.566 . . . . 2.4300000000000002 109.185 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 38.7 m -79.02 153.51 30.21 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-O 122.345 1.069 . . . . 3.3500000000000001 111.975 164.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -57.3 174.18 0.21 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 115.174 -0.921 . . . . 7.46 110.669 142.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 23.6 mt 73.34 -56.99 0.64 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.603 1.561 . . . . 3.2400000000000002 109.405 -169.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 40.6 p -103.38 146.65 28.16 Favored 'General case' 0 C--O 1.255 1.367 0 N-CA-C 115.863 1.801 . . . . 1.1899999999999999 115.863 -170.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 64.9 mt -102.44 103.46 13.85 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 128.484 2.714 . . . . 1.8500000000000001 111.601 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.5 p -65.77 170.76 4.92 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 115.111 1.522 . . . . 2.7799999999999998 115.111 178.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . 0.417 ' HD2' ' SD ' ' B' ' 56' ' ' MET . 10.7 tpt180 -47.6 -11.41 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 128.147 2.579 . . . . 5.0800000000000001 115.659 167.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.43 -47.91 3.14 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.812 1.245 . . . . 4.3099999999999996 112.275 168.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -52.91 -38.45 61.83 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.743 0.817 . . . . 2.29 111.428 179.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.498 HD23 ' HG2' ' B' ' 56' ' ' MET . 7.6 tp -71.9 -45.66 60.44 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.605 0.762 . . . . 2.21 112.539 178.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -71.58 -37.19 71.04 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 120.609 -1.307 . . . . 5.21 111.145 -176.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -54.24 -52.15 62.27 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.157 1.383 . . . . 2.8799999999999999 111.982 164.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 42.9 tp -58.24 -53.17 61.32 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.988 1.267 . . . . 1.99 112.376 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 27.4 mt -54.64 -55.07 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 N-CA-C 109.131 -0.692 . . . . 1.22 109.131 176.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -68.2 -11.84 59.94 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.08 1.141 . . . . 4.2000000000000002 114.08 -173.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 12.8 mmtp -92.59 -29.64 16.05 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 125.057 1.343 . . . . 3.8900000000000001 114.034 178.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -100.28 -49.93 4.1 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.635 0.774 . . . . 5.7400000000000002 111.733 177.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -81.1 56.19 2.74 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.857 1.263 . . . . 2.3900000000000001 110.383 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 72.3 m -79.24 -7.31 58.17 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.382 1.473 . . . . 3.79 113.432 176.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.4 HD23 ' H ' ' B' ' 44' ' ' LEU . 1.8 pt? -83.94 137.56 33.58 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.847 1.259 . . . . 2.7200000000000002 112.015 -176.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.1 -108.14 2.44 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.414 -0.674 . . . . 3.8799999999999999 111.414 178.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -169.08 118.46 0.68 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.08 1.752 . . . . 5.7699999999999996 106.947 -174.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.66 -13.61 60.04 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 122.231 1.015 . . . . 3.8199999999999998 112.871 -173.026 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.4 mtpp 71.93 45.8 0.39 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 128.123 2.569 . . . . 5.1900000000000004 110.215 170.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . 0.268 7.3 pt-20 -63.4 2.96 0.34 Allowed 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 119.893 3.294 . . . . 4.1900000000000004 119.893 -138.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 29.4 t -53.47 -29.92 38.25 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 119.129 -2.232 . . . . 2.7999999999999998 111.488 149.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 8.6 t -68.63 -15.38 63.51 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.041 1.336 . . . . 2.6200000000000001 114.003 171.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 5.9 mm -68.96 -21.68 25.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 CA-C-N 120.512 1.506 . . . . 2.1600000000000001 111.461 173.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -77.36 -44.79 28.15 Favored 'General case' 0 C--O 1.224 -0.247 0 N-CA-C 113.754 1.02 . . . . 3.4399999999999999 113.754 164.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.35 -30.86 66.68 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.422 1.465 . . . . 2.54 114.086 -178.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -51.81 -39.45 58.75 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 117.997 -1.001 . . . . 2.5299999999999998 110.399 162.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . 0.498 ' HG2' HD23 ' B' ' 34' ' ' LEU . 23.1 mtp -63.32 -55.74 22.17 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-O 116.912 -1.518 . . . . 2.6099999999999999 112.383 173.259 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -61.13 -32.78 72.47 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 122.238 2.29 . . . . 4.4500000000000002 112.995 -175.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 21.2 m -72.49 -42.68 64.61 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.142 1.377 . . . . 2.1099999999999999 112.183 177.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 8.8 mp -74.41 -31.89 62.48 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 117.992 -1.004 . . . . 2.7200000000000002 112.858 173.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -108.4 56.06 0.63 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 128.568 2.747 . . . . 1.99 110.863 178.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . 0.583 ' H ' ' HE2' ' B' ' 61' ' ' LYS . 0.0 OUTLIER -58.17 -19.7 35.19 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 115.453 1.649 . . . . 3.2799999999999998 115.453 -173.536 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -89.34 -6.61 56.54 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.121 1.526 . . . . 1.77 115.121 173.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 57.8 m 63.06 22.96 13.72 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.903 1.681 . . . . 2.0800000000000001 114.635 174.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 37.0 p30 -89.8 -2.33 58.2 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.505 1.122 . . . . 2.8999999999999999 111.913 177.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 74.71 -31.41 0.21 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 129.935 3.294 . . . . 4.1900000000000004 114.559 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -73.41 135.55 44.21 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 122.629 1.204 . . . . 2.5600000000000001 110.188 176.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 77.9 mt -124.42 106.23 16.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 124.8 1.24 . . . . 1.5 108.551 -176.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -90.23 160.96 15.92 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 127.043 2.137 . . . . 3.71 109.919 165.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -39.18 -42.56 0.98 Allowed 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.985 1.714 . . . . 2.4399999999999999 113.892 170.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -80.16 -10.56 59.77 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.182 0.993 . . . . 4.0099999999999998 113.471 -171.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -91.08 -47.3 7.63 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.3 1.04 . . . . 1.8999999999999999 109.509 161.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -63.57 -28.06 69.67 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 129.083 2.953 . . . . 2.71 115.546 -171.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 13.4 p -54.48 -24.04 18.73 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.674 -1.266 . . . . 2.2000000000000002 113.033 175.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 p -58.1 -34.82 50.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 N-CA-C 113.009 0.744 . . . . 2.7000000000000002 113.009 171.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -66.3 -51.27 58.98 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.015 1.326 . . . . 1.6499999999999999 109.972 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 28.9 mt -61.16 -43.2 99.25 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.764 0.825 . . . . 1.48 110.123 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 24.1 m -57.49 -51.45 69.4 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.41 1.084 . . . . 1.1499999999999999 111.469 176.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 3.8 mmm -56.97 -44.7 82.88 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.568 0.747 . . . . 2.54 112.638 178.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 96.8 mt -68.23 -43.31 78.22 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.604 0.762 . . . . 1.45 111.668 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 80.0 m -61.64 -33.0 73.18 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.274 -0.891 . . . . 1.6000000000000001 112.554 175.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 41.1 mtp -69.14 -37.91 78.53 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.163 0.892 . . . . 2.8500000000000001 112.925 171.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.54 -46.34 88.84 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.207 0.912 . . . . 1.24 112.121 174.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -64.62 -27.72 69.13 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.094 1.146 . . . . 2.4500000000000002 114.094 174.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.67 -39.6 73.47 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.281 0.946 . . . . 2.4100000000000001 111.338 174.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -68.29 -40.41 81.77 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.906 0.882 . . . . 4.1799999999999997 111.475 177.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -52.68 -50.87 62.43 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.566 1.546 . . . . 2.9100000000000001 111.481 172.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -59.23 -25.72 64.26 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.256 1.422 . . . . 2.4500000000000002 113.144 -178.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 60.1 mt -77.37 -22.25 52.02 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 117.842 -1.075 . . . . 2.29 112.787 177.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -99.53 0.8 43.1 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.043 1.337 . . . . 4.1500000000000004 113.567 169.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -84.2 -36.28 22.9 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.815 1.246 . . . . 3.71 111.78 164.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -100.49 28.3 5.15 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.46 1.504 . . . . 3.2200000000000002 113.409 -170.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 3.7 ptmm? . . . . . 0 C--O 1.246 0.901 0 N-CA-C 118.011 2.597 . . . . 5.3700000000000001 118.011 -156.338 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.445 -0.724 0 N-CA-C 106.594 -1.632 . . . . 5.0800000000000001 106.594 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 75.6 p -53.17 162.78 1.02 Allowed Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 124.289 1.036 . . . . 1.6000000000000001 111.225 164.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.75 -19.49 36.1 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 121.952 1.768 . . . . 1.5 111.965 168.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -79.06 -41.41 28.84 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.977 0.911 . . . . 4.1699999999999999 112.24 178.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -58.06 -46.21 85.8 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.347 1.059 . . . . 4.0300000000000002 110.094 176.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -60.53 -31.86 70.92 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 114.078 1.14 . . . . 3.6800000000000002 114.078 172.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.14 -34.04 75.6 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.274 0.943 . . . . 1.0 111.655 -175.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 71.4 mt -57.86 -51.81 68.06 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.055 0.942 . . . . 1.9199999999999999 110.476 170.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 m -58.77 -43.84 90.5 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.026 1.331 . . . . 1.74 112.004 175.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 51.2 m -60.83 -38.78 86.63 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.668 1.587 . . . . 1.5900000000000001 110.853 178.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.86 -52.8 47.29 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.171 0.988 . . . . 3.8900000000000001 111.453 172.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t -54.73 -28.8 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 O-C-N 120.555 -1.341 . . . . 1.9199999999999999 112.503 174.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 94.4 m -68.56 -46.55 69.15 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.033 1.333 . . . . 1.3500000000000001 113.372 -177.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.0 p -69.41 -42.96 74.36 Favored 'General case' 0 CA--C 1.504 -0.817 0 CA-C-N 119.724 1.147 . . . . 2.27 108.85 172.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -60.92 -57.22 13.57 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 124.622 1.201 . . . . 2.1000000000000001 110.729 -171.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -64.76 -40.84 95.95 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 122.244 -0.285 . . . . 2.5600000000000001 110.554 -175.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -67.24 -41.74 85.16 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.359 -0.838 . . . . 3.8199999999999998 112.776 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -68.8 -37.04 78.99 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.421 1.01 . . . . 2.1000000000000001 112.297 173.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.5 m -62.71 -27.31 69.17 Favored 'General case' 0 C--O 1.25 1.114 0 N-CA-C 114.934 1.457 . . . . 2.73 114.934 172.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.29 -4.63 80.73 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 126.703 2.097 . . . . 1.3500000000000001 114.071 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -54.67 -37.37 65.66 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.395 1.598 . . . . 4.0 112.608 178.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 173.12 -155.57 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 128.858 2.863 . . . . 7.04 109.539 176.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 72.92 -142.09 31.39 Favored Glycine 0 C--N 1.336 0.582 0 C-N-CA 127.131 2.3 . . . . 2.1200000000000001 110.181 176.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.9 t -64.43 142.3 58.47 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 122.882 1.325 . . . . 2.5 110.153 149.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -97.49 137.64 36.13 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.885 1.674 . . . . 9.2100000000000009 107.609 174.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.6 mt 92.47 -31.16 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 129.219 3.008 . . . . 4.2000000000000002 111.416 -161.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.418 HG22 ' HA ' ' A' ' 68' ' ' ASP . 81.5 p -116.7 161.97 18.4 Favored 'General case' 0 C--O 1.251 1.142 0 N-CA-C 114.638 1.347 . . . . 1.55 114.638 179.071 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -120.45 102.81 8.7 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.647 1.179 . . . . 2.4199999999999999 112.162 -179.336 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.4 p -77.75 173.64 11.86 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 120.776 -1.202 . . . . 2.02 112.381 165.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -39.51 -42.86 1.19 Allowed 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 116.857 2.169 . . . . 3.4399999999999999 116.857 -163.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.57 -26.99 45.67 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 119.632 -1.917 . . . . 5.2999999999999998 114.057 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -72.95 -51.19 19.4 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 107.339 -1.356 . . . . 2.1699999999999999 107.339 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.21 -32.45 74.13 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.737 0.643 . . . . 1.96 112.737 175.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -67.13 -38.81 86.22 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 120.11 -1.619 . . . . 4.6200000000000001 112.784 173.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -64.66 -29.29 70.29 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-O 117.794 -1.098 . . . . 4.4800000000000004 113.634 171.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.1 tt -73.27 -66.79 0.64 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.203 1.401 . . . . 2.0800000000000001 112.358 177.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.9 mt -56.26 -43.94 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 124.647 1.179 . . . . 0.82999999999999996 110.525 -168.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.3 tttp -70.97 -3.85 21.64 Favored 'General case' 0 N--CA 1.439 -1.012 0 N-CA-C 113.994 1.109 . . . . 4.0899999999999999 113.994 -176.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -108.76 -21.63 12.59 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.196 1.798 . . . . 3.73 113.387 168.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -76.84 -62.08 1.76 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.855 2.062 . . . . 4.6200000000000001 110.047 178.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 60.3 mt -92.57 101.05 13.47 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.514 -1.366 . . . . 2.4300000000000002 113.241 -163.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 77.8 m -88.03 48.81 1.69 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.626 2.371 . . . . 4.2699999999999996 112.315 -169.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 38.8 mt -129.27 -1.21 5.09 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.55 1.94 . . . . 3.7799999999999998 113.791 -163.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 140.81 33.69 0.13 Allowed Glycine 0 N--CA 1.472 1.07 0 C-N-CA 125.763 1.649 . . . . 2.79 112.752 -170.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 26.78 65.08 0.08 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 130.209 3.404 . . . . 8.3300000000000001 113.355 172.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 52.1 mmm -20.82 117.27 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.797 2.439 . . . . 2.71 117.122 -158.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.3 tmtt? -48.41 122.84 5.79 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.604 1.962 . . . . 7.4000000000000004 110.297 178.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.31 -39.66 87.8 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.019 1.489 . . . . 5.0099999999999998 115.019 -157.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.2 t -76.35 -21.41 56.15 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.525 1.057 . . . . 3.4900000000000002 113.507 174.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.0 m -73.66 -9.64 58.88 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.774 -1.204 . . . . 2.71 112.527 173.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 20.1 mm -67.59 -25.96 34.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 123.608 0.763 . . . . 1.79 112.076 165.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -78.04 -46.45 20.88 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 114.223 1.194 . . . . 2.7000000000000002 114.223 -163.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.28 -33.22 73.96 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.005 0.821 . . . . 3.25 110.762 166.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 67.9 tp -61.48 -39.36 90.65 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 117.982 -1.009 . . . . 1.8700000000000001 113.33 177.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 18.0 ptm -74.94 -34.5 62.09 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 120.2 1.364 . . . . 1.8100000000000001 112.973 169.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -73.83 -23.35 59.63 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 120.781 -1.199 . . . . 6.5999999999999996 112.735 -178.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.1 t -58.43 -36.89 74.31 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.958 1.703 . . . . 2.5099999999999998 111.348 163.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.6 mt -74.17 -33.69 63.55 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.128 0.971 . . . . 2.3199999999999998 111.306 178.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -80.8 94.02 6.35 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.107 1.763 . . . . 2.52 114.131 -175.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.46 ' HZ1' HG21 ' A' ' 74' ' ' VAL . 12.0 mptt -63.02 -34.1 76.84 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.6 1.16 . . . . 3.5800000000000001 111.594 174.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.87 -34.86 51.45 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.706 1.202 . . . . 2.02 111.491 175.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.0 m 55.66 61.68 2.73 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.024 2.13 . . . . 3.79 111.509 -164.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -105.77 -55.35 2.34 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 117.399 -1.286 . . . . 2.7599999999999998 112.036 -167.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 152.29 -32.35 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.73 1 C-N-CA 133.368 4.667 . . . . 5.1600000000000001 116.091 175.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -90.87 143.5 26.66 Favored 'General case' 0 C--O 1.244 0.803 0 CA-C-O 123.079 1.419 . . . . 2.5299999999999998 108.314 169.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 35.6 mm -110.45 111.43 36.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 126.302 1.841 . . . . 1.6699999999999999 107.051 173.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.418 ' HA ' HG22 ' A' ' 28' ' ' THR . 0.0 OUTLIER -74.71 175.32 8.04 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.315 1.046 . . . . 2.9100000000000001 112.991 169.983 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -46.92 -48.56 21.3 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.122 1.369 . . . . 2.4100000000000001 113.682 170.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -80.67 -31.81 36.2 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.862 1.265 . . . . 5.6799999999999997 112.226 -171.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -55.58 -65.88 0.51 Allowed 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 123.98 0.912 . . . . 1.8 110.217 159.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -59.42 -32.6 70.33 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.26 2.224 . . . . 2.5499999999999998 114.619 -172.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 69.5 m -62.85 -14.87 51.13 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 119.909 -1.744 . . . . 2.1000000000000001 113.06 -176.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.46 HG21 ' HZ1' ' A' ' 61' ' ' LYS . 46.0 t -70.53 -24.22 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 O-C-N 120.893 -1.129 . . . . 2.04 112.418 171.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -67.16 -50.0 62.76 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.473 1.109 . . . . 1.97 110.356 171.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -56.15 -44.54 79.37 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.226 1.01 . . . . 2.27 111.411 172.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.4 m -53.43 -57.41 10.76 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 118.544 -0.741 . . . . 0.68000000000000005 111.578 174.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 14.3 ptp -66.58 -29.09 69.08 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 118.924 0.784 . . . . 1.8500000000000001 112.864 -177.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.1 mt -67.21 -50.86 59.25 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-N 119.011 0.823 . . . . 1.4399999999999999 111.44 171.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.2 m -62.18 -34.71 76.94 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 119.056 0.843 . . . . 1.8 112.151 177.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 35.5 mtp -65.56 -37.79 87.73 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.03 0.832 . . . . 1.75 112.732 172.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.38 -34.71 54.9 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 119.632 1.106 . . . . 1.01 113.152 175.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.468 ' CD2' HD11 ' B' ' 9' ' ' LEU . 0.2 OUTLIER -64.21 -28.42 69.73 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.018 0.826 . . . . 2.8300000000000001 112.993 175.618 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -56.41 -52.08 65.97 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.275 0.63 . . . . 2.1000000000000001 111.004 167.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.47 -32.96 66.65 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.094 1.357 . . . . 3.4700000000000002 112.509 -176.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -57.22 -48.94 77.53 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.476 1.51 . . . . 2.9199999999999999 110.889 170.186 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -61.41 -38.67 87.94 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.919 1.288 . . . . 2.8900000000000001 112.716 174.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.1 -20.97 64.08 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.484 0.92 . . . . 2.77 113.484 176.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -95.02 -4.49 46.41 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.513 1.301 . . . . 4.3700000000000001 114.513 172.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.9 t70 . . . . . 0 N--CA 1.473 0.724 0 C-N-CA 125.114 1.366 . . . . 3.9300000000000002 111.685 172.73 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . 0.444 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 0.2 OUTLIER . . . . . 0 CA--C 1.542 0.661 0 N-CA-C 111.99 0.367 . . . . 3.04 111.99 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . 0.444 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 42.4 Cg_endo -71.04 -16.6 32.17 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 121.966 1.778 . . . . 2.0800000000000001 115.097 -173.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -73.01 -49.68 27.47 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 120.671 1.578 . . . . 2.3599999999999999 110.038 177.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . 0.504 ' H ' ' CD ' ' B' ' 6' ' ' GLU . 18.7 mp0 -67.45 -45.47 75.91 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.244 1.818 . . . . 5.8799999999999999 108.748 -178.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.55 -36.4 69.24 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.098 1.359 . . . . 6.2199999999999998 112.699 171.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.19 -48.78 64.33 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 117.515 -1.231 . . . . 2.2599999999999998 111.197 170.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.468 HD11 ' CD2' ' A' ' 83' ' ' TYR 0.274 0.3 OUTLIER -63.15 -24.11 67.74 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.68 1.582 . . . . 3.1600000000000001 112.962 179.674 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.1 m -52.16 -34.5 45.16 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.942 0.897 . . . . 1.3600000000000001 111.992 165.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.88 -22.04 58.88 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 117.222 -1.371 . . . . 2.6299999999999999 113.169 -179.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 19.9 mtp -72.02 -44.67 63.03 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 119.685 1.13 . . . . 3.6099999999999999 111.475 175.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 2.9 m -66.05 -23.84 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 O-C-N 121.055 -1.028 . . . . 2.3999999999999999 111.273 175.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 58.7 m -75.74 -49.49 18.06 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.501 1.52 . . . . 0.93000000000000005 111.707 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.2 p -66.57 -40.24 88.87 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 119.129 0.877 . . . . 1.5600000000000001 109.605 170.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -63.02 -58.88 5.81 Favored 'General case' 0 C--O 1.224 -0.284 0 O-C-N 123.872 0.732 . . . . 2.0899999999999999 110.488 -174.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -57.81 -46.43 84.7 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 118.004 0.365 . . . . 2.5600000000000001 110.588 -175.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.74 -30.53 65.7 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.333 0.864 . . . . 5.2599999999999998 113.333 -174.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -82.19 -19.69 39.32 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.104 0.866 . . . . 2.6099999999999999 112.811 169.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 21.3 p -81.22 -27.96 35.05 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.008 1.484 . . . . 1.4099999999999999 115.008 178.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.06 -9.58 86.01 Favored Glycine 0 CA--C 1.538 1.504 0 O-C-N 120.506 -1.371 . . . . 2.3300000000000001 112.736 168.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.7 -23.16 63.39 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.136 1.774 . . . . 3.8700000000000001 113.923 -168.075 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -150.41 157.95 43.61 Favored 'General case' 0 C--O 1.245 0.852 0 C-N-CA 126.863 2.065 . . . . 4.1600000000000001 108.454 172.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.69 -3.91 0.21 Allowed Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.383 1.468 . . . . 2.8700000000000001 114.011 -170.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 8.5 t 41.66 -137.74 0.19 Allowed 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 124.877 1.271 . . . . 4.9800000000000004 112.9 -144.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . 0.316 0.0 OUTLIER 53.2 -176.15 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.658 1 C-N-CA 132.703 4.401 . . . . 11.25 114.893 -173.301 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 14.4 tp -85.86 39.35 0.8 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.822 1.649 . . . . 4.6100000000000003 111.001 170.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 22.5 p -134.31 141.32 46.89 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.827 2.051 . . . . 1.1899999999999999 112.446 -167.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 53.8 mt -97.75 98.16 9.62 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.917 1.687 . . . . 1.77 111.2 172.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 29.1 t -54.09 151.9 6.51 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.167 1.387 . . . . 2.2200000000000002 110.893 158.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 25.4 ttm-85 -42.81 -37.56 1.84 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.52 1.928 . . . . 4.71 115.229 -172.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 17.1 tptt -87.39 -21.81 25.41 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 118.099 2.629 . . . . 8.9399999999999995 118.099 175.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -60.29 -49.62 76.9 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 108.178 -1.045 . . . . 2.3999999999999999 108.178 164.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -56.48 -50.4 71.87 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.967 1.707 . . . . 2.6000000000000001 111.386 -177.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . 0.413 ' HA ' HD12 ' B' ' 38' ' ' ILE . 0.0 OUTLIER -54.38 -42.52 70.44 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.056 1.132 . . . . 3.8900000000000001 114.056 -177.051 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -82.66 -35.53 26.79 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 118.251 -0.88 . . . . 4.9900000000000002 111.709 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.36 -42.29 81.77 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 118.096 -0.955 . . . . 2.1899999999999999 111.211 175.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 0.413 HD12 ' HA ' ' B' ' 35' ' ' LYS . 47.3 mt -44.9 -53.84 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 CA-C-N 120.178 1.354 . . . . 1.5800000000000001 110.27 171.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 4.5 ttpm? -78.19 -0.9 30.23 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 125.346 1.458 . . . . 3.6099999999999999 114.401 -174.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.85 -33.64 6.67 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 127.1 2.16 . . . . 4.1299999999999999 111.831 175.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.14 -68.51 0.38 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.889 1.675 . . . . 4.6299999999999999 107.185 170.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.13 141.25 52.7 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 121.33 -0.856 . . . . 3.2599999999999998 109.079 170.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 5.1 t -84.3 9.29 13.44 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.422 0.897 . . . . 4.3399999999999999 113.422 171.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 9.3 mp -89.71 153.38 20.75 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.372 1.469 . . . . 4.7199999999999998 111.688 -169.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.71 146.71 48.62 Favored Glycine 0 CA--C 1.532 1.146 0 N-CA-C 110.803 -0.919 . . . . 3.73 110.803 169.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . 0.513 ' HG2' ' H ' ' B' ' 48' ' ' LYS . 23.4 tt0 -57.26 145.38 32.06 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.845 1.054 . . . . 10.41 113.845 -164.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 76.3 mmm -40.49 -40.95 1.33 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.322 1.849 . . . . 4.4900000000000002 113.271 161.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.513 ' H ' ' HG2' ' B' ' 46' ' ' GLU . 0.8 OUTLIER 99.53 140.05 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.968 1 C-N-CA 134.613 5.165 . . . . 3.4399999999999999 108.117 -172.267 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -43.13 -47.76 6.21 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.973 1.709 . . . . 3.8700000000000001 113.579 -176.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -65.02 -15.29 62.16 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 115.39 1.626 . . . . 2.8900000000000001 115.39 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 40.5 t -92.71 -15.27 26.9 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 120.074 1.306 . . . . 2.4500000000000002 112.663 171.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 37.3 mm -65.02 -26.96 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 124.752 1.221 . . . . 2.25 111.636 -177.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -63.72 -60.42 3.32 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 119.35 0.977 . . . . 5.96 112.417 178.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.35 -25.98 61.74 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.138 0.792 . . . . 3.4199999999999999 113.138 177.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -63.62 -58.21 7.64 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-O 118.766 -0.635 . . . . 2.2200000000000002 109.785 169.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ppp? -66.15 -36.28 82.69 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 118.935 0.789 . . . . 2.6600000000000001 110.873 -172.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -60.1 -23.8 64.12 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 127.774 2.43 . . . . 3.7200000000000002 113.994 173.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 9.3 t -80.34 -21.82 42.07 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.939 -1.101 . . . . 2.79 112.187 174.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.3 mt -90.67 -46.39 8.3 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.762 1.625 . . . . 2.25 109.809 178.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -67.6 137.05 55.36 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.89 1.276 . . . . 2.4300000000000002 110.82 172.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.21 -43.08 7.52 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.545 -1.347 . . . . 2.9199999999999999 111.43 175.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -86.39 -15.1 41.44 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.294 0.85 . . . . 2.0699999999999998 113.294 -168.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 9.3 t 67.85 16.33 9.66 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.588 1.555 . . . . 2.0099999999999998 112.218 -169.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -73.47 -24.67 60.24 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 130.384 3.473 . . . . 2.1600000000000001 110.318 174.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 64.69 0.52 1.16 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 128.524 2.729 . . . . 5.9699999999999998 115.573 169.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -77.14 130.67 37.64 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 108.088 -1.078 . . . . 2.1200000000000001 108.088 138.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 48.0 mt -100.54 112.97 34.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 124.999 1.32 . . . . 1.28 108.516 173.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.94 164.31 25.9 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 122.444 0.298 . . . . 2.5800000000000001 111.466 172.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -43.83 -42.68 5.79 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.366 1.466 . . . . 2.52 113.537 179.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 ttpm? -76.04 -25.47 55.67 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.406 2.282 . . . . 3.5099999999999998 113.842 -177.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -74.85 -50.4 17.18 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 107.77 -1.196 . . . . 1.6000000000000001 107.77 167.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -56.81 -36.04 69.46 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.618 1.967 . . . . 2.1200000000000001 115.14 -178.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 89.7 p -67.74 -15.28 63.56 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 118.684 -2.51 . . . . 1.77 113.599 175.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 27.9 t -70.37 -30.42 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 O-C-N 120.668 -1.27 . . . . 2.04 111.711 170.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -60.84 -53.44 57.37 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.528 -0.732 . . . . 2.27 110.427 166.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 41.5 mt -57.23 -39.14 74.9 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.648 0.779 . . . . 1.3700000000000001 112.189 176.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 91.5 m -55.34 -56.19 22.94 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.793 1.637 . . . . 0.93999999999999995 111.627 174.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 22.0 ptp -68.15 -35.83 78.7 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 112.917 0.71 . . . . 1.8100000000000001 112.917 -177.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 97.4 mt -61.84 -45.31 94.37 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 122.921 0.488 . . . . 1.76 110.904 172.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 3.0 t -61.18 -32.19 71.93 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.173 0.897 . . . . 1.8799999999999999 112.817 177.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 68.3 mtp -71.57 -34.86 70.32 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.918 1.081 . . . . 1.99 113.918 172.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.46 -44.2 83.4 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.763 1.165 . . . . 1.05 110.475 171.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -64.71 -22.02 66.88 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.009 0.744 . . . . 2.3399999999999999 113.009 -179.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -61.18 -62.12 2.07 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 119.245 0.929 . . . . 2.1400000000000001 112.59 162.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.97 -30.47 65.31 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 119.343 0.974 . . . . 3.6800000000000002 112.51 -172.05 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -58.44 -46.96 85.49 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.481 1.912 . . . . 3.6000000000000001 112.143 169.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -60.7 -29.7 69.49 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.443 -1.411 . . . . 3.1600000000000001 112.193 169.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 86.5 mt -83.99 -5.03 59.15 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 117.893 -1.051 . . . . 2.6600000000000001 113.443 171.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -89.83 -23.9 21.57 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.874 1.67 . . . . 6.4699999999999998 112.618 170.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.44 -44.63 64.45 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.803 1.241 . . . . 3.52 110.682 163.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -90.34 4.02 52.02 Favored 'General case' 0 CA--C 1.558 1.265 0 N-CA-C 114.944 1.461 . . . . 3.0600000000000001 114.944 -176.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 1.1 tttp . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 117.969 2.581 . . . . 5.5800000000000001 117.969 -166.375 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 . . . . . 0 C--O 1.24 0.558 0 N-CA-C 108.702 -0.851 . . . . 4.8300000000000001 108.702 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.05 153.95 42.22 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 126.485 1.914 . . . . 2.8700000000000001 112.278 -175.086 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -65.93 -26.83 51.26 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.699 2.266 . . . . 2.1099999999999999 113.482 -167.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -65.31 -36.03 82.81 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.597 0.759 . . . . 3.2599999999999998 111.238 171.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -73.11 -36.9 66.85 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.129 -0.982 . . . . 4.1200000000000001 111.321 174.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -61.93 -33.37 74.13 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.063 -1.023 . . . . 4.4900000000000002 112.491 169.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.31 -46.58 60.34 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.997 1.319 . . . . 1.23 112.232 174.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 66.6 mt -72.41 -29.48 63.77 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 120.605 -1.309 . . . . 2.04 113.026 177.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.8 p -71.1 -32.34 68.91 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 120.695 -1.253 . . . . 2.6699999999999999 112.669 169.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.1 m -53.96 -39.96 66.42 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.852 1.206 . . . . 1.3999999999999999 110.782 171.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -61.05 -44.24 97.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.072 0.949 . . . . 4.1500000000000004 113.48 176.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.8 m -71.5 -19.6 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 CA-C-N 119.969 1.259 . . . . 2.25 113.097 176.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 87.4 m -80.48 -33.36 36.65 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.715 2.006 . . . . 1.3100000000000001 113.211 -179.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 p -70.82 -39.78 72.85 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.216 0.916 . . . . 1.96 108.87 158.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -62.98 -57.37 10.96 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.407 0.549 . . . . 1.6499999999999999 112.326 -167.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 -54.79 -44.99 74.23 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.728 -0.608 . . . . 3.3599999999999999 111.812 174.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -67.62 -42.72 81.89 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.872 0.869 . . . . 4.1500000000000004 112.492 -171.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -78.35 -29.21 47.38 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.605 -0.685 . . . . 2.1099999999999999 112.457 174.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.4 t -56.98 -19.04 15.99 Favored 'General case' 0 C--O 1.247 0.939 0 N-CA-C 114.738 1.385 . . . . 1.97 114.738 174.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.68 -5.04 88.61 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 116.823 -2.098 . . . . 1.8799999999999999 116.869 175.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 -76.94 -23.9 52.41 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 119.87 1.835 . . . . 4.8399999999999999 115.633 -174.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -162.65 162.29 26.95 Favored 'General case' 0 C--O 1.248 0.993 0 C-N-CA 126.861 2.065 . . . . 5.0899999999999999 109.805 -173.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 47.09 -137.58 9.7 Favored Glycine 0 N--CA 1.474 1.214 0 C-N-CA 125.836 1.684 . . . . 1.9299999999999999 113.877 174.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.2 t -73.6 167.97 20.25 Favored 'General case' 0 C--O 1.251 1.164 0 CA-C-O 123.121 1.439 . . . . 2.5800000000000001 112.982 173.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 38.9 mttp -117.07 67.47 0.73 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 130.604 3.562 . . . . 7.4400000000000004 109.501 -175.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 164.18 -10.77 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.969 1 C-N-CA 133.71 4.804 . . . . 3.8100000000000001 110.502 -174.458 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.6 p -107.76 160.46 15.7 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.466 2.307 . . . . 1.3899999999999999 112.282 167.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.8 mt -108.76 101.53 10.65 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.75 1.62 . . . . 1.51 111.307 162.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.4 m -71.1 160.8 32.23 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 125.102 1.361 . . . . 2.8999999999999999 113.138 -177.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -41.07 -47.03 3.08 Favored 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 115.472 1.656 . . . . 5.0099999999999998 115.472 -172.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.52 -30.29 13.41 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 121.122 1.783 . . . . 4.46 113.271 -178.086 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -49.87 -41.73 46.09 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.665 1.186 . . . . 1.51 110.32 163.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -68.55 -50.31 52.88 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.496 1.118 . . . . 2.7200000000000002 112.032 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -56.77 -38.52 72.59 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.223 -0.923 . . . . 4.1100000000000003 113.232 -178.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.0 tp10 -66.03 -44.17 85.44 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.36 0.664 . . . . 3.71 112.786 173.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.2 -51.65 69.06 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.664 1.185 . . . . 2.0499999999999998 111.94 -176.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 35.3 mt -54.21 -48.65 66.26 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 CA-C-O 121.925 0.869 . . . . 0.82999999999999996 110.478 179.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? -69.35 -8.88 50.33 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.371 1.068 . . . . 5.2000000000000002 112.405 -176.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.61 -71.14 0.66 Allowed 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.738 1.615 . . . . 4.5 112.805 157.474 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -40.61 -51.39 2.98 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.256 1.422 . . . . 4.3499999999999996 111.864 -172.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.32 9.76 17.0 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 115.608 1.707 . . . . 2.8599999999999999 115.608 -162.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 53.1 t -73.13 74.72 1.26 Allowed 'General case' 0 CA--C 1.551 1.012 0 CA-C-O 123.945 1.831 . . . . 3.5600000000000001 113.043 -177.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -80.5 -47.75 13.82 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 126.366 1.866 . . . . 5.0099999999999998 109.243 166.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -125.04 162.52 19.32 Favored Glycine 0 CA--C 1.534 1.281 0 N-CA-C 108.054 -2.018 . . . . 4.7999999999999998 108.054 139.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.07 120.42 31.24 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.686 1.743 . . . . 7.8899999999999997 110.591 -178.335 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.9 ptm -70.55 141.0 51.9 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.071 -1.018 . . . . 2.3300000000000001 110.825 168.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.41 166.91 22.08 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.93 1.085 . . . . 4.5 113.93 -166.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.35 -45.33 69.11 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 127.06 2.144 . . . . 5.9900000000000002 114.087 -168.366 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.4 p -76.06 -40.41 53.3 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 126.099 1.76 . . . . 2.4100000000000001 112.342 177.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.8 m -61.02 -28.6 69.17 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.43 -0.794 . . . . 2.4300000000000002 112.597 174.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.3 mt -70.91 -35.09 58.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-O 117.612 -1.185 . . . . 1.24 112.243 171.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.32 -29.0 57.13 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 120.432 1.469 . . . . 3.04 113.5 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -72.67 -38.01 67.75 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.103 0.865 . . . . 2.3700000000000001 112.025 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -58.67 -47.32 84.9 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.445 0.698 . . . . 2.46 109.666 169.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.26 -44.76 80.0 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.796 1.239 . . . . 1.8999999999999999 111.93 173.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.12 -22.92 61.63 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 119.881 1.219 . . . . 4.0599999999999996 113.047 173.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.1 t -80.84 -36.93 30.85 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 119.81 -1.806 . . . . 2.46 112.714 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.5 mp -64.57 -49.08 72.58 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 121.073 -1.017 . . . . 2.9300000000000002 110.608 168.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -103.05 71.44 1.13 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.255 1.822 . . . . 2.4399999999999999 111.718 -164.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -50.97 -27.94 8.77 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.916 1.686 . . . . 3.1699999999999999 114.074 -168.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 41.4 p30 -100.69 -11.52 19.89 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.318 1.847 . . . . 2.9300000000000002 114.744 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.4 t 50.49 52.65 14.41 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.825 1.25 . . . . 4.1600000000000001 112.047 -168.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.5 p30 -83.9 -11.13 57.37 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.575 1.55 . . . . 2.48 111.1 174.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 70.28 13.72 7.6 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 130.256 3.423 . . . . 4.4500000000000002 113.997 -177.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -131.65 120.97 23.55 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 127.209 2.204 . . . . 2.48 108.924 179.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 47.4 mt -101.72 108.14 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.004 -1.06 . . . . 1.6000000000000001 111.709 -178.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -64.34 155.74 31.34 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 127.71 2.404 . . . . 2.5499999999999998 111.571 164.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -34.68 68.33 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.477 -1.389 . . . . 2.04 114.324 -179.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? -83.72 -24.66 31.12 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 120.497 -1.377 . . . . 2.9900000000000002 112.502 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -60.46 -54.25 47.85 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 108.777 -0.823 . . . . 1.9299999999999999 108.777 157.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -62.07 -33.05 73.69 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 126.706 2.003 . . . . 3.1200000000000001 115.77 -174.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.41 -21.65 65.56 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 120.872 -1.143 . . . . 1.8100000000000001 112.452 -171.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.1 p -57.45 -35.29 49.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 123.632 0.773 . . . . 2.3199999999999998 112.573 170.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.469 ' CE1' HD11 ' A' ' 79' ' ' LEU . 18.2 t80 -61.79 -61.01 2.81 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 126.144 1.778 . . . . 2.1299999999999999 111.299 -173.274 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.5 mt -68.15 -24.54 65.0 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.451 -0.785 . . . . 2.3999999999999999 111.332 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 30.0 m -61.59 -54.88 37.07 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.199 0.909 . . . . 0.68999999999999995 110.983 168.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 78.1 mtm -58.36 -37.66 75.66 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.258 0.935 . . . . 1.46 112.888 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.469 HD11 ' CE1' ' A' ' 75' ' ' PHE . 43.6 mt -73.36 -46.24 50.25 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.853 0.686 . . . . 1.5700000000000001 112.853 178.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 1.7 t -71.11 -25.86 62.78 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.418 -0.801 . . . . 1.8100000000000001 112.721 178.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 44.6 mmm -58.82 -48.51 81.06 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.807 1.243 . . . . 1.74 111.657 165.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.67 -37.85 85.58 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.17 -0.957 . . . . 0.84999999999999998 112.067 174.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -64.88 -33.11 75.24 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.161 1.171 . . . . 2.27 114.161 173.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -58.25 -46.7 85.49 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.608 1.095 . . . . 2.1899999999999999 111.499 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -75.47 -35.36 60.87 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.086 1.354 . . . . 3.8500000000000001 111.984 -172.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.21 -46.02 79.63 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.991 1.716 . . . . 2.25 110.981 167.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -69.02 -27.49 65.72 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.672 1.189 . . . . 2.5899999999999999 112.466 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 78.6 mt -70.33 -41.36 73.33 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.967 -1.083 . . . . 1.8500000000000001 111.546 171.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -71.47 -13.73 61.91 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.954 1.464 . . . . 3.21 114.954 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.5 t70 . . . . . 0 CA--C 1.537 0.452 0 O-C-N 121.377 -0.827 . . . . 4.6299999999999999 111.182 163.965 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 72.4 p . . . . . 0 C--O 1.237 0.42 0 N-CA-C 113.189 0.811 . . . . 2.8799999999999999 113.189 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -65.01 -14.51 45.7 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 121.571 1.514 . . . . 1.96 112.489 168.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.2 -40.92 74.31 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-N 119.987 1.267 . . . . 3.0299999999999998 112.298 174.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -60.26 -27.6 67.38 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 120.676 1.58 . . . . 4.1500000000000004 112.58 171.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -74.7 -25.64 59.28 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.646 -1.284 . . . . 5.4400000000000004 111.869 171.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.45 -47.89 30.79 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.726 1.211 . . . . 1.02 112.116 172.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mp -60.5 -41.63 94.71 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 120.552 1.523 . . . . 2.4100000000000001 112.086 176.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 17.6 p -65.68 -39.41 91.29 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 118.147 -0.93 . . . . 2.0600000000000001 112.231 174.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 87.8 m -57.3 -45.48 84.13 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.775 1.17 . . . . 1.28 110.893 169.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 4.4 tmm? -60.18 -53.08 61.91 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.089 1.355 . . . . 3.79 111.584 -176.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 9.9 p -64.79 -25.06 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 O-C-N 121.241 -0.912 . . . . 2.1600000000000001 112.801 175.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 56.3 m -74.9 -45.42 42.82 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 117.978 -1.01 . . . . 0.75 111.276 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 8.6 p -58.48 -38.44 77.62 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.825 0.738 . . . . 1.5900000000000001 110.105 164.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -63.77 -51.98 62.41 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.927 -0.309 . . . . 2.4100000000000001 111.723 -173.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -78.16 -21.81 49.67 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 114.157 1.169 . . . . 2.23 114.157 -177.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -68.6 -54.88 13.75 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.068 0.849 . . . . 4.3499999999999996 111.374 167.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -73.25 -27.49 61.61 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 121.577 -0.702 . . . . 2.3500000000000001 112.412 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 10.5 p -68.74 -25.66 64.85 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.92 1.691 . . . . 2.3700000000000001 113.21 172.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.24 5.4 84.4 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 126.684 2.088 . . . . 1.6499999999999999 114.678 170.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -70.42 -29.11 65.63 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.166 1.483 . . . . 3.6800000000000002 112.171 172.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -156.75 153.84 29.03 Favored 'General case' 0 C--O 1.249 1.034 0 CA-C-O 121.899 0.857 . . . . 3.9500000000000002 112.255 176.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 58.08 -127.82 46.03 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 126.689 2.09 . . . . 2.5600000000000001 110.972 166.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.91 121.69 11.14 Favored 'General case' 0 C--O 1.249 1.027 0 O-C-N 122.267 -0.549 . . . . 3.0499999999999998 110.127 167.086 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -76.72 54.74 1.0 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 128.367 2.667 . . . . 7.4800000000000004 110.393 166.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 53.7 tp -161.28 -51.09 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 126.213 1.805 . . . . 2.7400000000000002 107.906 -178.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.6 p -92.28 157.42 16.67 Favored 'General case' 0 C--O 1.254 1.338 0 CA-C-O 123.513 1.625 . . . . 1.49 112.626 175.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -103.4 107.21 17.95 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 111.636 -2.529 . . . . 3.0800000000000001 107.814 167.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 41.4 t -70.91 143.03 51.1 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 108.594 -0.891 . . . . 2.1200000000000001 108.594 161.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -24.36 -51.51 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 128.727 2.811 . . . . 5.5700000000000003 116.352 -175.217 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -44.18 91.63 Favored 'General case' 0 CA--C 1.554 1.112 0 N-CA-C 116.107 1.891 . . . . 5.04 116.107 174.134 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -59.95 -43.74 94.81 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.862 2.065 . . . . 1.8 109.514 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.38 -44.93 70.5 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.245 1.418 . . . . 3.3399999999999999 110.834 -179.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -54.96 -42.11 71.94 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.069 -1.02 . . . . 2.8700000000000001 112.283 174.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -59.9 -49.06 79.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.532 0.733 . . . . 3.0299999999999998 111.805 174.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.5 tp -57.78 -44.52 86.29 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.144 0.978 . . . . 2.23 112.715 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 73.8 mt -56.74 -55.4 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 N-CA-C 109.558 -0.534 . . . . 1.29 109.558 171.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -63.5 -17.52 62.84 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 112.95 0.722 . . . . 4.5800000000000001 112.95 -175.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -87.25 -48.56 7.92 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 125.902 1.681 . . . . 4.7000000000000002 113.917 -178.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -116.09 -8.84 11.77 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 125.399 1.687 . . . . 6.5499999999999998 114.384 -159.254 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 24.0 tp -121.34 88.72 2.99 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.753 1.221 . . . . 2.5499999999999998 109.073 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 17.9 p -82.4 13.89 3.34 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 115.088 1.514 . . . . 4.4400000000000004 115.088 -157.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 8.0 mp -75.98 134.16 40.24 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.121 0.968 . . . . 3.5299999999999998 111.173 -169.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.59 -20.97 59.86 Favored Glycine 0 CA--C 1.532 1.15 0 CA-C-O 119.625 -0.541 . . . . 2.9399999999999999 113.83 177.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -87.39 -3.81 59.02 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.886 1.275 . . . . 5.6900000000000004 113.629 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 7.3 tpt -77.06 39.16 0.23 Allowed 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 124.309 2.004 . . . . 2.27 112.144 171.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -57.84 125.89 25.01 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 127.138 2.175 . . . . 3.98 109.848 -174.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 65.1 tt0 -58.38 -29.37 65.97 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 115.267 1.58 . . . . 3.5499999999999998 115.267 -166.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -66.66 -14.39 62.41 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 120.556 1.525 . . . . 2.4100000000000001 113.789 173.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 9.4 t -97.19 -7.84 31.44 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.669 1.588 . . . . 2.2999999999999998 112.422 172.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 12.5 mt -65.28 -40.39 88.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 119.843 1.202 . . . . 1.29 110.813 176.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -72.0 -23.89 61.48 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.206 0.817 . . . . 3.0800000000000001 113.206 -174.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -76.1 -37.22 58.38 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.467 0.707 . . . . 2.3900000000000001 111.809 172.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 10.3 tt -62.62 -49.39 75.38 Favored 'General case' 0 C--N 1.343 0.316 0 O-C-N 121.506 -0.746 . . . . 2.4399999999999999 110.184 168.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.09 -48.78 67.49 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 124.341 1.056 . . . . 3.1800000000000002 111.72 177.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -58.4 -36.47 73.61 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.313 1.845 . . . . 4.0300000000000002 113.056 173.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 67.9 m -77.57 -19.43 55.67 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.317 1.847 . . . . 2.1699999999999999 114.315 177.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 20.4 mt -78.08 -54.37 6.34 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.338 -0.851 . . . . 1.8 109.568 159.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -82.88 53.43 2.41 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 129.699 3.2 . . . . 2.0600000000000001 112.197 -172.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -58.53 -19.17 35.42 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.049 1.74 . . . . 3.2200000000000002 113.642 -172.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 50.9 p30 -96.23 -8.33 33.23 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.39 1.876 . . . . 2.1800000000000002 115.145 174.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 68.1 m 60.68 28.64 18.35 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.916 1.686 . . . . 2.1499999999999999 114.743 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 47.1 p30 -79.11 -8.54 59.06 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.173 -0.954 . . . . 2.29 111.562 177.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 71.12 -15.22 0.42 Allowed 'General case' 0 C--O 1.236 0.369 0 C-N-CA 131.038 3.735 . . . . 3.9700000000000002 115.282 171.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -78.3 150.14 33.37 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-O 122.752 1.263 . . . . 3.71 110.16 159.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 37.1 mm -113.72 112.14 39.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 125.824 1.649 . . . . 1.3100000000000001 108.561 164.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . 0.444 ' CG ' ' HZ2' ' B' ' 70' ' ' LYS . 0.0 OUTLIER -82.73 168.68 16.97 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.607 1.163 . . . . 2.8799999999999999 111.315 163.54 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -56.63 -33.27 66.14 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.508 0.929 . . . . 2.5499999999999998 113.508 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.444 ' HZ2' ' CG ' ' B' ' 68' ' ' ASP . 8.6 mtmp? -70.14 -44.28 69.19 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.555 -1.34 . . . . 4.1699999999999999 111.975 176.378 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -59.59 -47.91 83.74 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 118.838 0.744 . . . . 1.77 109.812 171.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -59.42 -31.91 69.71 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.849 1.66 . . . . 2.0499999999999998 114.851 179.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 38.3 t -56.43 -30.63 63.06 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.753 -1.217 . . . . 1.99 112.518 171.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 45.5 t -60.13 -44.47 95.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 O-C-N 121.394 -0.817 . . . . 1.54 110.471 175.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -58.24 -53.3 59.88 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.659 0.784 . . . . 1.6000000000000001 111.384 176.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 59.8 mt -60.28 -40.2 89.6 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.131 0.973 . . . . 1.55 111.604 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.9 m -62.02 -53.26 58.12 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.322 1.449 . . . . 0.80000000000000004 110.981 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.9 mtm -57.43 -38.79 74.95 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.383 0.512 . . . . 1.52 112.383 179.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 95.1 mt -70.39 -47.28 61.59 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 118.572 -0.728 . . . . 1.5800000000000001 111.699 178.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 65.0 m -64.4 -30.18 71.23 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 120.034 1.288 . . . . 1.8 113.872 175.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 81.3 mtp -64.39 -48.69 74.49 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.074 0.852 . . . . 2.2400000000000002 111.242 165.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.76 -39.01 92.84 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.298 0.953 . . . . 0.89000000000000001 112.513 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -66.66 -33.31 75.36 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.427 1.012 . . . . 3.3199999999999998 112.803 174.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.96 -49.99 58.5 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.271 1.028 . . . . 1.78 111.001 172.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -64.2 -46.69 82.8 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.802 1.241 . . . . 4.2000000000000002 110.725 -175.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -62.39 -41.26 98.53 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.234 1.813 . . . . 2.0600000000000001 112.509 174.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -64.26 -32.43 74.02 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 120.802 -1.186 . . . . 2.7200000000000002 111.104 174.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 66.0 mt -73.22 -17.25 61.37 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 117.934 -1.031 . . . . 1.8300000000000001 113.573 173.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -83.34 -15.01 51.66 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.905 1.23 . . . . 4.8700000000000001 113.679 168.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -85.57 -59.65 2.25 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.075 1.35 . . . . 3.1200000000000001 111.645 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.62 -4.67 32.3 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 115.064 1.505 . . . . 2.8599999999999999 115.064 -170.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.046 0 C-N-CA 126.649 1.98 . . . . 4.7800000000000002 114.969 175.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.4 mp0 . . . . . 0 CA--C 1.534 0.347 0 N-CA-C 107.169 -1.419 . . . . 4.9199999999999999 107.169 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 24.9 p -151.73 157.73 34.4 Favored Pre-proline 0 C--O 1.238 0.485 0 C-N-CA 128.569 2.747 . . . . 3.2400000000000002 108.617 177.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.77 -25.98 16.43 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 122.926 2.418 . . . . 2.6899999999999999 111.199 162.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.66 -47.01 85.55 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.676 1.59 . . . . 2.8599999999999999 112.351 -178.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -60.8 -34.73 74.95 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.258 0.481 . . . . 4.0599999999999996 111.746 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.33 -28.82 65.42 Favored 'General case' 0 CA--C 1.552 1.033 0 O-C-N 119.851 -1.781 . . . . 4.3899999999999997 112.17 175.424 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.16 -39.89 62.95 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.63 -0.669 . . . . 1.7 111.657 173.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 97.6 mt -59.9 -47.0 87.55 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.859 0.754 . . . . 1.3799999999999999 110.887 172.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 m -52.96 -54.52 33.76 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.424 1.49 . . . . 2.5499999999999998 112.031 171.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.7 t -66.86 -28.48 68.37 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-N 120.5 1.5 . . . . 2.6600000000000001 112.879 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.98 -48.45 63.1 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 117.782 -1.104 . . . . 3.77 112.365 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.0 p -63.74 -24.5 35.97 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-N 120.689 1.586 . . . . 2.27 111.848 175.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.9 m -73.9 -53.07 10.96 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.347 1.459 . . . . 0.72999999999999998 111.923 179.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.4 p -63.77 -35.01 79.18 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.701 1.137 . . . . 2.0499999999999998 110.533 171.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -59.05 -62.87 1.56 Allowed 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 108.925 -0.768 . . . . 1.8799999999999999 108.925 177.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.99 -31.13 69.74 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.647 1.112 . . . . 2.4700000000000002 112.725 -172.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -57.77 -49.25 77.22 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.704 -0.623 . . . . 4.2300000000000004 112.358 169.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -83.94 -29.57 26.99 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.951 -1.093 . . . . 2.9199999999999999 113.397 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.9 p -69.46 -30.69 68.65 Favored 'General case' 0 C--O 1.242 0.689 0 O-C-N 120.82 -1.175 . . . . 2.2999999999999998 111.047 172.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.57 -1.15 70.04 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 127.518 2.485 . . . . 1.72 115.467 171.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -72.23 -42.56 65.55 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.879 1.839 . . . . 5.8799999999999999 111.37 -177.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -149.56 166.44 29.22 Favored 'General case' 0 C--O 1.244 0.775 0 C-N-CA 125.781 1.633 . . . . 3.8500000000000001 113.011 -177.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.62 -132.77 51.62 Favored Glycine 0 C--N 1.339 0.735 0 C-N-CA 125.292 1.425 . . . . 2.5800000000000001 110.779 171.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.5 m -64.34 138.21 58.31 Favored 'General case' 0 C--O 1.249 1.051 0 O-C-N 121.934 -0.745 . . . . 2.6400000000000001 110.555 163.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 36.1 pttt -67.81 -24.81 65.33 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.31 0.644 . . . . 5.3799999999999999 111.929 171.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.0 mt -81.57 -23.74 36.95 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.931 1.292 . . . . 3.71 113.683 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 61.1 p -109.26 146.15 34.74 Favored 'General case' 0 C--O 1.244 0.799 0 CA-C-N 119.934 1.243 . . . . 1.24 111.276 175.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.84 83.37 2.54 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.245 -1.02 . . . . 2.1499999999999999 108.245 163.251 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.0 m -58.16 143.62 43.4 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 123.914 0.885 . . . . 3.7000000000000002 108.803 176.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 35.7 ptt-85 -47.47 -34.89 7.89 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 117.241 2.312 . . . . 6.3300000000000001 117.241 -158.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.5 ptmm? -51.76 -39.53 58.71 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 116.337 1.977 . . . . 4.6600000000000001 116.337 168.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -68.1 -52.57 33.49 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 128.334 2.654 . . . . 1.6499999999999999 108.747 169.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.6 tp -64.37 -33.95 77.03 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.799 0.666 . . . . 2.6099999999999999 112.799 -172.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -8.84 54.07 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 115.184 1.55 . . . . 4.8099999999999996 115.184 -179.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -74.96 -66.79 0.71 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 118.592 -0.718 . . . . 3.9500000000000002 109.758 156.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 31.8 tp -44.33 -54.49 5.76 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.319 1.448 . . . . 2.5299999999999998 113.26 -167.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 28.6 mt -48.14 -44.47 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 123.43 0.692 . . . . 0.96999999999999997 112.102 -176.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.275 0.0 OUTLIER -84.45 -9.07 58.71 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-O 118.626 -0.702 . . . . 4.1600000000000001 110.896 -167.769 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -67.28 -57.58 6.39 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.733 1.151 . . . . 2.6699999999999999 109.627 168.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -54.95 -69.16 0.14 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.885 2.074 . . . . 4.5099999999999998 110.421 171.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -79.23 65.23 4.34 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.66 1.219 . . . . 2.6699999999999999 108.402 176.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.8 p -59.96 -55.09 38.31 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.411 1.884 . . . . 3.5 111.647 176.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.464 HD12 ' H ' ' A' ' 44' ' ' LEU . 4.4 mp -14.28 -110.82 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.737 1 C-N-CA 132.378 4.271 . . . . 4.7000000000000002 115.876 -174.789 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -147.13 -28.63 0.07 OUTLIER Glycine 0 N--CA 1.473 1.119 0 O-C-N 121.473 -0.767 . . . . 3.6000000000000001 114.595 175.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 27.1 mp0 -63.24 -43.04 99.15 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 128.339 2.656 . . . . 5.5199999999999996 111.581 -177.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.17 67.59 6.04 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 123.961 1.838 . . . . 2.1200000000000001 110.333 165.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.3 tptp -72.5 160.23 32.64 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 111.49 -2.595 . . . . 6.8799999999999999 109.652 160.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.565 ' CD ' ' H ' ' A' ' 49' ' ' GLU . 4.4 mp0 -52.25 -45.85 65.53 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.624 1.57 . . . . 4.75 113.188 -170.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.8 t -80.02 -15.17 57.77 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.507 1.299 . . . . 3.04 114.507 178.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.9 m -68.04 -19.27 64.87 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.129 1.332 . . . . 2.6800000000000002 111.712 173.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 70.6 mt -85.93 -24.12 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 125.548 1.539 . . . . 1.49 112.808 -175.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -57.0 -58.08 9.74 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.698 -0.852 . . . . 3.6200000000000001 108.698 162.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -66.45 -38.61 87.74 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.339 0.866 . . . . 2.5299999999999998 113.339 -175.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.68 -51.35 70.32 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 118.582 -0.723 . . . . 2.3999999999999999 110.395 171.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.08 -33.26 70.03 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.236 0.925 . . . . 1.8200000000000001 112.5 -176.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.3 mtpt -58.72 -39.38 80.67 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.446 1.021 . . . . 4.7599999999999998 112.489 170.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.7 t -77.41 -30.37 53.48 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.617 0.969 . . . . 1.77 113.617 173.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.52 -36.36 76.36 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 124.398 1.079 . . . . 2.6200000000000001 112.143 178.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -72.45 77.48 1.04 Allowed 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.682 1.193 . . . . 1.6200000000000001 111.276 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 3.5 0.21 Allowed 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.863 1.665 . . . . 5.3600000000000003 114.974 -170.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 38.7 p30 -137.67 -0.79 2.11 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 127.298 2.239 . . . . 3.0899999999999999 114.525 173.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.9 m 60.73 37.48 18.92 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 115.182 1.549 . . . . 4.1299999999999999 115.182 168.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -88.11 -32.0 18.92 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 126.905 2.082 . . . . 2.7599999999999998 112.975 177.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 105.89 -1.17 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.043 1 C-N-CA 136.455 5.902 . . . . 4.0999999999999996 114.087 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -107.92 136.38 47.73 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 128.21 2.604 . . . . 2.4900000000000002 110.429 178.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 24.7 mm -112.05 114.34 46.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 124.173 0.989 . . . . 1.5800000000000001 108.468 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -103.48 156.92 17.4 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.558 2.343 . . . . 3.3199999999999998 108.589 173.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -37.82 -45.19 0.81 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.976 1.71 . . . . 2.4399999999999999 114.241 176.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.3 pttt -63.9 -18.31 64.07 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.965 1.306 . . . . 3.6800000000000002 114.025 -177.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -105.14 -53.17 2.71 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 127.797 2.439 . . . . 2.9100000000000001 108.147 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -45.25 -35.1 3.17 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 128.384 2.674 . . . . 2.0699999999999998 114.81 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.1 m -68.79 -15.3 63.47 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 120.657 -1.277 . . . . 1.9399999999999999 113.182 178.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 84.3 t -67.06 -31.37 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-N 119.348 0.977 . . . . 2.2599999999999998 110.637 169.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -59.33 -53.19 61.08 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 118.983 0.811 . . . . 1.77 110.323 168.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 22.1 mt -62.73 -35.91 81.28 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.255 0.622 . . . . 1.5700000000000001 111.186 -176.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.4 m -63.2 -42.39 99.31 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 125.12 1.368 . . . . 1.1599999999999999 111.507 172.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 44.3 ttm -61.6 -42.6 99.1 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.499 1.12 . . . . 3.3799999999999999 111.431 178.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.34 -56.66 10.05 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.056 0.543 . . . . 2.7999999999999998 111.253 173.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.3 m -60.99 -34.34 74.65 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.8 1.037 . . . . 1.5800000000000001 113.8 -175.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 56.0 mtp -76.7 -24.99 53.11 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.927 1.24 . . . . 2.25 113.918 173.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.3 -43.63 40.61 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 120.525 1.511 . . . . 0.93999999999999995 111.454 169.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -63.61 -28.73 70.12 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.494 1.043 . . . . 2.23 112.914 173.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -54.38 -56.72 15.72 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.577 0.751 . . . . 2.0699999999999998 111.75 165.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.75 -42.35 81.93 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.855 0.862 . . . . 3.2400000000000002 111.661 -176.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.52 -44.44 69.14 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.589 1.956 . . . . 2.2400000000000002 112.347 172.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -70.62 -32.2 69.44 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.577 -1.327 . . . . 3.0800000000000001 111.723 176.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.3 mt -84.41 -1.52 55.69 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 125.466 1.507 . . . . 1.9399999999999999 113.546 174.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -74.11 -22.42 59.48 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 121.088 -1.007 . . . . 5.2300000000000004 112.348 162.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.2 t70 . . . . . 0 CA--C 1.545 0.777 0 C-N-CA 126.379 1.872 . . . . 5.0099999999999998 111.39 176.931 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 48.4 p . . . . . 0 N--CA 1.469 0.486 0 N-CA-C 112.629 0.603 . . . . 1.75 112.629 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -63.41 -20.66 70.51 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 121.818 1.679 . . . . 2.1600000000000001 112.898 168.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -80.19 -43.39 21.62 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-O 117.136 -1.412 . . . . 2.4300000000000002 111.905 175.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.93 -46.98 81.67 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.436 1.471 . . . . 4.6200000000000001 110.922 168.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -57.97 -27.8 63.78 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.103 -0.998 . . . . 5.1699999999999999 112.959 172.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.09 -39.85 54.39 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 120.597 -1.314 . . . . 1.6599999999999999 111.659 176.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 96.0 mt -66.22 -32.5 73.96 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.016 0.926 . . . . 1.73 112.011 171.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.4 m -60.44 -55.98 26.96 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.087 0.858 . . . . 1.8500000000000001 110.777 161.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 83.4 m -53.07 -39.48 63.33 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.15 1.38 . . . . 2.48 111.375 -174.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -48.25 -42.6 30.91 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.027 1.731 . . . . 3.9700000000000002 112.864 174.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 66.4 t -62.41 -28.64 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 124.967 1.307 . . . . 2.2000000000000002 112.674 178.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 14.5 m -66.07 -39.96 90.5 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.991 1.716 . . . . 1.1200000000000001 112.423 -179.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -44.94 68.34 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 126.548 1.939 . . . . 1.8400000000000001 108.713 169.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -67.73 -43.97 78.72 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 123.719 0.637 . . . . 2.04 111.721 -169.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.46 -47.84 83.93 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.895 0.878 . . . . 2.9300000000000002 111.479 170.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 3.7 ttmp? -73.19 -40.61 64.63 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.667 0.988 . . . . 3.8100000000000001 113.667 -171.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -70.67 -26.07 63.27 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.047 -0.978 . . . . 2.3199999999999998 112.187 166.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 32.3 m -68.19 -40.54 82.19 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 120.702 1.592 . . . . 1.49 113.118 167.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.59 -12.88 83.78 Favored Glycine 0 CA--C 1.532 1.153 0 C-N-CA 125.769 1.652 . . . . 1.78 112.9 -178.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.06 97.83 0.53 Allowed 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 105.832 -1.914 . . . . 4.5700000000000003 105.832 153.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 65.17 175.45 0.21 Allowed 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 126.175 1.79 . . . . 5.4400000000000004 114.655 167.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.66 -140.03 30.56 Favored Glycine 0 N--CA 1.474 1.231 0 C-N-CA 125.919 1.723 . . . . 2.1899999999999999 113.036 174.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 67.6 m -78.36 162.42 26.47 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.517 -0.99 . . . . 3.3199999999999998 112.553 171.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 19.2 ttmt -85.65 128.24 34.72 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 127.187 2.195 . . . . 7.1299999999999999 107.363 156.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.0 tt 91.59 -24.66 0.06 Allowed 'General case' 0 N--CA 1.492 1.625 0 C-N-CA 128.819 2.848 . . . . 3.54 112.321 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.55 137.1 47.06 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 125.287 1.435 . . . . 1.8100000000000001 109.623 170.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 75.7 mt -98.29 98.39 9.65 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.928 1.291 . . . . 1.5900000000000001 110.627 175.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 3.6 m -52.43 153.56 2.93 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 122.102 0.953 . . . . 2.3199999999999998 112.493 163.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 19.1 ttp85 -48.52 -39.55 23.7 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.893 1.277 . . . . 3.6299999999999999 114.162 -172.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -68.59 -40.72 80.37 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 119.58 -1.95 . . . . 6.3600000000000003 111.7 178.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -53.77 -51.13 64.39 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.638 1.575 . . . . 1.76 109.245 177.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 15.0 tp -64.77 -45.61 85.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.477 1.111 . . . . 2.04 112.657 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 2.1 tmpt? -58.17 -34.31 70.18 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 118.883 0.765 . . . . 4.8399999999999999 111.711 175.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -68.64 -54.54 15.75 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.624 0.769 . . . . 4.4000000000000004 111.676 172.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.43 -52.74 64.17 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 126.16 1.784 . . . . 2.1099999999999999 112.294 -176.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 29.0 mt -59.72 -44.44 93.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 119.338 0.972 . . . . 1.45 110.092 178.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.425 ' HZ1' ' CD ' ' B' ' 49' ' ' GLU . 13.8 tppt? -66.65 -11.79 55.36 Favored 'General case' 0 CA--C 1.557 1.23 0 O-C-N 121.512 -0.743 . . . . 5.0499999999999998 112.488 178.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmtm -105.46 -35.59 7.43 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.796 2.038 . . . . 5.2300000000000004 114.591 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -69.71 -63.26 1.11 Allowed 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 124.8 1.24 . . . . 5.04 109.668 170.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -86.32 56.83 4.16 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.022 0.929 . . . . 2.4199999999999999 108.976 179.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 4.8 t -70.09 24.78 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 125.588 1.555 . . . . 3.6099999999999999 114.868 -173.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 38.6 mt -77.41 -3.86 42.41 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 128.746 2.818 . . . . 3.54 113.516 -177.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.14 -49.24 4.19 Favored Glycine 0 N--CA 1.47 0.945 0 C-N-CA 125.042 1.306 . . . . 3.9100000000000001 112.692 179.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -60.48 -10.16 4.61 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.583 1.553 . . . . 5.46 114.381 176.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 8.0 tpt -71.31 69.05 0.54 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.106 1.762 . . . . 2.0600000000000001 111.203 170.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -88.94 153.41 21.05 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.656 1.982 . . . . 3.7799999999999998 112.845 -166.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.425 ' CD ' ' HZ1' ' B' ' 39' ' ' LYS . 5.3 mp0 -49.64 -57.32 7.42 Favored 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 127.12 2.168 . . . . 4.25 112.096 -165.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 12.0 m -73.12 -0.21 13.45 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.317 1.599 . . . . 2.5699999999999998 115.317 -179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 15.7 t -97.27 -33.39 11.47 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.437 1.095 . . . . 2.7400000000000002 111.451 164.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 38.8 mt -58.81 -35.33 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 124.677 1.191 . . . . 1.6100000000000001 110.015 166.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -61.66 -25.04 67.14 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.515 1.126 . . . . 3.8399999999999999 113.829 170.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.491 ' HA ' ' HE2' ' B' ' 57' ' ' LYS . 7.8 t70 -89.93 -32.95 16.6 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 121.021 1.737 . . . . 4.1799999999999997 113.051 173.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -52.0 -41.72 62.41 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 118.646 -0.693 . . . . 2.5600000000000001 109.42 158.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -53.49 52.56 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 120.139 1.336 . . . . 2.1400000000000001 111.55 175.389 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . 0.491 ' HE2' ' HA ' ' B' ' 54' ' ' ASP . 30.0 mtmm -51.1 -44.1 61.21 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 118.988 0.813 . . . . 3.7000000000000002 112.9 176.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 38.9 m -76.06 -40.39 53.37 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.895 1.278 . . . . 2.02 113.279 -176.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 9.6 mp -71.36 -35.8 71.26 Favored 'General case' 0 C--O 1.225 -0.194 0 O-C-N 120.959 -1.088 . . . . 2.3399999999999999 111.808 178.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -100.11 98.49 9.2 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 119.612 1.096 . . . . 1.4299999999999999 113.897 -163.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -98.14 -14.8 20.22 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.933 1.693 . . . . 3.27 115.278 -176.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.88 -21.27 60.15 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 119.448 1.022 . . . . 2.5800000000000001 110.303 152.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 50.6 m 60.78 66.69 0.89 Allowed 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.04 1.736 . . . . 4.3399999999999999 111.165 168.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -147.3 -116.49 0.07 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.665 1.586 . . . . 3.5600000000000001 109.5 -148.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -149.74 -5.18 0.36 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 116.57 2.063 . . . . 4.54 116.57 169.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -115.37 139.13 50.27 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.89 1.276 . . . . 2.46 111.527 167.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 8.0 mm -94.27 110.78 24.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 126.24 1.816 . . . . 1.1699999999999999 109.858 172.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -58.22 156.26 10.1 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.593 1.157 . . . . 3.3999999999999999 110.705 166.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.99 -39.52 66.1 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.164 -1.585 . . . . 2.3500000000000001 111.525 169.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -76.59 -18.07 58.84 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.751 1.389 . . . . 3.8799999999999999 114.751 178.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -73.97 -50.33 20.46 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 108.322 -0.992 . . . . 1.8799999999999999 108.322 163.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -61.1 -26.28 67.56 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 128.814 2.845 . . . . 1.96 115.338 -177.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 68.6 m -47.91 -34.55 9.17 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 120.851 -1.156 . . . . 2.21 113.441 172.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 6.6 m -69.22 -22.45 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 O-C-N 121.208 -0.933 . . . . 2.6400000000000001 113.155 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -64.97 -59.54 4.05 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.101 0.96 . . . . 1.8100000000000001 110.031 175.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 58.6 mt -55.19 -37.65 67.34 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.792 0.837 . . . . 1.52 110.839 176.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 30.8 m -57.95 -61.84 2.25 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.619 1.168 . . . . 0.91000000000000003 111.677 173.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 24.3 ptp -68.08 -32.21 72.37 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 118.949 0.795 . . . . 1.8300000000000001 112.848 -174.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -46.02 81.22 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.923 0.889 . . . . 3.25 110.529 175.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.6 t -69.9 -27.67 64.98 Favored 'General case' 0 CA--C 1.545 0.786 0 O-C-N 121.736 -0.602 . . . . 2.1200000000000001 112.5 175.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 61.6 mtp -67.19 -40.38 86.53 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.837 -1.164 . . . . 1.96 112.768 168.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.81 -37.3 78.76 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.566 1.076 . . . . 0.77000000000000002 111.397 172.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 5.0 m-30 -65.7 -24.16 66.93 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.955 1.094 . . . . 2.1899999999999999 113.955 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -70.28 -41.3 73.59 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 119.82 1.191 . . . . 2.2400000000000002 111.866 174.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -65.61 -44.56 86.19 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.375 1.07 . . . . 3.3199999999999998 110.519 176.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.82 -47.05 77.88 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.14 1.776 . . . . 2.0600000000000001 111.884 174.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -63.66 -21.37 66.34 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.192 1.397 . . . . 2.6099999999999999 112.382 175.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 85.5 mt -88.27 -7.19 57.16 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 114.305 1.224 . . . . 1.79 114.305 176.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -70.18 -35.2 73.79 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.171 0.896 . . . . 5.1399999999999997 111.779 161.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -100.75 -65.34 0.97 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.538 1.935 . . . . 3.54 112.681 -168.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -79.91 34.36 0.29 Allowed 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 125.594 1.558 . . . . 3.9100000000000001 112.501 175.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.875 0 C-N-CA 131.521 3.928 . . . . 7.1699999999999999 117.518 -172.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 . . . . . 0 CA--C 1.537 0.445 0 N-CA-C 108.633 -0.877 . . . . 3.75 108.633 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.433 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 1.2 p -153.26 179.61 1.25 Allowed Pre-proline 0 N--CA 1.478 0.965 0 C-N-CA 127.03 2.132 . . . . 1.46 109.123 169.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.433 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 95.0 Cg_endo -76.9 -9.31 18.12 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 121.471 1.447 . . . . 1.47 113.7 171.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -76.92 -49.63 15.15 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.022 1.329 . . . . 2.71 112.67 -178.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -56.66 -34.96 67.86 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.574 1.079 . . . . 4.5 110.876 169.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.7 mtpm? -73.24 -26.65 61.21 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.575 -1.328 . . . . 4.71 113.415 173.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.0 -49.99 39.11 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.756 1.222 . . . . 1.21 109.921 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.3 mt -56.16 -45.49 79.65 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.319 1.048 . . . . 1.8500000000000001 111.258 171.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.4 m -54.42 -53.34 55.48 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.091 0.956 . . . . 1.77 111.736 171.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 t -67.39 -32.76 73.9 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 120.094 1.315 . . . . 2.2200000000000002 112.172 -178.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 95.4 mtp -59.0 -51.65 69.16 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.412 1.085 . . . . 2.8900000000000001 112.452 169.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.2 m -68.82 -28.55 40.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 CA-C-N 119.153 0.888 . . . . 2.1800000000000002 112.745 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 90.9 m -60.84 -57.02 14.41 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.88 1.272 . . . . 0.85999999999999999 110.089 173.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -57.94 -40.06 79.59 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 122.789 0.436 . . . . 2.21 110.736 172.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -64.14 -47.86 78.29 Favored 'General case' 0 C--N 1.334 -0.077 0 C-N-CA 119.901 -0.719 . . . . 1.97 112.078 -171.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -40.67 74.57 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.881 1.218 . . . . 2.8100000000000001 111.759 178.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -58.37 -47.33 84.17 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.684 1.993 . . . . 3.73 113.427 178.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -70.78 -37.38 73.33 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.827 0.851 . . . . 2.3900000000000001 112.481 168.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.3 m -64.22 -20.59 66.13 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.816 -1.178 . . . . 2.27 113.771 178.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -98.33 40.35 2.51 Favored Glycine 0 CA--C 1.533 1.186 0 C-N-CA 127.501 2.477 . . . . 1.99 113.11 171.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.1 mmp_? -105.08 -17.89 14.34 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.275 1.03 . . . . 4.96 113.169 167.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -175.03 172.41 2.84 Favored 'General case' 0 C--O 1.248 0.984 0 C-N-CA 127.172 2.189 . . . . 4.7000000000000002 110.737 -173.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.57 -135.48 50.57 Favored Glycine 0 C--N 1.337 0.629 0 C-N-CA 124.915 1.245 . . . . 1.97 111.726 171.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.1 m -84.89 164.46 18.38 Favored 'General case' 0 C--O 1.246 0.872 0 CA-C-O 121.494 0.664 . . . . 2.54 112.079 163.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -84.64 156.31 21.6 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.18 0.992 . . . . 4.9299999999999997 110.224 157.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.2 tp 73.15 -2.74 2.64 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.745 2.018 . . . . 3.9300000000000002 112.392 -159.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 61.3 p -138.89 150.41 45.93 Favored 'General case' 0 C--O 1.253 1.272 0 C-N-CA 125.342 1.457 . . . . 0.95999999999999996 113.798 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.1 mt -114.87 109.79 18.68 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.711 2.004 . . . . 1.5600000000000001 111.631 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.9 t -84.42 173.76 10.63 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.042 1.337 . . . . 2.3199999999999998 112.042 167.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -51.36 -41.72 60.83 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 114.724 1.379 . . . . 3.8900000000000001 114.724 -163.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.42 ' HZ2' ' HB2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -82.68 -28.94 30.27 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 120.332 1.424 . . . . 3.7400000000000002 113.414 178.545 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -56.45 -46.09 80.5 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.281 0.946 . . . . 1.7 109.81 166.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -73.09 -41.86 63.61 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.124 0.97 . . . . 2.3300000000000001 111.016 -173.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.74 -41.16 77.04 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.253 -0.905 . . . . 6.4400000000000004 113.28 167.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -70.61 -31.43 68.41 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.943 0.72 . . . . 3.2599999999999998 112.943 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 tt -64.75 -63.48 1.11 Allowed 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.47 -0.937 . . . . 2.23 108.47 174.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.7 mt -56.28 -56.72 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-N 119.044 0.838 . . . . 1.05 112.305 -172.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 mmmm -79.26 4.22 15.67 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.496 1.295 . . . . 5.0599999999999996 114.496 -171.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -112.37 -36.5 5.26 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 117.718 -1.134 . . . . 3.21 113.656 166.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -66.27 -34.15 77.35 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.104 1.361 . . . . 3.9399999999999999 112.81 172.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -105.82 108.72 20.38 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 107.974 -1.121 . . . . 2.3999999999999999 107.974 168.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 28.2 p -80.13 51.99 1.47 Allowed 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.101 0.96 . . . . 4.7699999999999996 113.227 -178.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.5 mp -111.11 153.51 25.59 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.773 2.029 . . . . 4.54 112.722 -170.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -82.91 -17.95 66.44 Favored Glycine 0 CA--C 1.536 1.355 0 O-C-N 121.219 -0.926 . . . . 3.8199999999999998 112.59 166.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -79.34 -157.18 0.12 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 129.561 3.144 . . . . 5.9000000000000004 111.024 178.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.8 tpt 55.86 22.01 5.29 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 123.494 1.616 . . . . 3.1400000000000001 113.589 -178.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.6 tttm -72.03 154.44 41.13 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 113.732 -1.576 . . . . 5.6699999999999999 114.136 -141.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.7 mp0 -66.02 -22.17 66.43 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 116.058 1.873 . . . . 5.5999999999999996 116.058 -134.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.7 t -67.09 -15.23 63.59 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.3 -1.5 . . . . 2.4700000000000002 113.783 171.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.7 t -82.98 -12.23 57.46 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.667 1.187 . . . . 2.9199999999999999 113.4 170.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 18.0 mm -74.87 -35.05 34.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 124.568 1.147 . . . . 1.6899999999999999 110.924 -176.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.92 -33.23 75.23 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.661 1.584 . . . . 3.0600000000000001 110.899 176.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -75.23 -47.39 28.35 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-O 118.397 -0.811 . . . . 2.4199999999999999 111.79 165.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.23 -45.12 68.58 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.581 1.082 . . . . 2.3900000000000001 110.87 -172.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.6 ppp? -62.88 -48.67 77.97 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 122.149 -0.344 . . . . 2.29 111.701 175.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -18.95 47.81 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.406 2.282 . . . . 4.0499999999999998 114.342 173.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.9 m -94.98 -27.63 15.55 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 127.411 2.284 . . . . 3.1699999999999999 112.934 177.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 96.9 mt -76.91 -33.46 57.75 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.366 1.066 . . . . 1.9199999999999999 112.002 165.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -73.35 68.65 1.09 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.985 2.114 . . . . 1.78 112.582 -173.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.1 tttt -54.29 -23.84 16.68 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 127.97 2.508 . . . . 4.5899999999999999 114.009 -175.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -85.06 -23.13 28.69 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.472 1.286 . . . . 2.4100000000000001 114.472 173.057 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.3 t 57.73 63.75 1.73 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.043 1.337 . . . . 2.54 112.432 -167.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -120.12 -108.75 0.35 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.427 2.291 . . . . 2.7400000000000002 109.338 -172.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -142.45 -19.9 0.69 Allowed 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 115.231 1.567 . . . . 6.04 115.231 167.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -132.7 145.5 51.1 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 122.599 1.19 . . . . 2.4700000000000002 110.815 -169.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 8.8 mm -86.88 113.48 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 125.713 1.605 . . . . 1.27 107.666 174.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.34 174.12 11.92 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.767 0.827 . . . . 3.0899999999999999 111.702 167.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -54.5 -38.24 66.25 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-O 122.564 1.173 . . . . 2.2599999999999998 112.163 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -78.45 -22.06 48.17 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.107 2.163 . . . . 3.1200000000000001 113.577 -173.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -79.01 -54.11 6.35 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.213 1.805 . . . . 1.72 109.005 161.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -53.7 -37.72 63.55 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 128.122 2.569 . . . . 2.4399999999999999 115.005 -173.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -20.23 56.7 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 120.988 -1.07 . . . . 2.02 113.755 174.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 53.3 t -70.13 -28.24 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 120.875 -1.141 . . . . 1.79 110.973 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -64.58 -53.56 45.93 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.369 -0.832 . . . . 1.98 110.928 171.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -54.64 -45.79 73.84 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.427 1.091 . . . . 2.1200000000000001 110.548 177.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 88.1 m -53.6 -49.28 68.12 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.373 1.069 . . . . 0.81000000000000005 112.263 176.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 50.4 mtm -62.18 -47.48 84.29 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 118.684 0.675 . . . . 1.3700000000000001 112.596 178.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.8 mt -65.56 -36.75 84.7 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.737 -0.602 . . . . 1.5800000000000001 112.125 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 4.3 t -68.44 -32.34 72.3 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 118.467 -0.777 . . . . 1.3200000000000001 112.477 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -47.72 85.12 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 118.855 0.752 . . . . 3.6899999999999999 110.921 171.185 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.26 -38.02 89.04 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.196 0.907 . . . . 1.6899999999999999 113.086 -175.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -68.68 -29.93 68.5 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.134 0.79 . . . . 2.6699999999999999 113.134 174.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -73.79 -44.27 56.45 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.943 0.792 . . . . 2.3799999999999999 111.669 171.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -72.44 -16.7 61.82 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.435 1.094 . . . . 4.4900000000000002 111.664 -173.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -50.91 -57.83 7.52 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.624 1.97 . . . . 3.1200000000000001 111.682 166.037 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -55.18 -28.9 56.22 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.973 0.909 . . . . 3.79 112.584 176.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 71.6 mt -83.39 -18.47 38.69 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.782 0.833 . . . . 1.96 111.324 -172.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -90.4 -15.32 31.22 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.905 1.446 . . . . 3.7999999999999998 114.905 164.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 . . . . . 0 CA--C 1.55 0.963 0 C-N-CA 124.607 1.163 . . . . 3.4700000000000002 111.818 163.573 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 71.6 p . . . . . 0 N--CA 1.476 0.854 0 CA-C-O 119.692 -0.194 . . . . 1.8999999999999999 111.52 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -62.46 -20.06 69.36 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.005 1.803 . . . . 1.3 112.738 174.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -83.13 -41.72 18.19 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.736 1.215 . . . . 3.2999999999999998 111.949 174.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -58.29 -31.88 67.9 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.606 1.094 . . . . 3.6099999999999999 110.923 164.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.81 -30.46 62.73 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.106 -1.621 . . . . 4.0800000000000001 112.921 172.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.16 -43.35 92.08 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.206 -0.934 . . . . 1.0 111.027 168.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 81.6 mt -61.36 -44.77 96.6 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.429 1.091 . . . . 1.54 111.84 169.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 85.7 m -53.43 -47.2 69.84 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.73 1.212 . . . . 2.1600000000000001 110.543 174.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 27.3 m -59.42 -52.5 65.36 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.041 0.937 . . . . 1.5800000000000001 109.326 174.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 4.3 tpp -50.13 -53.56 26.71 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.943 1.697 . . . . 3.2799999999999998 112.299 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 21.2 m -70.99 -21.27 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 112.706 0.632 . . . . 2.4500000000000002 112.706 -175.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 61.5 m -83.42 -45.29 13.84 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.034 1.333 . . . . 0.84999999999999998 111.283 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -54.61 -41.08 69.52 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.497 -0.557 . . . . 1.6499999999999999 109.497 164.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -71.75 -35.22 70.05 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 120.326 -0.55 . . . . 2.1800000000000002 111.662 -176.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -64.42 -51.12 64.74 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 120.444 -1.41 . . . . 2.6699999999999999 112.095 170.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -55.93 -51.84 66.23 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.924 0.889 . . . . 6.3600000000000003 111.788 177.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.476 ' CD2' HD13 ' B' ' 37' ' ' LEU . 56.1 m-85 -83.43 -34.99 25.35 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 117.372 -1.299 . . . . 1.9399999999999999 112.504 -172.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 60.2 p -68.39 -28.68 67.31 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 121.351 1.887 . . . . 1.6699999999999999 111.733 174.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.27 17.37 5.08 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 125.81 1.671 . . . . 1.7 114.516 170.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 5.6 mmp_? -92.45 62.88 4.03 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 120.372 2.086 . . . . 6.6100000000000003 109.608 166.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 71.2 -177.91 0.21 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.195 1.398 . . . . 4.3300000000000001 112.123 -175.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.72 -146.0 50.14 Favored Glycine 0 CA--C 1.53 0.988 0 N-CA-C 109.829 -1.309 . . . . 2.1699999999999999 109.829 -156.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 73.3 m -78.67 153.97 30.54 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.277 -1.131 . . . . 3.5099999999999998 111.405 161.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 15.4 ttpt -68.24 55.81 0.07 Allowed 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 125.344 1.458 . . . . 7.7699999999999996 111.153 160.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -170.88 -31.99 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 126.42 1.888 . . . . 3.2999999999999998 111.658 -165.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 20.7 p -119.34 151.58 38.22 Favored 'General case' 0 C--O 1.242 0.694 0 C-N-CA 125.764 1.626 . . . . 1.0800000000000001 113.422 -175.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 87.4 mt -114.53 119.44 36.82 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.274 2.23 . . . . 1.77 112.243 178.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 4.8 t -104.18 179.22 4.34 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 113.506 0.928 . . . . 2.98 113.506 162.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 31.0 ttp180 -56.16 -36.02 67.84 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.71 1.744 . . . . 4.0800000000000001 115.71 -161.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -29.04 64.0 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 120.457 -1.402 . . . . 5.4800000000000004 113.452 173.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -72.22 -51.68 19.93 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 108.006 -1.109 . . . . 2.1000000000000001 108.006 177.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 mt -67.71 -33.15 74.33 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-O 117.475 -1.25 . . . . 2.5 113.884 176.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.7 ttmt -53.13 -48.63 67.75 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 120.816 1.644 . . . . 3.46 111.788 170.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -66.38 -45.54 79.7 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.378 0.881 . . . . 3.8599999999999999 113.378 176.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . 0.476 HD13 ' CD2' ' B' ' 19' ' ' TYR . 55.1 tp -74.05 -45.24 50.72 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 117.682 -1.152 . . . . 2.04 112.572 -175.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 28.6 mt -57.25 -52.43 56.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 CA-C-N 121.041 1.746 . . . . 1.3700000000000001 107.999 176.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . 0.344 0.0 OUTLIER -70.49 8.46 0.82 Allowed 'General case' 0 CA--C 1.558 1.268 0 CA-C-O 122.022 0.915 . . . . 5.4900000000000002 113.106 -178.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 10.1 mmtm -118.99 -29.6 5.23 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 127.158 2.183 . . . . 5.8200000000000003 115.696 170.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -67.86 -29.73 68.94 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.964 1.256 . . . . 5.6100000000000003 109.706 160.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.451 HD21 HD11 ' B' ' 79' ' ' LEU . 3.7 mm? -111.49 63.86 0.62 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 126.391 1.877 . . . . 2.6400000000000001 109.015 170.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.9 t -62.72 -33.69 75.64 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 120.443 -1.411 . . . . 3.3999999999999999 111.945 -178.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.421 HD23 ' H ' ' B' ' 44' ' ' LEU . 1.8 pt? -90.49 -5.0 56.57 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.022 1.729 . . . . 4.0 114.996 172.227 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -103.79 10.98 52.97 Favored Glycine 0 N--CA 1.475 1.296 0 CA-C-O 118.401 -1.222 . . . . 3.4300000000000002 115.915 -162.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 70.87 -83.52 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.339 1.855 . . . . 5.6299999999999999 112.663 169.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 1.1 mmt 70.71 87.91 0.11 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 128.455 2.702 . . . . 3.3599999999999999 113.309 -168.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 mttp -61.59 133.61 55.85 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.655 -1.278 . . . . 3.5899999999999999 110.951 166.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -36.06 -56.89 0.72 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 127.12 2.168 . . . . 3.7999999999999998 114.998 -177.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 29.3 t -67.28 -15.01 63.44 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.389 1.255 . . . . 3.4100000000000001 114.389 -176.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 10.5 t -85.43 -12.51 51.82 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.405 1.002 . . . . 2.3100000000000001 112.796 171.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 71.3 mt -77.74 -37.53 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 CA-C-N 119.316 0.962 . . . . 2.7599999999999998 109.871 179.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -70.79 -39.93 72.85 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.718 1.207 . . . . 2.9100000000000001 113.108 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -68.77 -40.25 79.8 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 118.489 0.586 . . . . 2.9900000000000002 111.4 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 25.4 tp -59.23 -48.42 81.68 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 117.429 -1.272 . . . . 1.8999999999999999 110.437 172.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 58.0 mmm -50.18 -48.83 53.86 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 120.158 1.344 . . . . 2.29 111.823 173.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -16.82 48.83 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.107 1.763 . . . . 4.2800000000000002 113.994 175.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.13 -31.9 12.23 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.399 1.48 . . . . 2.2599999999999998 113.659 171.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . 0.453 HD22 ' HB2' ' B' ' 75' ' ' PHE . 13.1 mt -76.21 -24.13 54.65 Favored 'General case' 0 N--CA 1.463 0.186 0 O-C-N 120.933 -1.104 . . . . 1.99 111.56 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -94.04 149.05 21.58 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.504 1.122 . . . . 1.98 113.664 168.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -99.78 -11.76 20.53 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.734 1.614 . . . . 3.6800000000000002 113.169 172.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.63 -62.79 1.53 Allowed 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.342 0.868 . . . . 1.8200000000000001 113.342 -157.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 58.6 m 109.98 12.57 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.116 1 C-N-CA 132.332 4.253 . . . . 2.77 111.667 -157.146 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 48.0 p-10 -83.82 8.18 15.62 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 119.377 -2.077 . . . . 2.71 112.289 -165.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 55.18 2.05 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 130.564 3.546 . . . . 4.1699999999999999 115.923 -166.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -131.88 121.14 23.57 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 125.499 1.52 . . . . 2.8100000000000001 111.342 -168.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 2.8 mp -93.06 103.84 15.1 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.398 1.479 . . . . 1.8500000000000001 107.736 177.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.24 160.18 32.65 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.268 1.427 . . . . 3.3599999999999999 111.517 169.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -47.69 -46.93 29.89 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.579 1.551 . . . . 2.2599999999999998 112.512 -179.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -69.2 -17.45 63.8 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.817 0.847 . . . . 4.8099999999999996 112.776 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -84.44 -51.96 6.53 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.592 1.157 . . . . 1.9199999999999999 109.966 170.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -53.13 -25.81 14.54 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.89 2.476 . . . . 1.75 114.14 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.27 -20.17 65.22 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.776 -1.202 . . . . 2.5099999999999998 111.426 177.53 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.3 p -70.45 -31.32 46.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 O-C-N 120.79 -1.194 . . . . 2.0699999999999998 112.252 172.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . 0.453 ' HB2' HD22 ' B' ' 59' ' ' LEU . 10.7 t80 -63.36 -56.16 18.61 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 108.682 -0.858 . . . . 1.8100000000000001 108.682 174.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 96.2 mt -53.88 -39.56 65.81 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.832 1.253 . . . . 1.4099999999999999 112.385 175.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 97.8 m -62.16 -53.58 53.28 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.294 1.038 . . . . 0.94999999999999996 111.862 176.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 19.7 ptp -68.82 -32.87 72.88 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 118.604 0.638 . . . . 1.8500000000000001 112.64 -177.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.451 HD11 HD21 ' B' ' 42' ' ' LEU . 2.0 mm? -65.64 -49.69 67.77 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.043 0.937 . . . . 2.4300000000000002 112.277 170.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 12.8 t -65.45 -32.0 73.38 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.035 0.383 . . . . 1.6599999999999999 112.035 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -45.9 92.84 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.837 0.744 . . . . 2.6000000000000001 112.255 167.034 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.02 -40.73 94.68 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.176 0.898 . . . . 0.80000000000000004 111.89 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -60.95 -24.8 66.35 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.431 1.271 . . . . 2.04 114.431 176.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -70.03 -42.55 72.8 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.636 1.107 . . . . 1.98 111.909 174.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -69.8 -41.3 75.23 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.959 0.904 . . . . 3.02 110.315 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -51.45 -53.09 40.62 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.581 1.552 . . . . 2.3100000000000001 110.9 169.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -61.96 -24.25 66.89 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.54 1.536 . . . . 2.9399999999999999 113.705 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 47.0 mt -79.7 -23.44 42.4 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.529 -1.357 . . . . 1.8600000000000001 112.456 174.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -94.55 -6.69 43.09 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.74 1.385 . . . . 4.04 114.74 170.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -86.38 -37.57 18.28 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 127.35 2.26 . . . . 3.7400000000000002 113.488 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -82.33 49.55 1.45 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.193 1.797 . . . . 3.8399999999999999 113.244 -167.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? . . . . . 0 C--O 1.252 1.219 0 C-N-CA 128.095 2.558 . . . . 7.71 114.334 178.06 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 . . . . . 0 CA--C 1.54 0.594 0 N-CA-C 112.821 0.674 . . . . 3.75 112.821 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 66.2 p -153.17 162.43 26.47 Favored Pre-proline 0 N--CA 1.472 0.665 0 C-N-CA 124.893 1.277 . . . . 1.8500000000000001 111.61 -161.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -64.5 -11.75 30.06 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 122.426 2.084 . . . . 1.6000000000000001 113.128 166.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.91 -38.05 15.94 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.104 1.362 . . . . 2.5800000000000001 111.471 178.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -55.44 -50.5 69.67 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 108.961 -0.755 . . . . 4.8499999999999996 108.961 159.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.428 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -59.18 -31.08 68.68 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.665 -0.647 . . . . 3.7599999999999998 112.6 177.063 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.34 -53.69 39.95 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.429 0.692 . . . . 1.21 110.861 172.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 44.8 mt -54.77 -44.75 73.95 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.058 0.943 . . . . 1.95 112.234 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.8 p -69.37 -36.87 77.25 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 117.844 -1.074 . . . . 2.2599999999999998 112.447 176.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.4 m -62.32 -39.92 94.62 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 120.292 1.405 . . . . 1.3500000000000001 111.564 171.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 72.8 mtp -60.59 -51.92 67.37 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.067 0.947 . . . . 3.21 112.173 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.3 p -63.46 -34.37 67.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 CA-C-N 118.692 0.678 . . . . 2.52 111.506 173.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 85.3 m -61.74 -53.71 52.31 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 117.923 -1.037 . . . . 0.81999999999999995 111.067 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.5 p -55.97 -43.29 77.43 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.036 0.835 . . . . 2.23 109.559 172.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -64.64 -54.63 28.84 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.302 0.376 . . . . 1.98 111.51 -169.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.7 -32.65 73.45 Favored 'General case' 0 CA--C 1.548 0.869 0 O-C-N 121.544 -0.723 . . . . 2.5099999999999998 111.831 179.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -76.81 -12.87 60.04 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.453 1.279 . . . . 4.1699999999999999 114.453 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -92.43 -33.24 14.61 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 119.527 1.058 . . . . 2.46 112.56 155.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.8 p -42.76 -48.3 5.6 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 117.389 2.366 . . . . 3.7799999999999998 117.389 -163.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -88.01 4.82 85.49 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 125.393 1.473 . . . . 1.95 114.319 -173.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 35.3 mtp180 -92.6 50.26 1.57 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.663 1.232 . . . . 5.5 108.957 175.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 115.34 151.76 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.877 1 C-N-CA 131.832 4.053 . . . . 4.4000000000000004 111.455 -177.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.86 -159.99 48.51 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 120.752 -1.218 . . . . 2.27 113.391 -179.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.4 t -75.22 161.91 28.93 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.885 -0.773 . . . . 3.77 111.981 172.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.0 mmtp -49.96 -24.92 2.84 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.279 1.432 . . . . 4.7199999999999998 112.404 155.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 18.9 tp -93.47 -13.64 27.65 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 117.35 -1.309 . . . . 3.8500000000000001 114.095 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 53.7 p -128.04 145.04 51.11 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-N 120.714 1.597 . . . . 0.96999999999999997 114.983 -168.012 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.8 mt -101.19 120.44 40.23 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.772 1.629 . . . . 1.5800000000000001 111.876 170.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.4 p -78.37 171.81 14.53 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.961 1.467 . . . . 2.9700000000000002 114.961 -177.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -45.43 -27.6 0.73 Allowed 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 115.021 1.489 . . . . 3.3700000000000001 115.021 167.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.93 -38.97 6.43 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.863 1.265 . . . . 3.8599999999999999 113.148 -178.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -67.63 -30.06 69.53 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.062 1.345 . . . . 2.1899999999999999 111.584 175.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.2 tp -75.33 -47.97 25.3 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.097 0.959 . . . . 1.8700000000000001 112.417 173.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -15.2 57.59 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.95 1.463 . . . . 4.79 114.95 -172.639 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -94.87 -39.23 10.34 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.951 1.093 . . . . 4.6299999999999999 113.951 175.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 39.6 tp -58.33 -50.78 72.43 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.469 1.031 . . . . 2.3599999999999999 111.558 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.1 mt -52.51 -57.09 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-O 121.628 0.728 . . . . 0.98999999999999999 109.081 175.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.404 ' HE2' ' OE1' ' A' ' 49' ' ' GLU . 25.9 ttpp -67.11 -8.3 29.71 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.254 1.205 . . . . 3.8399999999999999 114.254 -176.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.9 mmtm -95.27 -33.43 12.57 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 125.358 1.463 . . . . 3.7999999999999998 112.212 172.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -68.61 -66.96 0.51 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.086 1.754 . . . . 4.9500000000000002 110.045 169.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -70.52 22.54 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 126.667 1.987 . . . . 2.8300000000000001 113.667 176.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 12.9 t -67.36 2.27 1.78 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.708 2.003 . . . . 3.29 113.951 177.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -68.96 -10.99 60.23 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.638 0.775 . . . . 4.79 112.639 167.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 145.38 13.08 0.22 Allowed Glycine 0 CA--C 1.528 0.889 0 CA-C-O 117.909 -1.495 . . . . 3.5699999999999998 116.709 169.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -124.49 -175.13 3.18 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.674 1.737 . . . . 4.71 113.282 -176.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 63.35 33.84 13.59 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-O 123.552 1.644 . . . . 2.3300000000000001 113.686 169.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.409 ' H ' ' HD2' ' A' ' 48' ' ' LYS . 2.7 mptt -59.77 151.75 24.61 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 113.359 -1.746 . . . . 5.0999999999999996 110.429 166.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.404 ' OE1' ' HE2' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -44.31 -44.12 7.9 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.941 1.46 . . . . 4.3799999999999999 114.941 -165.93 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.0 t -63.73 -15.57 58.89 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 115.061 1.504 . . . . 2.96 115.061 -178.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 43.4 m -90.02 -7.8 53.08 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.371 0.987 . . . . 2.1299999999999999 113.091 172.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 45.2 mt -88.25 -35.75 8.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 117.745 -1.122 . . . . 1.5700000000000001 113.326 -166.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.87 -25.75 64.78 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.427 1.467 . . . . 2.6699999999999999 113.197 -176.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.55 -44.09 71.61 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.899 0.772 . . . . 3.3999999999999999 111.169 164.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 tp -62.54 -43.49 98.68 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 118.611 -0.709 . . . . 2.1099999999999999 109.922 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.5 tpt -53.93 -53.96 45.49 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 125.914 1.686 . . . . 1.49 110.791 170.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.83 -35.67 64.19 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.008 1.323 . . . . 4.2699999999999996 113.147 176.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 61.3 m -86.69 -33.3 20.09 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 126.15 1.78 . . . . 1.99 111.964 -173.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.555 HD11 ' HB2' ' A' ' 75' ' ' PHE . 1.8 mm? -69.57 -42.78 74.07 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 126.776 2.03 . . . . 2.5 112.015 169.45 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -74.72 63.09 1.11 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 123.384 1.564 . . . . 1.51 110.77 -176.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -69.84 -4.95 22.5 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.83 1.252 . . . . 5.5099999999999998 113.427 -164.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -110.5 -5.69 15.08 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.85 2.46 . . . . 2.4900000000000002 113.785 171.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 37.7 t 58.69 64.55 1.41 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.074 1.35 . . . . 2.73 112.797 172.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -115.07 -88.97 0.56 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.384 1.473 . . . . 2.8100000000000001 108.67 176.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -173.19 -26.32 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.746 2.419 . . . . 6.1799999999999997 114.724 -176.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -124.78 163.22 22.6 Favored 'General case' 0 C--O 1.243 0.729 0 CA-C-O 123.249 1.5 . . . . 3.1000000000000001 111.944 175.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.6 mm -104.95 100.08 9.8 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.882 2.473 . . . . 1.03 110.401 -178.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -66.16 163.13 18.31 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.538 0.735 . . . . 3.7999999999999998 111.636 167.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -47.13 -42.32 19.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.603 0.761 . . . . 2.1000000000000001 112.882 -178.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 -30.39 67.03 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 120.895 -1.128 . . . . 7.7400000000000002 112.649 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -68.3 -54.36 18.02 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 107.855 -1.165 . . . . 1.96 107.855 171.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -51.2 -37.34 46.13 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.864 2.066 . . . . 2.5499999999999998 114.401 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.0 p -66.17 -14.89 62.6 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 120.307 -1.496 . . . . 1.6399999999999999 114.647 173.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 44.7 t -71.82 -33.02 46.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 CA-C-N 120.441 1.473 . . . . 2.1400000000000001 111.212 171.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.555 ' HB2' HD11 ' A' ' 59' ' ' LEU . 19.4 t80 -56.32 -54.72 42.09 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.466 1.03 . . . . 1.74 110.637 172.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 67.0 mt -64.07 -30.49 71.56 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.165 0.986 . . . . 1.8700000000000001 111.864 -178.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 15.3 m -68.13 -50.98 51.22 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.284 0.947 . . . . 0.87 111.942 170.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 65.3 mtp -51.87 -48.01 64.23 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.182 0.901 . . . . 1.8600000000000001 111.088 177.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 99.6 mt -65.45 -48.68 71.88 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.086 0.955 . . . . 1.22 112.599 176.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 34.6 t -64.84 -33.04 75.06 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.352 0.978 . . . . 1.8400000000000001 113.213 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 88.7 mtp -63.39 -46.59 85.73 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 118.687 0.676 . . . . 1.76 110.813 168.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.94 -42.94 97.18 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.626 0.602 . . . . 1.1100000000000001 112.626 -178.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -65.39 -25.71 67.68 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.574 -0.704 . . . . 2.7200000000000002 112.346 178.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -69.56 -37.21 76.94 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.103 0.865 . . . . 3.2200000000000002 112.351 173.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -70.65 -47.46 59.88 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.979 1.312 . . . . 2.8100000000000001 110.703 172.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -52.41 -47.42 66.32 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 126.09 1.756 . . . . 2.8999999999999999 110.98 177.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -53.53 -33.1 53.32 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.504 1.522 . . . . 2.5600000000000001 113.045 177.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 24.7 mt -81.86 -20.73 38.31 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.99 0.916 . . . . 1.5800000000000001 112.506 -177.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -96.5 -7.85 33.61 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.641 1.348 . . . . 2.9399999999999999 114.641 172.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 23.7 t70 . . . . . 0 CA--C 1.538 0.496 0 C-N-CA 126.89 2.076 . . . . 3.71 112.686 -174.081 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . 0.4 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 1.2 p . . . . . 0 N--CA 1.483 1.213 0 CA-C-O 118.77 -0.633 . . . . 1.97 109.769 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . 0.4 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 92.1 Cg_endo -81.8 -15.04 9.73 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 121.759 1.639 . . . . 1.8200000000000001 113.139 166.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.26 -39.31 68.49 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.604 1.093 . . . . 2.48 111.967 -174.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -50.69 -55.46 16.42 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.604 0.762 . . . . 5.1200000000000001 110.522 167.496 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 43.4 mttm -67.54 -19.23 65.26 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.221 -0.924 . . . . 3.7799999999999998 112.365 -176.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.59 -43.17 39.83 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.018 1.327 . . . . 0.87 111.891 171.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 56.7 mt -61.47 -44.62 96.78 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.177 1.391 . . . . 1.51 111.69 169.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 88.2 m -58.26 -48.99 78.7 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.542 1.537 . . . . 1.27 110.445 171.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 23.2 m -54.92 -49.96 70.0 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 119.539 1.063 . . . . 1.3 110.897 175.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 14.9 mmm -50.68 -51.46 49.18 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.684 1.194 . . . . 2.8300000000000001 112.623 174.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 4.0 t -59.31 -40.7 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.848 0.859 . . . . 1.78 112.34 175.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 87.9 m -72.28 -44.12 63.25 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.766 1.627 . . . . 0.90000000000000002 111.753 -173.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 19.2 p -67.74 -44.88 76.53 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 108.913 -0.773 . . . . 1.76 108.913 172.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -63.57 -53.65 48.41 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 123.597 0.561 . . . . 2.3599999999999999 110.518 -173.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -66.19 -30.01 70.4 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 112.506 0.558 . . . . 2.5899999999999999 112.506 -178.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 19.4 ttmm -70.91 -47.06 61.22 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 120.868 -1.145 . . . . 4.0999999999999996 112.117 176.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -73.18 -32.95 65.14 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.351 -0.843 . . . . 2.21 112.486 176.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 53.1 p -68.44 -29.02 67.58 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-N 119.666 1.121 . . . . 1.6299999999999999 113.012 176.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.35 -5.91 84.59 Favored Glycine 0 C--N 1.342 0.88 0 C-N-CA 127.625 2.536 . . . . 1.5 114.756 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -64.48 -41.68 96.33 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.896 1.848 . . . . 3.2799999999999998 111.392 175.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -147.93 156.02 42.22 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 123.252 1.501 . . . . 3.48 114.799 -173.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.43 -126.79 43.21 Favored Glycine 0 C--N 1.34 0.765 0 C-N-CA 127.156 2.313 . . . . 1.8500000000000001 111.123 171.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 2.3 m -54.53 116.31 2.6 Favored 'General case' 0 C--O 1.249 1.035 0 CA-C-O 121.207 0.527 . . . . 4.0899999999999999 109.736 162.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -18.81 60.65 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.445 0.906 . . . . 6.4500000000000002 113.445 -176.061 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.476 ' H ' HD23 ' B' ' 27' ' ' LEU . 2.0 pt? -91.27 -13.71 32.2 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.622 1.569 . . . . 4.2599999999999998 113.58 177.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -127.86 162.27 27.09 Favored 'General case' 0 C--O 1.249 1.042 0 N-CA-C 114.226 1.195 . . . . 1.54 114.226 -178.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 91.8 mt -107.16 108.51 20.0 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.89 2.476 . . . . 1.72 111.592 -178.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 95.9 p -70.72 163.37 27.31 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 121.26 -0.9 . . . . 2.1899999999999999 113.211 164.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -42.28 -38.16 1.72 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 125.642 1.577 . . . . 6.3499999999999996 114.545 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.63 -28.0 25.06 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 116.438 2.014 . . . . 4.0999999999999996 116.438 176.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -67.53 -48.64 66.41 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 120.103 1.32 . . . . 1.6699999999999999 109.221 166.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 24.6 tp -58.07 -42.95 86.63 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.679 1.191 . . . . 1.8300000000000001 111.827 177.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -51.37 -40.79 59.91 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.915 0.886 . . . . 3.5699999999999998 111.885 177.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -64.33 -51.98 60.7 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.948 0.499 . . . . 2.9700000000000002 110.364 177.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 29.6 tp -57.65 -55.24 37.35 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 117.067 -1.444 . . . . 2.25 111.0 -178.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 30.7 mt -54.46 -51.44 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-N 120.201 1.364 . . . . 0.98999999999999999 110.469 178.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 44.1 tttm -65.89 -18.53 65.4 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.755 1.02 . . . . 4.4299999999999997 113.755 -176.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm -85.78 -59.75 2.22 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.752 1.621 . . . . 3.1600000000000001 110.609 168.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 72.3 tt0 -43.54 -62.52 1.06 Allowed 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 130.97 3.708 . . . . 5.1600000000000001 112.846 -177.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -82.22 -37.65 25.69 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.296 1.038 . . . . 3.4300000000000002 111.939 178.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 8.2 t 70.33 -44.44 0.57 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 127.691 2.396 . . . . 3.2400000000000002 114.998 175.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -63.31 -4.24 2.46 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 117.351 2.352 . . . . 3.2799999999999998 117.351 -167.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.48 16.55 77.71 Favored Glycine 0 N--CA 1.474 1.215 0 O-C-N 120.812 -1.18 . . . . 3.9300000000000002 115.105 173.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -46.05 -71.36 0.08 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 127.45 2.3 . . . . 7.9800000000000004 112.204 176.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.84 125.46 26.89 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.944 0.878 . . . . 2.7799999999999998 111.431 173.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -87.18 173.88 8.96 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.836 -0.54 . . . . 3.5 109.809 166.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.01 -37.5 74.41 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 115.062 1.504 . . . . 3.4700000000000002 115.062 -169.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 13.1 t -72.59 -11.15 60.53 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 114.148 1.166 . . . . 2.7400000000000002 114.148 172.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 1.7 m -94.17 -31.68 14.04 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.992 1.717 . . . . 2.8700000000000001 111.544 172.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 86.6 mt -65.99 -32.96 60.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.293 0.637 . . . . 1.76 110.718 170.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.0 -66.12 0.56 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.232 1.013 . . . . 3.0800000000000001 111.207 176.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.61 -24.64 62.78 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 113.885 1.068 . . . . 3.9199999999999999 113.885 -173.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.77 -52.96 63.46 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.52 0.728 . . . . 2.21 109.992 164.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -60.89 -49.47 77.34 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.377 1.071 . . . . 1.6499999999999999 111.922 -179.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 24.8 mtpt -57.16 -36.22 70.5 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.44 1.096 . . . . 5.1200000000000001 113.011 173.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 52.1 m -75.07 -30.64 61.02 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 120.956 -1.09 . . . . 2.6400000000000001 113.479 177.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 mp -65.34 -52.8 51.41 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 118.031 -0.985 . . . . 2.8799999999999999 110.504 167.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -73.93 74.91 1.66 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.322 2.249 . . . . 1.45 114.343 -169.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . 0.496 ' HZ3' HG11 ' B' ' 74' ' ' VAL . 14.8 mptt -53.96 -27.57 32.12 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 115.113 1.523 . . . . 3.4700000000000002 115.113 -176.542 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -88.25 -15.28 36.29 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.723 1.209 . . . . 1.8799999999999999 113.379 177.529 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 29.4 t 58.17 32.05 21.54 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.473 1.109 . . . . 2.1600000000000001 112.552 -176.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -84.47 -0.24 52.19 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.378 1.471 . . . . 2.3500000000000001 112.02 -175.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 82.3 -0.96 1.42 Allowed 'General case' 0 C--O 1.238 0.477 0 C-N-CA 130.36 3.464 . . . . 4.4800000000000004 113.204 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -126.38 135.21 51.16 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 123.045 1.403 . . . . 2.27 113.106 178.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 21.3 mm -74.58 100.0 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-N 115.016 -0.993 . . . . 1.49 109.232 170.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.35 158.31 31.91 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.293 1.037 . . . . 4.9900000000000002 109.846 169.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.57 -35.17 53.36 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 120.517 -1.364 . . . . 2.8599999999999999 113.496 175.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.451 ' HD3' ' H ' ' B' ' 70' ' ' LYS . 1.0 OUTLIER -67.18 -25.96 66.4 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.862 0.865 . . . . 5.2599999999999998 112.48 177.45 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -88.03 -40.74 13.6 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.246 1.418 . . . . 2.2799999999999998 110.35 174.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -54.78 -23.67 19.05 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 120.39 -1.444 . . . . 2.1000000000000001 113.059 173.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 36.1 t -65.8 -30.61 71.28 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.518 1.527 . . . . 2.3300000000000001 112.989 174.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.496 HG11 ' HZ3' ' B' ' 61' ' ' LYS . 0.9 OUTLIER -86.85 -28.57 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.714 0.805 . . . . 2.48 111.544 -176.974 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -58.93 -67.03 0.41 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.945 1.298 . . . . 1.6100000000000001 111.396 179.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -59.92 -36.77 77.71 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.452 1.101 . . . . 3.71 112.0 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 31.5 m -51.19 -54.35 26.33 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.664 0.786 . . . . 0.97999999999999998 110.492 173.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.4 mtm -58.68 -46.11 87.94 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 118.544 0.611 . . . . 1.5900000000000001 111.593 179.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.08 -45.54 94.32 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.147 0.579 . . . . 1.48 112.436 178.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.4 t -72.68 -29.41 63.38 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.328 -0.857 . . . . 2.0800000000000001 113.1 -178.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 91.5 mtp -69.9 -39.45 76.2 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 118.79 -0.624 . . . . 2.0499999999999998 110.948 170.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.65 -36.16 81.93 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.493 1.042 . . . . 0.85999999999999999 112.524 173.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -68.26 -35.43 77.89 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.083 1.142 . . . . 2.5699999999999998 114.083 170.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 17.1 t30 -64.72 -42.38 95.28 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.521 1.055 . . . . 1.74 112.607 171.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -73.43 -24.7 60.28 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.11 0.964 . . . . 4.0199999999999996 111.186 -177.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -55.98 26.53 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.492 1.517 . . . . 2.7400000000000002 112.104 160.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -57.46 -26.62 61.51 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.862 1.665 . . . . 2.3100000000000001 112.3 -179.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 55.0 mt -77.05 -7.89 56.48 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.728 1.381 . . . . 2.4399999999999999 114.728 174.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -94.78 -29.78 14.58 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 113.86 1.059 . . . . 4.4699999999999998 113.86 162.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -74.6 -46.91 35.49 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.956 1.302 . . . . 3.6099999999999999 112.464 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -136.77 41.36 2.52 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 127.723 2.409 . . . . 4.4500000000000002 110.874 -165.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 36.8 mttm . . . . . 0 C--O 1.253 1.239 0 C-N-CA 130.386 3.475 . . . . 8.5500000000000007 117.047 -175.607 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 CA--C 1.533 0.322 0 CA-C-O 121.148 0.499 . . . . 3.4199999999999999 111.421 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 67.3 p -110.49 165.2 13.14 Favored Pre-proline 0 N--CA 1.472 0.645 0 C-N-CA 126.474 1.909 . . . . 1.4299999999999999 110.652 -168.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -69.62 -23.09 31.81 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 121.118 1.212 . . . . 1.4199999999999999 112.26 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.34 -40.39 44.28 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.7 1.137 . . . . 2.7000000000000002 113.63 173.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -64.75 -34.44 78.33 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.114 1.325 . . . . 4.0599999999999996 110.625 172.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 59.1 mttt -68.21 -29.02 67.76 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 120.051 -1.656 . . . . 4.5199999999999996 112.255 170.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.13 -50.79 29.76 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.273 1.029 . . . . 1.1000000000000001 111.204 174.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.2 mt -55.9 -43.56 77.41 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.745 1.218 . . . . 1.6899999999999999 111.87 174.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 85.4 m -53.49 -54.71 33.16 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.342 1.057 . . . . 1.77 111.366 168.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.3 m -58.55 -37.24 75.28 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.489 1.115 . . . . 1.3100000000000001 111.924 -179.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 60.0 mtp -61.91 -52.54 63.67 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.032 0.933 . . . . 3.25 111.113 174.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 19.2 m -67.77 -28.25 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 CA-C-N 119.803 1.183 . . . . 2.27 113.299 177.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 57.2 m -58.64 -55.85 29.73 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.891 1.276 . . . . 0.91000000000000003 110.851 174.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -74.53 -34.45 63.01 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 119.304 -0.379 . . . . 2.54 110.275 -176.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.426 ' CZ ' HD23 ' A' ' 29' ' ' LEU . 21.2 t80 -61.66 -51.59 67.8 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 118.397 -0.811 . . . . 1.8200000000000001 110.999 176.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -66.29 -39.25 89.25 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 120.307 1.412 . . . . 2.5899999999999999 112.23 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -53.71 52.65 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.756 1.222 . . . . 4.9299999999999997 113.097 176.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -74.13 -32.2 63.07 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.358 -0.839 . . . . 2.46 112.091 176.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.5 t -58.79 -38.6 78.91 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 120.429 1.468 . . . . 2.1699999999999999 114.145 178.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.55 -6.17 83.74 Favored Glycine 0 CA--C 1.528 0.85 0 CA-C-O 117.958 -1.468 . . . . 1.96 115.184 -171.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -69.0 -41.56 77.63 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.239 1.519 . . . . 6.79 112.616 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -149.98 143.49 25.24 Favored 'General case' 0 C--O 1.247 0.93 0 C-N-CA 124.217 1.007 . . . . 4.6100000000000003 110.551 -154.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.39 -131.8 34.4 Favored Glycine 0 C--N 1.337 0.592 0 CA-C-N 114.522 -1.217 . . . . 1.99 110.973 -178.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.9 m -65.4 155.02 36.72 Favored 'General case' 0 C--O 1.247 0.973 0 C-N-CA 123.896 0.878 . . . . 2.79 112.995 170.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -112.86 10.73 19.1 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 115.037 1.495 . . . . 4.6100000000000003 115.037 170.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.8 mp -93.11 -1.66 56.22 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.339 1.056 . . . . 4.3799999999999999 111.485 167.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -159.7 148.29 17.56 Favored 'General case' 0 C--O 1.247 0.972 0 C-N-CA 126.841 2.056 . . . . 1.8 110.915 -157.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.426 HD23 ' CZ ' ' A' ' 16' ' ' PHE . 3.1 mm? -96.21 103.14 15.02 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 113.859 -1.518 . . . . 2.79 108.354 175.109 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.3 p -70.95 155.93 40.23 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.854 -1.066 . . . . 2.7599999999999998 110.348 171.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.1 ttm-85 -40.56 -50.9 2.98 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.665 1.186 . . . . 3.8399999999999999 113.897 -169.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -74.16 -30.33 62.21 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 115.39 1.626 . . . . 5.96 115.39 -175.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -58.12 -44.93 88.02 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.165 0.586 . . . . 1.96 111.227 166.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.73 -46.48 65.81 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.246 1.018 . . . . 2.9900000000000002 110.854 -175.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.1 ttmt -60.31 -44.29 95.56 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.43 -1.419 . . . . 4.1100000000000003 112.702 177.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.12 -43.2 87.09 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 114.026 1.121 . . . . 5.1799999999999997 114.026 168.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.9 tp -62.01 -54.01 47.57 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.4 1.08 . . . . 2.1899999999999999 111.149 179.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.7 mt -56.51 -44.52 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 CA-C-N 118.893 0.77 . . . . 0.90000000000000002 109.962 175.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -67.96 -18.98 64.91 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 114.149 1.166 . . . . 3.9300000000000002 114.149 -176.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -91.81 -40.48 11.19 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.57 1.548 . . . . 3.0699999999999998 112.498 -179.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -81.29 -26.38 35.77 Favored 'General case' 0 CA--C 1.552 1.041 0 O-C-N 124.413 1.071 . . . . 4.6600000000000001 111.815 176.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.0 mt -133.62 131.74 39.96 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 123.277 1.513 . . . . 2.71 113.442 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 4.3 t -149.15 7.51 0.71 Allowed 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.508 1.67 . . . . 4.4800000000000004 115.508 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -87.43 170.35 11.45 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.327 1.051 . . . . 3.3799999999999999 111.556 170.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.55 -131.08 26.44 Favored Glycine 0 N--CA 1.472 1.079 0 N-CA-C 109.977 -1.249 . . . . 3.73 109.977 -172.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -119.89 86.28 2.53 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.666 0.746 . . . . 7.29 109.137 148.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.0 tpt -74.65 78.47 2.02 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 120.51 -1.369 . . . . 2.1400000000000001 109.287 169.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.9 tttm -89.44 151.37 22.05 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.799 1.407 . . . . 6.0899999999999999 114.799 -157.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.3 -40.31 81.64 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.589 0.959 . . . . 4.5199999999999996 113.589 174.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.7 t -83.84 -41.76 17.15 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.134 0.974 . . . . 2.77 113.458 174.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.9 m -61.92 -24.82 67.21 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.492 1.117 . . . . 2.8799999999999999 112.442 177.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 65.8 mt -69.51 -28.13 36.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 124.265 1.026 . . . . 1.29 113.111 167.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.92 -30.19 68.61 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.958 1.708 . . . . 2.7799999999999998 112.123 -176.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -79.68 -35.77 38.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.747 0.819 . . . . 3.1699999999999999 112.401 168.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.9 tp -59.63 -32.42 70.42 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.559 -0.713 . . . . 2.02 111.236 170.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 6.0 tpt -55.16 -46.78 75.75 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.292 1.437 . . . . 1.8700000000000001 111.517 173.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -65.87 -29.28 69.71 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.799 1.24 . . . . 3.1899999999999999 112.524 171.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.9 t -75.35 -31.29 60.49 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.041 0.936 . . . . 2.1400000000000001 112.794 177.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.0 mp -71.38 -55.55 7.75 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.39 1.076 . . . . 2.7999999999999998 111.348 167.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -70.78 148.5 47.84 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 113.07 0.767 . . . . 2.1200000000000001 113.07 -168.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm -125.44 7.54 7.69 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.758 1.223 . . . . 3.3700000000000001 113.0 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -122.17 -21.19 5.98 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.587 1.155 . . . . 2.5699999999999998 112.995 176.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 7.8 t 74.35 20.89 2.49 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.408 2.283 . . . . 2.2200000000000002 112.584 -171.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 p30 -83.4 -23.75 32.24 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.928 2.091 . . . . 1.97 112.287 -163.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 73.59 19.23 3.35 Favored 'General case' 0 CA--C 1.548 0.874 1 C-N-CA 132.1 4.16 . . . . 3.8399999999999999 113.736 -172.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -121.85 122.57 39.74 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 128.719 2.808 . . . . 3.71 109.211 169.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 18.2 mm -91.47 107.75 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 O-C-N 120.652 -1.28 . . . . 1.1100000000000001 110.441 175.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 59.1 t0 -74.85 151.81 38.98 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 127.07 2.148 . . . . 2.7599999999999998 109.66 164.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -46.33 -43.61 16.11 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 115.299 1.592 . . . . 2.25 115.299 -177.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.458 ' H ' ' HD2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -69.98 -21.59 63.22 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 113.831 1.048 . . . . 3.0299999999999998 113.831 178.673 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -74.03 -53.36 10.19 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.718 1.207 . . . . 1.6699999999999999 108.634 165.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -52.9 -30.04 31.89 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 120.304 -1.497 . . . . 2.23 114.401 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 33.1 t -40.76 -45.1 2.36 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.125 1.77 . . . . 3.21 113.284 165.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.3 m -75.05 -27.99 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 CA-C-N 118.925 0.784 . . . . 2.3399999999999999 112.419 -172.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -59.25 -58.23 9.53 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 118.724 0.693 . . . . 1.79 110.499 168.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 38.3 mt -65.42 -29.61 70.33 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.517 0.727 . . . . 1.5600000000000001 111.902 -177.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.0 m -65.91 -46.64 77.53 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.331 1.052 . . . . 0.94999999999999996 111.196 174.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 59.0 mtm -61.45 -47.79 84.09 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.668 1.122 . . . . 1.5600000000000001 112.116 177.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 96.7 mt -62.21 -44.85 95.65 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.737 0.815 . . . . 1.29 112.002 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 16.3 t -66.49 -35.2 79.68 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 113.012 0.745 . . . . 1.78 113.012 175.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.1 -41.3 96.41 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.009 0.744 . . . . 3.1400000000000001 113.009 174.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.54 -38.1 86.41 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 118.53 -0.748 . . . . 1.26 111.468 174.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -63.05 -28.17 69.91 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 120.011 1.278 . . . . 2.73 114.059 176.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -60.55 -52.04 66.85 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.869 1.213 . . . . 2.1699999999999999 110.919 170.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -73.11 -30.42 63.62 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.063 1.345 . . . . 3.3900000000000001 112.107 -175.136 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.77 -54.03 51.1 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.7 1.6 . . . . 3.3599999999999999 110.132 168.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -55.76 -38.12 69.43 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.29 1.436 . . . . 2.54 112.489 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 85.5 mt -70.66 -16.07 62.78 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.879 1.066 . . . . 1.8600000000000001 113.879 177.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -109.89 2.52 19.88 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.156 1.782 . . . . 3.25 113.621 175.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 15.6 t70 . . . . . 0 N--CA 1.474 0.775 0 C-N-CA 126.539 1.936 . . . . 2.9900000000000002 112.311 -174.825 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . 0.5 HG23 ' H ' ' B' ' 6' ' ' GLU . 3.9 t . . . . . 0 N--CA 1.472 0.631 0 CA-C-O 118.506 -0.759 . . . . 2.73 110.727 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -65.77 -24.52 54.38 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 122.079 1.853 . . . . 1.49 113.065 164.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 14.0 tp -65.69 -63.48 1.08 Allowed 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 121.135 1.788 . . . . 2.7200000000000002 111.451 -176.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . 0.5 ' H ' HG23 ' B' ' 3' ' ' THR . 14.2 tp10 -57.99 -37.85 75.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.234 1.016 . . . . 5.3200000000000003 110.646 178.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . 0.445 ' HA ' ' HE2' ' B' ' 7' ' ' LYS . 0.2 OUTLIER -63.92 -31.53 72.75 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 120.361 -1.462 . . . . 5.21 112.997 174.994 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -79.38 -27.74 41.9 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.58 1.152 . . . . 1.22 112.862 178.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 56.8 mt -60.31 -32.55 71.33 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 120.864 -1.148 . . . . 1.8600000000000001 111.799 168.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.7 m -60.35 -40.57 91.2 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.074 -1.016 . . . . 1.78 111.722 167.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 5.9 m -57.74 -38.82 76.01 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.175 0.898 . . . . 1.45 111.261 177.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 13.7 ttm -59.53 -37.42 78.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.447 0.906 . . . . 3.1099999999999999 113.447 173.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -75.06 -27.26 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 CA-C-N 119.911 1.232 . . . . 2.3399999999999999 112.092 172.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 85.5 m -71.94 -46.75 56.41 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.708 1.603 . . . . 0.84999999999999998 110.24 -171.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 38.1 p -69.9 -39.12 76.42 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 123.538 0.735 . . . . 1.76 109.68 170.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -62.37 -53.63 52.14 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-O 118.455 -0.783 . . . . 2.29 111.966 -175.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -19.44 62.62 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 120.269 1.395 . . . . 2.98 112.328 -178.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -72.63 -49.36 32.43 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.698 -1.251 . . . . 4.5 112.519 168.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -74.54 -39.6 62.24 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.688 -1.258 . . . . 2.2799999999999998 112.886 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 18.2 m -55.96 -42.0 75.58 Favored 'General case' 0 C--O 1.245 0.831 0 C-N-CA 124.299 1.04 . . . . 1.76 112.337 166.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.94 -9.03 86.86 Favored Glycine 0 C--N 1.343 0.928 0 C-N-CA 127.237 2.351 . . . . 1.3400000000000001 113.999 -176.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -56.75 -67.52 0.3 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.184 1.794 . . . . 3.7799999999999998 109.373 174.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -138.01 168.61 19.36 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 124.167 0.987 . . . . 3.5699999999999998 113.025 -168.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.2 -132.18 48.84 Favored Glycine 0 C--N 1.341 0.839 0 C-N-CA 125.785 1.66 . . . . 2.0899999999999999 111.816 176.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -50.51 121.78 6.21 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.176 0.991 . . . . 3.96 110.227 158.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -85.17 -16.22 41.12 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 120.657 -1.277 . . . . 7.9000000000000004 114.411 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 60.8 tp -72.72 -36.62 67.83 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.504 1.121 . . . . 2.7400000000000002 112.226 168.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 3.2 p -119.23 166.5 12.91 Favored 'General case' 0 C--O 1.252 1.236 0 C-N-CA 126.283 1.833 . . . . 1.29 114.553 -172.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.81 129.46 47.04 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 113.663 -1.608 . . . . 2.25 113.83 176.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.64 175.51 5.47 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.712 1.605 . . . . 2.2599999999999998 110.698 175.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . 0.486 HH11 ' HG2' ' B' ' 31' ' ' ARG . 14.9 ttt-85 -44.77 -33.04 1.74 Allowed 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 116.738 2.125 . . . . 5.4500000000000002 116.738 -170.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -79.99 -36.49 35.92 Favored 'General case' 0 CA--C 1.549 0.931 0 O-C-N 120.337 -1.477 . . . . 4.0099999999999998 114.076 176.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -70.27 -48.2 57.85 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 108.831 -0.803 . . . . 1.8400000000000001 108.831 173.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.43 HD11 ' CG1' ' B' ' 67' ' ' ILE . 15.7 mt -52.09 -45.88 65.0 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.714 1.605 . . . . 3.1499999999999999 113.498 175.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -52.77 -41.95 64.54 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.373 0.533 . . . . 3.0 111.518 178.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -71.91 -38.75 69.86 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.498 0.925 . . . . 3.2400000000000002 113.498 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 7.2 tt -57.13 -59.6 4.85 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.473 0.709 . . . . 1.9199999999999999 109.876 173.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 41.8 mt -54.84 -54.57 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.957 0.903 . . . . 1.03 109.974 -172.077 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -72.61 -22.64 60.93 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 118.507 -1.277 . . . . 6.4000000000000004 114.135 -171.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -83.31 -34.89 25.61 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 117.457 -1.258 . . . . 4.4000000000000004 113.531 173.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 80.7 mt-10 -72.43 -58.12 3.64 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.736 1.153 . . . . 3.7400000000000002 111.143 172.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mp -91.97 91.47 7.87 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.72 -0.844 . . . . 3.4399999999999999 108.72 175.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 89.0 m -55.75 -37.61 68.74 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 121.599 -0.688 . . . . 3.46 112.526 174.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.46 -156.93 0.29 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 127.492 2.317 . . . . 3.6400000000000001 114.354 -171.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.11 162.07 33.57 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.186 1.85 . . . . 3.8199999999999998 113.547 177.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -79.47 43.81 0.57 Allowed 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 122.498 1.142 . . . . 6.2000000000000002 109.995 165.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 4.2 tpt -80.49 65.55 5.68 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.519 1.527 . . . . 2.04 112.533 -157.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -71.16 164.79 24.93 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.089 1.755 . . . . 3.8500000000000001 111.646 175.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -45.15 -53.53 7.97 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.789 1.636 . . . . 4.7599999999999998 112.581 175.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -66.32 -29.3 69.47 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.2 -0.938 . . . . 2.6499999999999999 113.104 -178.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 24.4 t -76.66 -18.06 58.78 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 118.089 -0.958 . . . . 2.5600000000000001 112.201 175.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 81.2 mt -86.39 -36.5 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 126.451 1.9 . . . . 1.3799999999999999 109.834 173.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -59.01 -58.4 8.82 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.704 2.002 . . . . 4.1399999999999997 111.248 168.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -67.63 -26.42 66.23 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.305 0.957 . . . . 2.9199999999999999 113.58 176.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.19 -56.59 19.66 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.209 0.913 . . . . 2.5299999999999998 110.282 165.278 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -69.26 -29.57 67.5 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 117.75 -1.119 . . . . 2.23 112.108 -172.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 18.5 mtpt -64.48 -36.64 84.84 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 120.397 1.453 . . . . 3.7400000000000002 113.076 164.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 22.7 t -69.18 -31.76 70.6 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.868 -1.145 . . . . 2.8599999999999999 112.599 175.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . 0.462 ' HB3' HD12 ' B' ' 67' ' ' ILE . 10.4 mp -69.93 -55.62 9.19 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 120.666 -1.271 . . . . 2.75 110.79 167.061 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -79.21 61.59 3.36 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 129.029 2.932 . . . . 1.3600000000000001 113.079 -173.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 22.8 mttp -54.85 -18.75 5.25 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 115.117 1.525 . . . . 3.25 115.117 -172.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -105.79 -3.57 21.86 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.003 1.721 . . . . 2.3700000000000001 115.106 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 15.0 t 68.79 25.36 6.3 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 114.678 1.362 . . . . 2.0800000000000001 114.678 177.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 13.6 p30 -78.27 -14.31 59.48 Favored 'General case' 0 CA--C 1.552 1.022 0 O-C-N 120.682 -1.261 . . . . 2.2999999999999998 112.001 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 75.79 -6.13 2.04 Favored 'General case' 0 CA--C 1.543 0.705 1 C-N-CA 133.243 4.617 . . . . 4.6500000000000004 115.052 177.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -97.43 152.86 18.53 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 127.347 2.259 . . . . 2.73 109.304 169.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . 0.462 HD12 ' HB3' ' B' ' 59' ' ' LEU . 29.6 mm -115.22 97.07 5.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-O 122.322 1.058 . . . . 1.8899999999999999 109.816 171.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.92 153.4 43.63 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.297 1.839 . . . . 2.8300000000000001 110.771 159.433 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.97 -33.91 39.97 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.298 1.222 . . . . 2.4900000000000002 114.298 -174.312 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -25.83 61.77 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.778 -1.202 . . . . 3.6099999999999999 112.09 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -78.87 -47.58 16.26 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.892 1.277 . . . . 1.6799999999999999 109.342 169.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -52.92 -48.53 67.21 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 127.61 2.364 . . . . 2.8999999999999999 114.228 -174.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 97.2 p -61.17 -25.64 67.16 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.236 -0.915 . . . . 1.71 113.149 -172.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 37.3 t -65.56 -21.74 29.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 123.784 0.834 . . . . 2.4300000000000002 111.964 178.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -57.48 -58.44 8.28 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.487 1.115 . . . . 2.7000000000000002 111.595 168.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . 0.4 HD22 ' H ' ' B' ' 76' ' ' LEU . 2.9 mm? -61.62 -40.6 95.41 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.788 0.835 . . . . 3.3599999999999999 111.037 179.054 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 52.3 m -53.39 -52.55 58.96 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 118.191 -0.909 . . . . 1.52 112.358 172.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 74.6 mtm -57.74 -49.94 74.9 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 119.808 1.186 . . . . 1.8300000000000001 112.452 177.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 84.5 mt -62.49 -37.93 87.88 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.724 0.41 . . . . 1.5 111.598 -179.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 8.5 t -69.22 -31.64 70.36 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.02 0.928 . . . . 1.96 112.921 175.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 67.3 mtp -61.46 -46.43 90.09 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 119.029 0.831 . . . . 1.9199999999999999 110.73 167.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.31 -45.63 90.42 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 118.728 0.695 . . . . 0.73999999999999999 112.836 177.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -59.12 -27.03 65.23 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.651 -0.656 . . . . 2.4199999999999999 112.759 176.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -72.86 -35.55 67.21 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.337 1.426 . . . . 2.0 112.685 176.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.79 -39.89 72.89 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.81 0.844 . . . . 2.8399999999999999 110.261 175.127 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.56 -50.87 68.9 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.167 1.387 . . . . 2.0299999999999998 110.812 170.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -58.04 -29.85 65.69 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.175 1.39 . . . . 2.3700000000000001 113.123 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 24.8 mt -73.65 -24.44 60.0 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.324 1.05 . . . . 2.0699999999999998 113.547 177.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -97.74 -32.48 11.72 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 114.388 1.255 . . . . 4.1699999999999999 114.388 175.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -74.33 -27.42 60.69 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.365 1.466 . . . . 4.2800000000000002 113.568 -170.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -88.13 -1.85 58.25 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.898 0.879 . . . . 4.8799999999999999 112.853 176.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.042 0 C-N-CA 126.277 1.831 . . . . 6.1100000000000003 114.25 -159.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.4 mp0 . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 109.145 -0.687 . . . . 3.2200000000000002 109.145 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.4 p -118.27 163.99 22.41 Favored Pre-proline 0 C--O 1.238 0.481 0 C-N-CA 125.059 1.344 . . . . 2.21 108.954 172.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -64.38 -12.75 34.59 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 121.985 1.79 . . . . 1.8799999999999999 113.516 175.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.8 tt -79.7 -35.09 39.53 Favored 'General case' 0 C--N 1.347 0.492 0 CA-C-N 120.238 1.381 . . . . 3.1899999999999999 112.512 170.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -52.69 52.68 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.339 1.427 . . . . 3.8599999999999999 108.7 167.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.521 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -57.5 -26.14 60.86 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 113.096 0.776 . . . . 4.2000000000000002 113.096 -179.137 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.64 -53.62 44.68 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-O 118.335 -0.841 . . . . 1.29 111.844 168.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 47.5 mt -54.45 -48.36 71.82 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 120.041 1.292 . . . . 1.71 111.597 177.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.7 p -67.52 -36.31 80.79 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 117.636 -1.174 . . . . 2.8500000000000001 113.289 177.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.42 -29.12 66.77 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 121.149 1.795 . . . . 2.1299999999999999 112.078 170.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.96 -55.97 18.58 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.378 1.071 . . . . 3.77 110.815 -178.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.7 m -62.56 -25.13 37.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 113.021 0.749 . . . . 2.2799999999999998 113.021 177.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.1 m -70.17 -49.22 52.63 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.697 1.599 . . . . 1.3899999999999999 112.512 175.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -48.13 81.22 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.054 0.843 . . . . 2.25 109.68 167.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -62.85 -50.96 68.9 Favored 'General case' 0 N--CA 1.465 0.319 0 O-C-N 124.222 0.951 . . . . 2.5299999999999998 111.1 -166.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 24.0 m170 -68.21 -34.81 76.95 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 118.394 -0.812 . . . . 2.79 112.42 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -70.81 -43.02 69.49 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 120.056 1.298 . . . . 4.4800000000000004 113.315 177.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -70.53 -23.16 62.58 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.312 0.96 . . . . 2.0800000000000001 112.045 170.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.0 p -69.88 -36.67 75.66 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.326 -1.484 . . . . 2.7000000000000002 111.181 169.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.47 -15.37 75.17 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 125.871 1.7 . . . . 1.6000000000000001 113.516 175.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -64.11 92.94 0.08 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 106.999 -1.482 . . . . 4.6699999999999999 106.999 157.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 60.63 178.08 0.1 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.764 2.026 . . . . 6.7800000000000002 115.635 169.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.36 -140.3 44.79 Favored Glycine 0 C--N 1.343 0.938 0 C-N-CA 126.294 1.902 . . . . 2.21 112.522 166.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.5 t -54.14 132.38 42.92 Favored 'General case' 0 C--O 1.241 0.613 0 O-C-N 121.817 -0.813 . . . . 2.7200000000000002 110.343 156.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.5 ptmm? -86.31 16.79 4.14 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.063 0.945 . . . . 4.0999999999999996 113.546 171.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.2 mt -128.85 -39.6 1.59 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.561 1.144 . . . . 4.3099999999999996 111.475 178.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 12.5 p -101.0 162.33 12.96 Favored 'General case' 0 C--O 1.248 0.995 0 C-N-CA 124.996 1.318 . . . . 1.3700000000000001 111.508 174.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 92.6 mt -90.48 98.17 11.62 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 112.304 -2.225 . . . . 1.72 109.127 172.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.2 t -63.0 166.15 6.11 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 121.59 0.709 . . . . 1.8300000000000001 112.242 170.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.65 -40.61 1.99 Allowed 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 127.008 2.123 . . . . 3.6400000000000001 115.419 -175.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -79.71 -36.87 36.82 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.06 1.133 . . . . 6.3899999999999997 114.06 176.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -66.09 -47.72 73.29 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.533 1.533 . . . . 1.54 109.615 -175.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 38.1 tp -53.93 -50.41 66.48 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.569 1.148 . . . . 1.8400000000000001 111.049 175.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -57.46 -44.74 85.04 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 112.958 0.725 . . . . 3.46 112.958 176.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -58.31 -38.8 77.81 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 119.264 0.938 . . . . 3.77 112.488 174.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.7 -57.84 5.08 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.482 1.113 . . . . 2.6600000000000001 110.734 177.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.6 mt -58.27 -49.37 82.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 118.517 0.599 . . . . 0.79000000000000004 110.107 -175.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.62 -8.18 53.99 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 120.818 -1.176 . . . . 4.6699999999999999 111.874 -173.181 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -95.42 -39.03 10.21 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.998 1.319 . . . . 3.3599999999999999 113.455 166.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -72.72 -64.94 0.86 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.761 1.225 . . . . 4.5300000000000002 109.637 177.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -82.33 72.99 9.39 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 123.177 1.465 . . . . 2.3300000000000001 107.399 165.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.9 t -65.58 7.56 0.23 Allowed 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 114.877 1.436 . . . . 2.9900000000000002 114.877 178.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -49.71 157.19 0.59 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 129.452 3.101 . . . . 4.4299999999999997 114.322 -177.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -83.1 -19.64 62.43 Favored Glycine 0 N--CA 1.474 1.222 0 C-N-CA 124.313 0.959 . . . . 3.5499999999999998 112.165 168.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -69.47 -29.45 67.12 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 128.806 2.842 . . . . 5.5 111.34 170.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.7 85.35 2.72 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.578 1.551 . . . . 2.2799999999999998 110.943 173.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.6 mmtp -111.53 170.71 7.94 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.728 2.411 . . . . 4.21 110.081 176.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -57.01 -42.11 79.73 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.637 -0.664 . . . . 4.3600000000000003 112.477 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -70.92 -4.2 23.31 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.824 1.416 . . . . 3.3500000000000001 114.824 173.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.4 m -101.56 -39.07 7.67 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.586 1.154 . . . . 2.1299999999999999 110.715 172.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 34.8 mm -71.3 -36.24 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 125.213 1.405 . . . . 2.04 112.242 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -66.55 -33.92 76.76 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.82 1.044 . . . . 4.04 113.82 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -83.57 -34.2 25.24 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 113.201 0.815 . . . . 2.8799999999999999 113.201 176.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.9 tt -54.51 -50.96 66.6 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.816 0.846 . . . . 2.23 109.313 169.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.2 ttt -60.34 -40.42 90.62 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.254 1.022 . . . . 1.4399999999999999 113.009 172.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.2 ttmm -58.74 -35.25 72.41 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.206 1.002 . . . . 4.4000000000000004 112.553 176.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 68.1 m -80.44 -23.2 40.45 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.529 1.931 . . . . 1.8600000000000001 113.442 177.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.2 mt -73.66 -54.03 9.05 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.018 -1.051 . . . . 1.8600000000000001 113.5 176.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -88.03 143.96 26.79 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.562 1.074 . . . . 1.9299999999999999 113.843 -167.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -115.83 7.08 14.45 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 125.252 1.421 . . . . 2.8500000000000001 113.424 -177.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -118.8 -23.44 6.99 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.95 1.3 . . . . 2.8700000000000001 114.224 -170.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 54.3 m 58.77 39.55 24.05 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.448 2.299 . . . . 2.8799999999999999 112.577 -157.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.6 p30 -87.73 -26.02 23.14 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.018 1.327 . . . . 2.75 112.93 -173.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 75.35 4.4 4.09 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 130.693 3.597 . . . . 3.73 114.346 -170.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -116.38 121.6 42.4 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.386 2.274 . . . . 2.7400000000000002 109.599 -179.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 29.0 mm -78.83 106.4 9.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 115.36 -0.836 . . . . 1.02 109.431 177.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -58.67 147.99 30.81 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.037 1.335 . . . . 4.0999999999999996 109.468 169.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -57.29 -35.39 69.74 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 120.062 -1.649 . . . . 2.8900000000000001 111.726 173.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -50.38 -44.15 54.76 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.989 1.716 . . . . 3.9100000000000001 113.142 167.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -79.41 -40.96 28.78 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.284 1.834 . . . . 1.7 111.275 -177.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -58.16 -28.21 64.53 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.558 1.143 . . . . 2.0099999999999998 112.625 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 53.2 p -53.34 -33.23 52.72 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 121.025 -1.047 . . . . 2.8799999999999999 113.676 168.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.4 t -67.16 -41.63 87.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.298 1.039 . . . . 1.8999999999999999 109.725 -178.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -55.51 -57.15 13.12 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.648 0.779 . . . . 2.2599999999999998 111.202 171.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.31 -33.91 73.05 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 113.06 0.763 . . . . 1.5700000000000001 113.06 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 63.7 m -70.32 -44.38 68.37 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.554 0.742 . . . . 0.68999999999999995 111.481 -179.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 79.5 mtm -55.56 -41.01 72.67 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.482 0.583 . . . . 1.3300000000000001 111.556 172.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.5 mt -73.23 -41.49 63.66 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.777 0.831 . . . . 1.29 113.177 -179.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 3.5 p -67.75 -31.84 72.03 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 119.29 0.95 . . . . 3.1200000000000001 112.643 175.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 70.8 mtp -71.57 -37.73 71.03 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.791 -0.568 . . . . 1.6799999999999999 111.919 170.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.88 -36.6 83.87 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.461 1.028 . . . . 0.76000000000000001 113.213 176.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -66.76 -18.1 65.2 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.254 -0.904 . . . . 2.3999999999999999 113.347 170.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.474 HD22 HG13 ' B' ' 13' ' ' VAL . 5.0 t-20 -74.57 -39.85 62.0 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 119.938 1.245 . . . . 2.1800000000000002 112.915 174.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -58.53 -48.98 79.05 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.115 0.966 . . . . 4.3300000000000001 110.103 171.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.82 -46.09 64.19 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.468 1.507 . . . . 2.1000000000000001 112.876 174.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -67.09 -22.92 65.8 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.994 1.318 . . . . 2.4199999999999999 112.943 -179.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.1 mt -86.45 -24.99 25.45 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.425 1.09 . . . . 1.6299999999999999 112.232 172.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -89.23 -20.8 23.71 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 115.479 1.659 . . . . 2.7599999999999998 115.479 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 . . . . . 0 N--CA 1.477 0.89 0 C-N-CA 124.55 1.14 . . . . 2.9199999999999999 112.39 167.026 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 2.6 t . . . . . 0 N--CA 1.47 0.557 0 N-CA-C 108.022 -1.103 . . . . 3.1499999999999999 108.022 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -60.39 -11.51 16.83 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.186 1.924 . . . . 1.8 113.677 175.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.21 -33.19 59.26 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 119.356 0.98 . . . . 2.7599999999999998 112.574 171.02 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -58.97 -46.28 88.47 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 121.144 -0.973 . . . . 4.8399999999999999 109.484 167.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 8.5 mmtm -65.43 -29.95 70.69 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.134 1.161 . . . . 4.3300000000000001 114.134 175.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.46 -43.99 79.73 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.661 0.784 . . . . 1.0 111.795 170.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 48.8 mt -62.7 -41.63 99.22 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.014 0.926 . . . . 1.6399999999999999 112.057 174.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -55.7 24.34 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 118.814 0.734 . . . . 1.26 109.845 167.313 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 42.0 m -54.91 -38.8 68.08 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.202 1.801 . . . . 1.29 112.623 -174.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 88.4 mtp -53.37 -43.49 67.84 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.973 0.806 . . . . 3.0099999999999998 111.602 175.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.474 HG13 HD22 ' A' ' 84' ' ' ASN . 19.5 t -71.36 -34.81 55.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.824 1.249 . . . . 2.2799999999999998 111.47 176.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.9 m -62.3 -47.37 84.61 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 121.123 -0.986 . . . . 1.05 112.387 174.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 p -62.55 -28.53 69.93 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.404 1.082 . . . . 2.0699999999999998 112.065 170.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -63.56 -59.53 4.5 Favored 'General case' 0 C--O 1.225 -0.202 0 O-C-N 124.001 0.813 . . . . 2.4100000000000001 109.63 -178.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -74.67 -27.96 60.64 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 117.426 -1.273 . . . . 2.9399999999999999 114.139 -177.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 24.8 mtpt -41.05 -47.75 3.16 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.773 1.229 . . . . 6.6399999999999997 112.322 167.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -108.09 -36.64 6.27 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.786 1.234 . . . . 2.0600000000000001 113.06 -175.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 29.2 t -58.47 -26.57 63.52 Favored 'General case' 0 C--O 1.246 0.874 0 O-C-N 120.824 -1.173 . . . . 1.9099999999999999 112.95 173.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.7 -7.25 87.3 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 127.61 2.529 . . . . 1.76 115.402 175.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 11.7 mmp_? -57.92 -73.33 0.07 Allowed 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 120.118 1.959 . . . . 4.3700000000000001 110.362 168.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -127.06 161.92 27.27 Favored 'General case' 0 C--O 1.246 0.909 0 C-N-CA 126.546 1.938 . . . . 3.7799999999999998 110.65 -156.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.06 -136.26 48.44 Favored Glycine 0 C--N 1.338 0.686 0 C-N-CA 125.709 1.623 . . . . 2.1699999999999999 110.978 174.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 46.1 t -63.09 141.21 58.85 Favored 'General case' 0 C--O 1.248 1.011 0 CA-C-O 123.207 1.48 . . . . 3.8799999999999999 110.828 162.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 55.4 mttm -85.86 1.29 50.41 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.902 1.281 . . . . 8.1099999999999994 112.695 173.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 76.3 mt -88.96 -33.85 17.08 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.662 1.585 . . . . 4.8700000000000001 112.083 164.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 65.5 p -109.2 152.05 25.68 Favored 'General case' 0 C--O 1.249 1.032 0 C-N-CA 125.292 1.437 . . . . 1.73 112.686 -176.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.7 pp -105.47 112.88 26.14 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 114.932 -1.031 . . . . 1.95 111.492 170.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 2.3 p -77.74 171.01 15.6 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.853 1.261 . . . . 2.0099999999999998 112.229 170.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 -41.19 -32.69 0.29 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 117.026 2.232 . . . . 3.77 117.026 174.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.65 -41.78 15.99 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 120.161 -1.587 . . . . 4.7199999999999998 112.196 179.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -57.85 -38.4 75.62 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.561 1.544 . . . . 1.9099999999999999 109.821 169.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 tt -68.47 -50.66 50.78 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.019 1.728 . . . . 3.0299999999999998 113.129 176.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 7.6 ptpt -71.19 -15.57 62.48 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 120.085 1.311 . . . . 3.02 114.27 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -72.99 -56.46 5.1 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.925 0.89 . . . . 3.8999999999999999 110.974 163.108 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.1 tt -52.21 -58.99 4.94 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 126.197 1.799 . . . . 2.1200000000000001 112.598 -175.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 33.1 mt -56.55 -50.06 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 N-CA-C 109.084 -0.71 . . . . 0.88 109.084 -172.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -71.24 -13.24 61.84 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 124.047 0.939 . . . . 3.96 113.482 -171.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -99.59 -33.28 10.7 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 114.195 1.183 . . . . 4.0599999999999996 114.195 174.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -79.95 -50.04 11.0 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.011 0.823 . . . . 4.8600000000000003 110.29 173.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 39.6 mt -81.07 64.31 5.76 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 122.955 1.359 . . . . 2.4500000000000002 109.606 160.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 8.2 p -65.64 37.19 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.034 2.534 . . . . 3.8799999999999999 112.772 164.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 98.5 mt -121.41 172.38 8.09 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 126.689 1.996 . . . . 4.2999999999999998 111.178 -171.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -75.39 22.44 1.67 Allowed Glycine 0 CA--C 1.535 1.312 0 CA-C-O 117.738 -1.59 . . . . 3.5299999999999998 114.666 176.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.19 -128.65 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 126.005 1.722 . . . . 9.4299999999999997 112.181 -171.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 14.3 ptp -62.85 146.07 53.57 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.813 1.642 . . . . 3.3700000000000001 114.494 -172.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -121.59 161.21 22.82 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.547 1.139 . . . . 4.3200000000000003 109.364 -173.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -66.79 -12.83 60.36 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 117.783 2.512 . . . . 3.2799999999999998 117.783 -155.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 12.9 t -72.75 -12.16 60.9 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 120.617 1.553 . . . . 2.6099999999999999 114.199 167.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 7.7 m -103.73 -16.21 15.51 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.055 1.342 . . . . 2.4300000000000002 112.534 175.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 10.7 mm -64.53 -34.28 68.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.793 1.237 . . . . 1.6299999999999999 111.757 177.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.25 -18.97 57.21 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.195 0.998 . . . . 2.9100000000000001 112.646 176.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -80.47 -42.63 22.23 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.272 -0.893 . . . . 3.0299999999999998 110.802 166.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -57.25 -46.9 82.59 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.931 1.293 . . . . 2.71 109.967 175.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 6.9 tpt -48.31 -57.73 5.59 Favored 'General case' 0 C--O 1.217 -0.648 0 C-N-CA 125.782 1.633 . . . . 1.75 111.134 167.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.04 -25.44 67.83 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.25 1.42 . . . . 4.2000000000000002 114.017 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 15.1 m -82.11 -39.6 23.12 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.44 1.896 . . . . 1.9199999999999999 111.764 -178.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 12.4 mt -57.33 -59.06 5.69 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.116 1.366 . . . . 2.8599999999999999 111.044 158.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -80.77 47.92 1.02 Allowed 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 127.574 2.349 . . . . 1.7 112.103 -173.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -51.57 -24.42 5.34 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.31 1.844 . . . . 5.3799999999999999 112.954 170.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 52.5 p30 -88.74 -6.88 57.13 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 115.616 1.709 . . . . 2.0800000000000001 115.616 172.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 19.1 m 69.42 25.22 5.53 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.258 1.823 . . . . 2.8799999999999999 115.417 163.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 p30 -100.71 -2.87 31.39 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.818 1.647 . . . . 2.48 113.048 -177.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 63.99 -7.64 0.2 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 131.154 3.782 . . . . 4.25 115.989 -174.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -92.83 145.78 24.13 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 123.706 0.802 . . . . 3.6200000000000001 108.965 174.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 42.6 mm -117.63 113.14 41.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 125.313 1.445 . . . . 1.54 108.875 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.28 173.23 9.31 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.615 1.166 . . . . 2.73 110.571 161.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -54.39 -38.4 66.12 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.933 1.086 . . . . 2.9199999999999999 113.933 175.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 18.1 mtpp -71.47 -25.2 62.18 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.492 0.717 . . . . 4.5 112.447 -177.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -75.66 -53.45 8.54 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.073 0.949 . . . . 1.6799999999999999 110.188 161.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -51.58 -37.49 50.05 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.498 1.919 . . . . 2.3300000000000001 114.874 -173.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 4.8 m -59.44 -26.49 65.24 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 117.791 -1.1 . . . . 2.2400000000000002 113.848 173.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 68.0 t -62.46 -47.12 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 CA-C-N 120.679 1.581 . . . . 1.6399999999999999 110.277 178.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -57.89 -50.75 72.27 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.488 1.115 . . . . 1.6299999999999999 112.219 172.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 82.9 mt -67.85 -29.0 68.03 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 118.693 -0.67 . . . . 1.73 112.31 -176.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 31.5 m -65.16 -50.75 64.77 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.219 1.008 . . . . 0.82999999999999996 110.538 167.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 72.8 mtp -55.78 -41.61 74.32 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.207 1.003 . . . . 1.9399999999999999 113.197 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 39.8 mt -69.16 -50.56 46.56 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 118.531 0.605 . . . . 1.54 112.094 174.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -65.84 -26.7 67.78 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 121.513 -0.742 . . . . 1.6899999999999999 111.984 -177.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 60.7 mmm -63.19 -44.49 95.22 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.554 1.142 . . . . 2.27 112.553 165.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.1 -36.92 80.99 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.863 1.21 . . . . 0.90000000000000002 112.455 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -69.96 -23.31 63.16 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.966 1.099 . . . . 2.25 113.966 171.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -63.26 -48.59 77.55 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.463 1.029 . . . . 2.4300000000000002 111.452 175.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -63.27 -43.71 97.17 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.764 1.225 . . . . 3.1400000000000001 112.214 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -54.36 -50.93 66.33 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.363 1.465 . . . . 2.79 111.649 176.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -63.76 -27.44 69.2 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.121 0.968 . . . . 2.5 111.882 -176.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 82.3 mt -81.17 -14.27 57.77 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 117.749 -1.12 . . . . 1.8300000000000001 112.834 177.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -92.96 -21.45 19.78 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.405 1.261 . . . . 4.3499999999999996 114.405 166.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -73.99 -36.5 64.52 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.372 1.469 . . . . 3.9900000000000002 112.816 175.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -99.25 47.06 0.97 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.745 1.218 . . . . 2.7799999999999998 112.655 -167.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt . . . . . 0 C--O 1.249 1.052 0 C-N-CA 127.752 2.421 . . . . 4.9900000000000002 114.797 -174.864 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 . . . . . 0 CA--C 1.548 0.887 0 N-CA-C 113.884 1.068 . . . . 6.3499999999999996 113.884 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.445 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 9.9 p -107.19 178.19 1.14 Allowed Pre-proline 0 N--CA 1.48 1.069 0 C-N-CA 127.169 2.187 . . . . 1.5900000000000001 113.059 -159.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.445 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 56.7 Cg_endo -72.34 -24.9 19.03 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 122.201 1.934 . . . . 1.6499999999999999 113.986 170.196 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.2 tt -75.12 -41.37 58.61 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 119.645 1.112 . . . . 2.9100000000000001 111.173 173.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -59.29 -43.8 92.55 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.654 0.782 . . . . 4.4100000000000001 110.772 173.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.3 mttp -68.34 -32.86 73.27 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.453 -1.404 . . . . 3.3199999999999998 113.224 173.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.538 ' HB1' ' HB1' ' B' ' 8' ' ' ALA . . . -60.96 -50.25 74.17 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.81 0.732 . . . . 1.04 112.016 174.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.5 mt -69.75 -33.49 72.5 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.179 0.9 . . . . 2.3599999999999999 111.873 178.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 88.7 m -57.84 -45.34 86.37 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 118.055 -0.974 . . . . 1.5600000000000001 111.111 169.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.4 m -58.16 -40.08 80.5 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.742 1.156 . . . . 1.3300000000000001 111.648 175.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 16.3 mtp -62.67 -52.37 63.59 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 118.65 0.659 . . . . 3.3999999999999999 110.779 174.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.0 t -58.0 -37.24 60.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 121.217 -0.927 . . . . 2.21 112.725 176.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.4 m -67.15 -57.0 7.58 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.587 1.555 . . . . 1.26 110.73 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.4 p -58.79 -41.08 85.86 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.329 0.651 . . . . 1.9199999999999999 109.976 176.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.43 -65.61 0.66 Allowed 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 118.687 -0.673 . . . . 2.2000000000000002 109.241 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -58.07 -36.21 72.48 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 120.078 1.308 . . . . 2.7200000000000002 112.446 -177.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -63.37 -56.11 19.02 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 120.52 -1.363 . . . . 4.9400000000000004 113.348 174.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -70.95 -31.24 67.75 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.188 0.995 . . . . 2.9500000000000002 111.459 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.412 ' HA ' ' OE1' ' A' ' 33' ' ' GLU . 13.0 t -58.23 -37.64 75.26 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 124.908 1.283 . . . . 2.02 111.017 169.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.98 6.88 11.01 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 127.906 2.67 . . . . 1.8 116.379 175.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -94.48 123.25 37.78 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 105.332 -2.099 . . . . 5.1900000000000004 105.332 150.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 60.77 169.42 0.09 Allowed 'General case' 0 CA--C 1.559 1.303 0 N-CA-C 116.069 1.877 . . . . 5.7199999999999998 116.069 161.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.25 -106.33 1.56 Allowed Glycine 0 N--CA 1.472 1.078 0 N-CA-C 108.39 -1.884 . . . . 2.5699999999999998 108.39 -175.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.7 m -129.63 -179.85 5.41 Favored 'General case' 0 C--O 1.24 0.592 0 O-C-N 121.741 -0.858 . . . . 3.48 111.946 141.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.2 ttmm -66.87 -9.62 39.72 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 127.973 2.509 . . . . 4.4199999999999999 113.326 174.142 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.9 mt -84.5 -43.62 14.39 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.698 1.599 . . . . 3.7599999999999998 111.302 170.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.7 p -101.51 134.6 44.37 Favored 'General case' 0 C--O 1.243 0.712 0 C-N-CA 125.862 1.665 . . . . 1.55 112.241 -168.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 68.4 mt -88.02 96.04 10.36 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.354 1.462 . . . . 1.6200000000000001 108.848 162.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.429 ' H ' ' CD ' ' A' ' 33' ' ' GLU . 2.4 m -66.87 157.62 32.66 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.227 -0.921 . . . . 2.6099999999999999 112.133 171.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 45.5 ttt-85 -50.63 -9.88 0.06 Allowed 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 128.115 2.566 . . . . 3.3300000000000001 117.527 -177.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.43 -44.0 7.04 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 119.895 -1.753 . . . . 4.8399999999999999 113.259 167.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.429 ' CD ' ' H ' ' A' ' 30' ' ' SER . 17.2 mt-10 -54.42 -45.95 73.1 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.084 1.354 . . . . 1.5600000000000001 109.711 170.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.3 tp -67.28 -40.41 86.13 Favored 'General case' 0 C--N 1.344 0.368 0 C-N-CA 123.203 0.601 . . . . 2.2000000000000002 112.307 -179.505 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -59.51 -44.54 93.09 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.88 0.764 . . . . 3.27 111.658 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.511 ' HG2' ' HE2' ' A' ' 40' ' ' LYS . 53.3 tt0 -63.92 -52.19 60.98 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-O 119.035 -0.507 . . . . 3.8999999999999999 112.096 173.329 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -61.69 -47.39 85.53 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.843 1.257 . . . . 2.8599999999999999 112.647 -174.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 48.0 mt -49.77 -47.39 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 119.378 0.99 . . . . 1.25 109.291 170.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.3 tptt -74.08 -12.7 60.68 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 112.995 0.739 . . . . 5.5 112.995 -173.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.511 ' HE2' ' HG2' ' A' ' 36' ' ' GLU . 68.1 mmtt -79.69 -40.32 29.26 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.894 1.224 . . . . 2.7799999999999998 112.573 163.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -67.06 -71.76 0.19 Allowed 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 108.973 -0.751 . . . . 4.71 108.973 175.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.5 mt -76.45 65.5 2.33 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.956 1.302 . . . . 3.0499999999999998 111.824 172.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 14.9 t -79.63 -27.02 40.98 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.885 1.674 . . . . 3.5299999999999998 112.942 174.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -54.7 1.63 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 130.159 3.384 . . . . 4.5599999999999996 120.086 -161.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 104.8 -23.49 30.96 Favored Glycine 0 N--CA 1.473 1.118 0 C-N-CA 125.861 1.696 . . . . 3.7999999999999998 113.465 -175.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -80.87 171.36 15.11 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 117.475 0.637 . . . . 5.0899999999999999 112.19 160.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 31.1 tpp 72.6 106.3 0.07 Allowed 'General case' 0 C--O 1.235 0.328 0 C-N-CA 129.165 2.986 . . . . 2.5499999999999998 112.49 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -131.1 157.3 43.48 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.429 1.892 . . . . 5.5099999999999998 111.129 -174.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -26.46 -74.88 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 128.34 2.656 . . . . 4.6699999999999999 114.921 -168.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.1 m -65.14 -17.0 64.11 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.543 1.312 . . . . 2.71 114.543 -169.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -76.17 -15.69 60.01 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.246 -0.909 . . . . 2.6299999999999999 112.919 173.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 81.0 mt -75.11 -30.15 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.1 0.96 . . . . 1.55 110.482 -178.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.2 -22.09 36.12 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.543 0.942 . . . . 2.6299999999999999 113.543 -179.643 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -68.75 -44.13 74.39 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 121.188 -0.945 . . . . 3.2400000000000002 109.886 157.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 17.1 tp -62.57 -39.03 92.36 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 117.684 -1.15 . . . . 1.78 110.958 -176.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.6 mmm -51.95 -56.79 12.01 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 126.022 1.729 . . . . 1.8200000000000001 112.113 167.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.4 tmmm? -58.91 -31.34 68.54 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.567 1.547 . . . . 3.2599999999999998 112.874 177.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 20.6 m -88.72 -26.86 21.56 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.82 1.648 . . . . 1.8999999999999999 112.775 -175.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.6 mp -66.52 -44.0 83.71 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.099 0.863 . . . . 3.2599999999999998 110.76 160.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -58.69 147.07 34.24 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 123.134 1.445 . . . . 2.5699999999999998 113.617 174.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.38 15.24 13.87 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.852 1.261 . . . . 2.9199999999999999 111.876 161.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 27.7 p-10 -137.85 -48.63 0.56 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.099 1.759 . . . . 3.3199999999999998 112.851 -177.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 2.9 t 95.62 104.18 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 129.163 2.985 . . . . 2.8900000000000001 108.383 -173.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.8 p30 -145.64 -139.31 0.1 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.736 1.215 . . . . 4.1799999999999997 109.349 -178.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -141.38 24.56 2.09 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.085 0.954 . . . . 4.2999999999999998 111.068 164.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -144.89 136.78 25.73 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 126.026 1.73 . . . . 3.2999999999999998 112.683 -173.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 39.8 mm -120.94 124.31 72.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 125.515 1.526 . . . . 1.0900000000000001 110.274 -173.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.4 -176.23 3.33 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.967 1.707 . . . . 2.9700000000000002 111.794 168.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -57.44 -37.5 72.92 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 116.326 1.973 . . . . 3.2999999999999998 116.326 175.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 43.5 mtmt -74.58 -31.95 62.22 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.835 0.854 . . . . 3.6600000000000001 111.964 -178.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.407 ' O ' HG12 ' A' ' 74' ' ' VAL . 77.4 mt-10 -69.76 -65.04 0.77 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.63 0.772 . . . . 2.2200000000000002 109.337 162.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -47.34 -36.45 9.49 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.996 2.119 . . . . 2.29 115.224 -174.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.5 m -70.0 -19.38 63.33 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 120.314 -1.491 . . . . 2.1699999999999999 111.97 -177.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.407 HG12 ' O ' ' A' ' 71' ' ' GLU . 0.8 OUTLIER -74.05 -22.29 18.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 O-C-N 121.292 -0.88 . . . . 2.0499999999999998 112.696 173.845 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -65.28 -66.5 0.54 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.449 1.5 . . . . 2.6600000000000001 110.477 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.418 ' H ' HD23 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -53.75 -33.2 55.01 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.316 1.446 . . . . 2.3700000000000001 112.523 170.101 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.6 m -59.57 -44.72 93.2 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.854 1.206 . . . . 0.94999999999999996 112.139 173.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 51.4 mtp -60.23 -42.94 96.28 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.933 0.788 . . . . 1.8700000000000001 111.234 178.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 44.0 mt -66.57 -50.04 64.41 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.332 1.053 . . . . 1.22 110.87 178.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 3.2 t -64.31 -27.26 68.91 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.269 1.428 . . . . 1.4099999999999999 113.051 -177.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 71.8 mtm -72.63 -39.39 67.25 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.051 1.13 . . . . 3.6699999999999999 114.051 165.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.6 -44.37 82.29 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.612 1.096 . . . . 1.3999999999999999 112.036 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -60.9 -24.75 66.22 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.669 0.618 . . . . 2.3100000000000001 112.669 173.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -65.93 -51.98 53.83 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 118.978 0.808 . . . . 2.4199999999999999 112.083 175.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -58.8 -51.05 71.63 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.207 1.803 . . . . 2.9199999999999999 111.581 174.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -50.93 -47.14 61.02 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.62 1.568 . . . . 2.8199999999999998 111.439 178.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -64.41 -33.76 76.62 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.913 0.885 . . . . 2.5600000000000001 112.852 -178.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.3 mt -74.61 -18.39 60.57 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.819 0.848 . . . . 2.1200000000000001 112.745 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -96.96 -13.91 22.05 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.742 1.386 . . . . 4.8499999999999996 114.742 172.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 28.8 t70 . . . . . 0 CA--C 1.539 0.551 0 C-N-CA 125.343 1.457 . . . . 3.1499999999999999 112.668 179.415 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 74.1 p . . . . . 0 N--CA 1.47 0.552 0 N-CA-C 110.225 -0.287 . . . . 1.8899999999999999 110.225 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -64.72 -6.62 12.74 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 123.04 2.493 . . . . 1.3899999999999999 114.692 175.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 10.6 mp -76.91 -55.52 5.4 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.907 1.231 . . . . 3.5699999999999998 111.165 174.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -59.62 -29.85 68.29 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-O 122.297 1.046 . . . . 4.3099999999999996 111.82 170.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.74 -37.15 65.17 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 119.411 -2.055 . . . . 4.7999999999999998 113.869 170.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.538 ' HB1' ' HB1' ' A' ' 8' ' ' ALA . . . -62.02 -45.46 93.47 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.507 1.123 . . . . 0.97999999999999998 112.467 170.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 58.8 mt -58.45 -44.64 89.31 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 124.758 1.223 . . . . 1.55 111.425 173.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 64.7 m -53.48 -56.17 19.2 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 118.272 -0.871 . . . . 1.47 110.711 169.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 94.9 m -58.86 -37.1 75.73 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.144 1.378 . . . . 1.6100000000000001 111.811 -178.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.2 mmm -59.06 -51.81 68.45 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.304 1.042 . . . . 3.23 112.674 171.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 85.6 t -68.79 -31.67 51.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 121.126 -0.984 . . . . 1.8899999999999999 111.909 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 31.8 m -59.02 -59.86 4.8 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.131 1.373 . . . . 1.1899999999999999 110.178 175.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.7 -31.48 71.47 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 124.743 1.217 . . . . 2.7799999999999998 110.046 -174.093 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -63.06 -46.73 86.13 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.892 0.701 . . . . 1.8600000000000001 112.892 174.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -61.99 -39.32 91.82 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.996 -1.065 . . . . 2.3500000000000001 112.408 175.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.475 ' HE2' ' CZ ' ' B' ' 19' ' ' TYR . 4.9 tttt -53.65 -33.44 55.24 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 125.501 1.52 . . . . 5.4900000000000002 113.468 171.341 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.475 ' CZ ' ' HE2' ' B' ' 18' ' ' LYS . 67.1 m-85 -96.02 -37.25 10.72 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 115.614 1.709 . . . . 2.1499999999999999 115.614 176.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 62.8 m -66.66 -22.69 66.09 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 116.661 2.097 . . . . 1.9099999999999999 116.661 -172.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.02 -17.18 63.56 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-O 118.43 -1.206 . . . . 2.0600000000000001 113.982 179.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 28.7 ttt-85 -58.07 -26.99 63.23 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.408 2.283 . . . . 3.79 114.107 -175.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -151.33 144.41 24.62 Favored 'General case' 0 C--O 1.243 0.76 0 C-N-CA 128.617 2.767 . . . . 3.79 108.382 178.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.18 -12.76 0.58 Allowed Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.318 1.437 . . . . 2.2200000000000002 114.766 -172.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 63.72 -159.66 0.3 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.56 1.944 . . . . 5.8300000000000001 110.747 -161.173 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 31.5 mmtm 73.62 -176.28 0.16 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.306 2.242 . . . . 8.8000000000000007 113.193 163.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -72.82 -9.3 58.51 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.79 1.236 . . . . 2.8100000000000001 113.521 168.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . 0.435 ' HB ' ' HB3' ' B' ' 66' ' ' GLU . 5.9 p -90.43 135.21 33.83 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.974 1.309 . . . . 1.3400000000000001 110.954 -171.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -114.93 108.42 16.69 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.42 1.888 . . . . 2.0499999999999998 110.691 -159.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.487 ' HA ' ' HA ' ' B' ' 66' ' ' GLU . 0.9 OUTLIER -76.17 162.29 28.1 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 119.394 -2.066 . . . . 2.6400000000000001 115.364 -171.278 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -44.23 -38.28 3.71 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.728 0.811 . . . . 3.6499999999999999 112.176 169.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.66 -41.51 26.76 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.773 -1.204 . . . . 4.6799999999999997 114.055 177.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -58.31 -40.16 81.3 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.139 0.575 . . . . 1.76 109.978 173.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 18.3 tp -65.68 -41.86 91.93 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.818 1.247 . . . . 2.0099999999999998 112.669 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 20.7 mtpt -49.73 -53.06 27.08 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 120.305 1.411 . . . . 3.4399999999999999 111.483 176.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -67.14 -41.61 85.79 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 117.959 -1.02 . . . . 3.1200000000000001 113.305 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.6 tt -54.87 -54.21 45.41 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.618 1.099 . . . . 1.9399999999999999 110.471 175.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 29.1 mt -57.88 -48.57 83.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 118.186 -0.911 . . . . 1.3200000000000001 109.856 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -75.65 -8.12 56.01 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 115.205 1.557 . . . . 5.0700000000000003 115.205 -172.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -108.29 -45.24 3.95 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.162 1.385 . . . . 3.6499999999999999 112.353 174.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -80.23 -19.83 46.01 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.122 0.569 . . . . 5.5099999999999998 111.357 -178.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mp -128.66 174.14 9.68 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.351 1.861 . . . . 3.71 108.77 156.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 27.0 p -150.91 4.17 0.47 Allowed 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 116.755 2.132 . . . . 3.1400000000000001 116.755 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.422 ' H ' HD12 ' B' ' 44' ' ' LEU . 4.5 mp -43.16 -32.34 0.72 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 117.405 2.372 . . . . 3.0699999999999998 117.405 -168.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.64 -26.98 2.6 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 124.82 1.2 . . . . 2.9300000000000002 113.515 -178.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -61.03 -25.82 67.18 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.471 1.135 . . . . 5.7599999999999998 113.007 167.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.92 72.97 0.18 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 122.839 1.304 . . . . 2.7400000000000002 110.622 147.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.1 mppt? -66.13 159.23 26.64 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.05 -0.977 . . . . 4.9199999999999999 108.742 166.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -52.2 -37.66 55.55 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 113.359 0.874 . . . . 4.96 113.359 -177.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 35.2 t -62.37 -16.7 56.18 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 115.021 1.489 . . . . 4.1100000000000003 115.021 174.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 3.3 t -106.33 -3.38 21.22 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.419 1.488 . . . . 3.0800000000000001 112.264 173.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 19.6 mm -80.2 -44.0 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 O-C-N 120.025 -1.672 . . . . 1.8799999999999999 110.839 175.088 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -70.98 -42.58 69.48 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.55 0.574 . . . . 3.3700000000000001 112.55 -178.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.95 -35.08 69.48 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 120.43 -1.419 . . . . 2.4300000000000002 112.483 -177.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -54.42 -47.88 72.28 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.324 1.049 . . . . 2.5299999999999998 110.285 164.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.49 -44.33 89.35 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.849 1.26 . . . . 1.7 112.378 177.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -69.6 -27.22 64.91 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 120.832 -1.167 . . . . 4.1299999999999999 113.597 176.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 23.0 t -71.71 -36.13 70.44 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 121.125 -0.984 . . . . 2.8599999999999999 111.523 170.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 8.7 mp -62.78 -50.33 71.47 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-O 118.352 -0.833 . . . . 2.71 112.102 168.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -87.57 82.4 7.46 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 122.086 0.946 . . . . 1.6699999999999999 113.293 -169.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -21.65 58.74 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.121 1.156 . . . . 3.8100000000000001 114.121 -177.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -84.69 -22.89 29.62 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.28 0.945 . . . . 2.3700000000000001 112.101 175.599 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 32.2 t 58.5 38.92 25.44 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.576 1.151 . . . . 2.21 112.138 -167.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -88.54 -119.24 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.478 1.511 . . . . 3.04 107.152 176.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -148.6 -3.82 0.46 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 117.447 2.388 . . . . 4.5499999999999998 117.447 166.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . 0.487 ' HA ' ' HA ' ' B' ' 30' ' ' SER . 16.8 mt-10 -118.5 146.69 44.33 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 123.175 1.464 . . . . 3.25 112.702 166.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . 0.432 HG22 ' HB2' ' B' ' 72' ' ' TYR . 79.1 mt -103.07 115.62 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 126.958 2.103 . . . . 1.77 109.405 -175.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.74 161.73 25.57 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.808 2.043 . . . . 2.6299999999999999 111.2 169.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.2 -31.93 67.79 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 119.982 -1.699 . . . . 2.4300000000000002 114.749 -174.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.9 mtmp? -83.11 -16.98 44.7 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.222 1.409 . . . . 3.5099999999999998 113.151 177.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -70.66 -61.85 1.61 Allowed 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 107.389 -1.338 . . . . 1.99 107.389 156.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . 0.432 ' HB2' HG22 ' B' ' 67' ' ' ILE . 32.0 t80 -58.45 -29.86 66.49 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 127.975 2.51 . . . . 2.48 117.3 -171.117 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 60.2 p -58.29 -24.01 58.15 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 120.777 1.626 . . . . 2.3399999999999999 113.745 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.9 p -67.56 -22.82 28.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 O-C-N 121.529 -0.732 . . . . 2.0099999999999998 112.578 174.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -63.73 -51.15 66.21 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.233 1.013 . . . . 3.0800000000000001 110.397 174.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 39.5 mt -60.74 -44.56 96.52 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 124.183 0.993 . . . . 2.1000000000000001 110.39 176.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 43.4 m -54.69 -54.35 42.94 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.743 0.817 . . . . 1.03 111.423 176.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 48.5 mtm -60.32 -45.15 94.43 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.403 0.681 . . . . 1.78 112.124 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 82.4 mt -63.17 -43.71 97.5 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 118.467 0.576 . . . . 2.04 112.354 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 93.3 m -67.76 -33.82 75.6 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 122.742 0.417 . . . . 1.6899999999999999 112.073 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 64.5 mtp -68.56 -38.76 81.04 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 118.777 0.717 . . . . 2.04 112.847 172.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.23 -38.19 66.13 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.482 1.037 . . . . 0.89000000000000001 112.351 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -68.31 -25.66 65.24 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.403 1.001 . . . . 2.04 113.362 177.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 17.7 t30 -59.54 -46.09 89.89 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.358 0.981 . . . . 2.27 111.499 169.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.89 -34.69 44.55 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.307 1.443 . . . . 3.1400000000000001 111.973 -175.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -53.32 -54.49 35.77 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.331 1.452 . . . . 2.9500000000000002 110.019 166.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -54.11 -36.28 63.05 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.895 1.278 . . . . 2.7400000000000002 112.757 177.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 55.1 mt -74.16 -19.16 60.65 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.916 1.08 . . . . 2.1800000000000002 113.916 178.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -101.83 -14.94 17.07 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.567 1.321 . . . . 3.5699999999999998 114.567 171.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -96.47 -48.45 5.56 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.312 1.845 . . . . 4.7599999999999998 112.548 -176.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -87.83 46.75 1.41 Allowed 'General case' 0 CA--C 1.548 0.866 0 CA-C-O 122.903 1.335 . . . . 4.2699999999999996 111.316 173.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm . . . . . 0 C--O 1.25 1.107 0 CA-C-O 114.903 -2.475 . . . . 5.5700000000000003 114.894 168.874 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 . . . . . 0 CA--C 1.531 0.22 0 N-CA-C 108.648 -0.871 . . . . 3.8300000000000001 108.648 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.407 HG21 ' O ' ' B' ' 41' ' ' GLU . 7.9 t 174.13 150.76 0.25 Allowed Pre-proline 0 C--O 1.236 0.386 0 C-N-CA 127.331 2.253 . . . . 2.3999999999999999 107.612 -163.498 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -73.51 -24.25 16.38 Favored 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 121.925 1.75 . . . . 1.6399999999999999 112.437 175.564 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -69.54 -43.05 73.79 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.141 -0.933 . . . . 3.48 112.584 -171.557 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -53.08 -34.52 56.96 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 122.137 0.97 . . . . 4.2400000000000002 112.563 171.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 46.9 mttt -80.68 -25.52 38.16 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.67 -1.269 . . . . 4.2000000000000002 111.455 -179.037 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.47 -42.23 62.16 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.027 0.931 . . . . 1.05 111.198 169.461 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 83.7 mt -64.3 -43.02 96.04 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.185 0.994 . . . . 1.4099999999999999 111.224 171.741 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 87.2 m -55.35 -42.84 74.41 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.136 -0.977 . . . . 1.53 111.664 167.912 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.5 m -61.63 -38.34 87.3 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 119.763 1.165 . . . . 1.3700000000000001 111.387 178.73 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 33.1 ttm -56.34 -53.88 52.06 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 118.473 0.579 . . . . 3.0 111.388 169.924 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 93.2 t -62.39 -37.07 77.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-N 118.798 0.727 . . . . 1.8999999999999999 112.498 178.685 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 76.0 m -57.43 -59.17 5.55 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.907 1.283 . . . . 0.79000000000000004 110.408 177.315 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.21 -34.28 70.7 Favored 'General case' 0 CA--C 1.521 -0.167 0 C-N-CA 123.789 0.836 . . . . 2.5800000000000001 110.599 -170.109 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -57.59 -40.35 78.84 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.344 0.658 . . . . 2.2999999999999998 110.976 174.612 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 36.6 m170 -78.81 -28.17 44.45 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.931 1.086 . . . . 2.5299999999999998 113.931 176.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.1 mtmp? -60.27 -55.72 30.33 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.366 1.439 . . . . 4.6200000000000001 111.438 166.553 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -71.24 -32.28 68.57 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.516 -0.74 . . . . 2.1299999999999999 111.96 -177.485 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.0 t -73.04 -6.43 45.49 Favored 'General case' 0 C--O 1.247 0.948 0 N-CA-C 116.465 2.024 . . . . 2.4300000000000002 116.465 -178.389 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.7 -12.62 74.34 Favored Glycine 0 CA--C 1.539 1.551 0 CA-C-O 119.061 -0.855 . . . . 2.2400000000000002 113.02 166.338 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -60.98 -31.35 70.94 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.507 1.523 . . . . 6.7999999999999998 113.652 -177.315 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 173.13 -149.95 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 129.662 3.185 . . . . 4.2199999999999998 111.706 164.337 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.04 -149.44 21.8 Favored Glycine 0 N--CA 1.476 1.352 0 O-C-N 120.351 -1.468 . . . . 2.2200000000000002 111.973 -175.229 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.7 m -78.48 -177.49 5.31 Favored 'General case' 0 CA--C 1.55 0.975 0 O-C-N 121.007 -1.29 . . . . 2.2799999999999998 112.072 158.351 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.48 ' HZ2' ' C ' ' B' ' 92' ' ' LYS . 38.1 ttmt -84.54 -32.99 23.58 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.191 1.397 . . . . 4.4299999999999997 111.726 169.579 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.424 ' H ' HD23 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -82.07 6.84 14.99 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.923 1.689 . . . . 3.1800000000000002 114.711 178.022 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 24.1 p -146.95 150.9 36.09 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.843 1.657 . . . . 1.1499999999999999 110.554 -170.141 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 79.1 mt -116.82 109.36 16.99 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.248 1.019 . . . . 1.5 112.331 174.603 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.0 t -77.46 151.93 34.47 Favored 'General case' 0 CA--C 1.549 0.924 0 O-C-N 121.325 -0.859 . . . . 2.1499999999999999 111.886 173.316 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.42 -46.19 4.63 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 126.087 1.755 . . . . 5.5899999999999999 115.604 -172.169 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.38 -18.06 61.21 Favored 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 115.051 1.5 . . . . 4.8700000000000001 115.051 178.996 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -90.73 -45.57 8.77 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 128.77 2.828 . . . . 2.1299999999999999 109.837 175.276 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.19 -31.04 72.01 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.281 1.033 . . . . 2.7999999999999998 112.906 175.318 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.95 -17.72 65.05 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.754 1.39 . . . . 5.4000000000000004 114.754 177.097 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.22 -58.2 3.42 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.38 1.072 . . . . 3.6899999999999999 108.894 171.529 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.9 tt -50.03 -56.02 12.44 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.729 1.611 . . . . 1.8799999999999999 112.121 -179.145 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.5 mt -53.69 -60.19 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 CA-C-N 118.85 0.75 . . . . 0.82999999999999996 109.937 -175.142 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.4 tptt -72.39 -9.64 58.77 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 113.264 0.839 . . . . 5.8200000000000003 113.264 -174.794 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 46.0 mmtt -91.69 -35.91 13.91 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.82 1.648 . . . . 3.4300000000000002 114.988 173.702 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -104.25 -44.38 4.98 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.652 0.781 . . . . 5.1399999999999997 112.094 -175.04 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -104.47 61.4 0.72 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.434 1.894 . . . . 3.0099999999999998 107.92 175.131 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 59.1 m -45.8 -64.94 0.62 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.537 1.535 . . . . 3.6400000000000001 113.066 -166.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 95.9 mt 65.19 152.17 0.05 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 127.862 2.465 . . . . 4.5099999999999998 115.974 168.426 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.57 -25.29 63.35 Favored Glycine 0 N--CA 1.474 1.199 0 O-C-N 121.378 -0.826 . . . . 2.9300000000000002 111.336 171.513 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.48 -160.2 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 129.484 3.114 . . . . 6.7000000000000002 110.894 173.312 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 17.8 mmt 43.5 93.38 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.22 1.808 . . . . 2.9100000000000001 115.187 -179.729 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.53 126.96 50.99 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.131 -1.062 . . . . 4.2199999999999998 108.131 164.076 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -12.73 -83.7 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 127.705 2.402 . . . . 4.9299999999999997 114.951 -157.652 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.5 t -60.08 -11.44 5.98 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.884 1.809 . . . . 4.3600000000000003 115.884 -172.009 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.9 t -61.53 -13.88 24.97 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 120.749 -1.219 . . . . 1.96 113.513 164.684 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 88.9 mt -77.03 -21.35 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 126.585 1.954 . . . . 1.3500000000000001 111.828 171.156 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -70.66 -53.53 15.41 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.858 0.754 . . . . 3.0099999999999998 111.3 -169.462 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -67.47 -34.01 76.29 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 121.51 -0.744 . . . . 3.2999999999999998 111.889 172.467 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.6 tp -54.73 -59.37 4.8 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 118.52 -0.752 . . . . 1.9399999999999999 110.186 174.11 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -67.4 -33.02 74.32 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.465 0.575 . . . . 1.8100000000000001 112.161 -179.323 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.5 tmtm? -65.78 -22.25 66.56 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 120.782 -1.198 . . . . 6.1600000000000001 112.885 169.455 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.2 t -86.89 -28.33 22.88 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.352 1.861 . . . . 1.9099999999999999 112.637 170.054 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.7 mt -65.83 -33.71 76.48 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.436 -0.79 . . . . 1.97 111.335 167.444 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -68.32 99.14 0.89 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 122.636 1.208 . . . . 2.3999999999999999 111.818 176.925 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -67.42 -23.6 65.56 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.691 1.196 . . . . 5.0999999999999996 113.697 -176.764 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -83.9 -29.81 26.86 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.322 1.449 . . . . 2.98 112.079 167.81 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.7 t 72.25 41.67 0.61 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 128.707 2.803 . . . . 3.3700000000000001 112.143 -167.569 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -94.9 -117.82 0.1 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.736 1.615 . . . . 3.8599999999999999 106.775 -179.656 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -153.04 -9.12 0.17 Allowed 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 116.394 1.998 . . . . 4.4500000000000002 116.394 173.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -101.41 128.97 47.37 Favored 'General case' 0 C--O 1.242 0.665 0 N-CA-C 106.857 -1.534 . . . . 2.6000000000000001 106.857 171.788 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.413 HG22 ' HB2' ' A' ' 72' ' ' TYR . 20.1 mm -96.54 89.74 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 124.451 1.1 . . . . 1.25 109.586 174.086 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -56.68 151.95 13.02 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.698 1.199 . . . . 2.98 111.3 165.106 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -46.95 -39.92 13.31 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.356 1.243 . . . . 2.2999999999999998 114.356 -175.831 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.58 -10.04 58.53 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.708 1.203 . . . . 3.4100000000000001 113.906 -179.544 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -73.1 -63.2 1.23 Allowed 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 106.633 -1.617 . . . . 2.04 106.633 155.599 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.413 ' HB2' HG22 ' A' ' 67' ' ' ILE . 24.0 t80 -49.04 -30.84 6.75 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 128.375 2.67 . . . . 2.0800000000000001 115.74 -173.931 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.5 m -53.45 -30.54 41.15 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.597 -1.314 . . . . 1.9099999999999999 113.229 173.158 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.0 m -68.98 -27.01 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 CA-C-N 119.903 1.229 . . . . 2.6699999999999999 112.935 179.816 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -59.47 -55.09 39.06 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.11 0.964 . . . . 1.75 109.968 173.416 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 52.3 mt -71.12 -25.91 62.79 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.015 -0.993 . . . . 2.3799999999999999 111.481 -179.599 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 41.5 m -64.48 -51.53 62.56 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.154 0.888 . . . . 0.93999999999999995 111.33 169.582 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 29.3 mtm -58.1 -45.57 87.02 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.455 1.025 . . . . 1.6499999999999999 111.909 179.121 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 72.6 mt -67.15 -38.18 85.08 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.905 -0.497 . . . . 1.28 112.085 178.563 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 33.5 t -63.28 -31.6 72.8 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.248 0.619 . . . . 1.8400000000000001 112.387 172.541 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 71.1 mtp -68.39 -40.19 81.46 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 119.701 1.137 . . . . 1.6599999999999999 112.324 167.448 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.15 -42.52 99.47 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.762 0.71 . . . . 0.77000000000000002 112.654 -179.112 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -60.69 -26.68 67.3 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.876 1.065 . . . . 3.0699999999999998 113.876 173.354 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -69.96 -37.7 75.88 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.466 1.03 . . . . 1.9199999999999999 112.796 176.402 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -73.04 -38.5 66.48 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.687 0.795 . . . . 3.2000000000000002 111.253 176.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -53.16 -51.47 61.9 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.131 1.372 . . . . 2.3900000000000001 110.959 172.198 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -55.54 -27.35 48.38 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.387 1.475 . . . . 2.3399999999999999 113.156 178.2 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 44.3 mt -84.03 -12.21 55.55 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.589 1.156 . . . . 1.73 113.496 178.776 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 82.0 mm-40 -90.88 -38.34 12.99 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.266 1.026 . . . . 2.79 113.147 165.882 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 . . . . . 0 CA--C 1.544 0.721 0 C-N-CA 126.975 2.11 . . . . 3.4300000000000002 114.637 -178.245 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 64.2 p . . . . . 0 N--CA 1.475 0.808 0 N-CA-C 112.626 0.602 . . . . 2.1699999999999999 112.626 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -67.32 -21.25 47.82 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.899 2.4 . . . . 1.79 112.855 172.404 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -63.49 -45.79 89.14 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-N 118.877 0.762 . . . . 2.4100000000000001 110.487 166.219 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.51 -48.19 82.18 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 118.594 0.634 . . . . 3.7599999999999998 110.579 173.233 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . 0.499 ' HE3' ' HA ' ' B' ' 7' ' ' LYS . 0.0 OUTLIER -58.09 -25.17 60.98 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 120.576 -1.327 . . . . 4.29 114.508 175.026 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.57 -41.69 99.09 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.498 0.59 . . . . 1.3999999999999999 110.924 176.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 29.2 mt -57.78 -48.62 79.15 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.251 1.02 . . . . 1.8100000000000001 111.324 172.963 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.1 -48.27 79.03 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.919 0.888 . . . . 1.1599999999999999 111.018 177.622 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -72.54 -32.54 66.17 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.163 -0.922 . . . . 2.3399999999999999 111.932 -177.817 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 7.6 mtp -64.42 -41.5 96.57 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.486 1.114 . . . . 2.9399999999999999 112.328 171.796 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.78 -36.89 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 119.629 1.104 . . . . 1.8600000000000001 111.422 169.328 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 88.7 m -63.77 -54.77 30.04 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 118.069 -0.967 . . . . 0.90000000000000002 110.89 -176.524 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.7 p -63.7 -44.64 93.09 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.056 0.942 . . . . 1.74 110.03 176.949 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -65.17 -47.12 78.1 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.484 -0.486 . . . . 2.3999999999999999 110.886 -174.472 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -67.51 -44.81 77.53 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 120.796 -1.19 . . . . 2.5699999999999998 111.968 177.719 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -65.34 -20.81 66.56 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 120.78 -1.2 . . . . 4.5300000000000002 113.839 178.727 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -98.73 -1.18 41.18 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.625 0.972 . . . . 2.3599999999999999 113.625 164.814 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 41.8 m -87.26 -48.93 7.61 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 120.702 1.592 . . . . 1.6799999999999999 113.173 175.535 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.28 13.0 57.06 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.376 1.941 . . . . 1.78 112.693 174.478 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 8.8 ttm-85 -65.11 -59.33 4.23 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.033 1.333 . . . . 2.9900000000000002 109.507 169.451 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -156.35 -172.43 4.08 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 126.263 1.825 . . . . 3.6600000000000001 110.461 -169.506 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.59 -135.69 47.24 Favored Glycine 0 N--CA 1.472 1.092 0 O-C-N 120.962 -1.086 . . . . 2.5499999999999998 110.667 -178.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 6.6 t -82.19 158.89 23.41 Favored 'General case' 0 C--O 1.247 0.931 0 CA-C-O 123.329 1.538 . . . . 3.5 111.2 154.723 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -84.52 155.75 22.0 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.993 1.317 . . . . 7.54 110.33 170.899 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.5 tt 71.42 -21.59 0.21 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.516 1.927 . . . . 3.21 112.868 -166.45 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.3 p -107.2 150.58 26.47 Favored 'General case' 0 C--O 1.253 1.237 0 C-N-CA 126.223 1.809 . . . . 1.01 115.099 174.337 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -98.48 108.51 21.22 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 129.784 3.233 . . . . 2.1099999999999999 111.712 173.045 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 9.5 t -85.51 161.94 19.14 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.282 1.033 . . . . 2.0699999999999998 113.279 174.773 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 33.5 ttt85 -50.2 -19.53 0.8 Allowed 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 117.293 2.331 . . . . 3.6099999999999999 117.293 -174.964 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.21 -25.35 12.02 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.286 1.217 . . . . 4.4900000000000002 114.286 170.702 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -62.12 -51.91 66.0 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 108.362 -0.977 . . . . 2.0499999999999998 108.362 169.485 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 8.1 tp -60.31 -38.79 84.77 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 125.172 1.389 . . . . 1.9199999999999999 112.651 179.173 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -55.74 -41.75 74.37 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 122.098 -0.376 . . . . 3.0600000000000001 110.851 175.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -65.34 -49.52 69.08 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 117.834 -1.079 . . . . 3.4100000000000001 113.293 169.631 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 tt -53.25 -48.9 67.85 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 120.155 1.343 . . . . 2.1200000000000001 111.671 -179.259 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 5.8 mt -65.35 -40.18 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 120.087 1.312 . . . . 0.91000000000000003 110.583 178.915 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -65.2 0.17 1.48 Allowed 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 114.572 1.323 . . . . 5.1900000000000004 114.572 171.566 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -119.78 -45.93 2.47 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.662 1.585 . . . . 3.5 112.971 177.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . 0.407 ' O ' HG21 ' A' ' 3' ' ' THR . 28.5 mt-10 -72.72 -29.34 63.27 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-O 117.418 -1.277 . . . . 4.29 112.785 175.367 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -125.24 -81.7 0.63 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.909 1.684 . . . . 2.5299999999999998 110.469 -175.978 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.5 t 64.07 -44.24 0.27 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 129.01 2.924 . . . . 4.79 115.745 -175.555 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 4.3 pp -61.92 -15.39 42.67 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 127.771 2.429 . . . . 3.3399999999999999 115.941 -167.707 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -79.92 13.17 26.32 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 124.346 0.974 . . . . 3.3799999999999999 114.148 171.757 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 61.43 56.07 2.69 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.205 2.202 . . . . 7.1799999999999997 111.811 -176.965 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.77 74.41 0.59 Allowed 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 115.624 1.712 . . . . 3.3100000000000001 115.624 -161.639 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -88.38 168.88 12.29 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 127.367 2.267 . . . . 5.2599999999999998 112.443 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -48.1 -53.61 15.96 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.789 1.236 . . . . 4.6200000000000001 113.146 -178.83 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 21.5 t -66.13 5.11 0.56 Allowed 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 115.652 1.723 . . . . 3.3500000000000001 115.652 -179.605 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 43.0 t -119.41 -40.63 2.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.17 1.388 . . . . 2.2200000000000002 111.765 166.732 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 26.0 mm -59.67 -33.93 53.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.612 1.565 . . . . 1.3200000000000001 112.507 174.307 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -70.67 -42.09 71.2 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.998 1.319 . . . . 4.1500000000000004 112.339 179.729 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -74.36 -42.23 59.69 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 124.362 1.065 . . . . 2.98 111.61 177.49 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 49.2 tp -58.73 -46.62 86.97 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.05 0.94 . . . . 2.3199999999999998 110.513 171.465 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 17.4 tpp -54.26 -49.18 70.13 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.059 0.943 . . . . 2.1000000000000001 110.773 174.334 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.65 -22.49 45.97 Favored 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 114.307 1.225 . . . . 4.1100000000000003 114.307 175.605 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.8 t -92.85 -28.25 16.64 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 120.744 -1.223 . . . . 2.6299999999999999 113.427 171.477 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.81 -42.44 27.75 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 127.924 2.49 . . . . 2.0 112.724 -179.127 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -99.34 128.4 45.45 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 124.776 1.231 . . . . 1.9299999999999999 110.24 166.546 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -95.27 -11.34 28.09 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.741 -0.599 . . . . 3.6699999999999999 112.606 173.794 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . 0.555 ' HB2' ' H ' ' B' ' 64' ' ' ASP . 5.2 m120 -94.32 -32.98 13.38 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.515 1.302 . . . . 1.8100000000000001 114.515 -169.502 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 9.2 t 72.91 15.87 4.57 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.161 1.384 . . . . 2.9300000000000002 112.462 -156.048 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . 0.555 ' H ' ' HB2' ' B' ' 62' ' ' ASN . 53.9 p-10 -71.94 -18.45 62.01 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.382 1.073 . . . . 2.1000000000000001 109.802 169.741 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 61.08 21.23 11.64 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 128.98 2.912 . . . . 4.4199999999999999 111.853 -178.758 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -126.23 144.9 50.61 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 128.375 2.67 . . . . 2.1200000000000001 109.657 171.811 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 16.0 mt -128.3 130.26 69.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 125.791 1.637 . . . . 1.3200000000000001 109.428 -171.325 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.34 173.01 6.49 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.915 1.686 . . . . 2.9700000000000002 111.516 168.868 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -47.25 -40.77 17.26 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.235 1.414 . . . . 3.1899999999999999 114.811 176.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 24.2 mtmm -70.28 -43.93 69.42 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.526 -0.734 . . . . 3.4300000000000002 110.986 -176.651 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -61.34 -47.22 86.89 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.185 0.994 . . . . 2.2400000000000002 110.642 173.773 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -58.89 -22.0 58.59 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 128.499 2.719 . . . . 2.5899999999999999 113.647 177.448 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 9.4 t -53.31 -35.26 59.95 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 120.982 -1.074 . . . . 2.6099999999999999 111.714 168.491 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 65.0 t -66.14 -31.89 55.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 O-C-N 121.248 -0.907 . . . . 1.6799999999999999 112.15 -179.868 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . 0.434 ' CE1' HD11 ' B' ' 79' ' ' LEU . 36.0 t80 -67.53 -56.98 7.34 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.431 1.092 . . . . 2.6800000000000002 111.849 173.522 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 77.8 mt -55.43 -39.82 70.74 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.046 1.338 . . . . 1.71 111.397 179.309 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 58.6 m -65.39 -52.19 55.16 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.141 1.376 . . . . 0.96999999999999997 111.815 176.538 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 16.7 ptp -65.63 -38.0 88.16 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.426 1.012 . . . . 2.3900000000000001 112.677 -177.412 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.434 HD11 ' CE1' ' B' ' 75' ' ' PHE . 92.3 mt -65.78 -47.01 76.58 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.269 0.628 . . . . 1.53 111.101 175.73 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 94.0 m -65.61 -32.58 74.23 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.462 -0.774 . . . . 1.71 112.611 176.864 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 52.9 mtm -65.85 -37.04 85.12 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.923 1.238 . . . . 3.1899999999999999 112.715 172.238 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.28 -42.42 98.61 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.602 1.092 . . . . 0.96999999999999997 112.593 173.313 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -69.67 -32.9 71.8 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.533 0.938 . . . . 2.79 113.533 172.682 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -58.8 -48.97 79.43 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.175 0.898 . . . . 2.6499999999999999 112.062 172.282 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -59.26 -48.66 80.79 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.163 1.385 . . . . 3.1800000000000002 111.44 177.78 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.09 -45.44 68.2 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.448 1.499 . . . . 2.6099999999999999 112.326 175.242 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -71.21 -28.18 64.03 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.31 1.444 . . . . 2.2400000000000002 112.861 -177.665 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 78.9 mt -77.74 -8.95 58.69 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.883 1.068 . . . . 2.3399999999999999 113.883 177.677 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -92.69 -3.38 54.96 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 119.298 0.954 . . . . 5.1200000000000001 113.333 167.564 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -99.7 -74.84 0.58 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.237 1.415 . . . . 4.96 110.203 166.926 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.32 -7.78 54.9 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 116.311 1.967 . . . . 5.1100000000000003 116.311 -167.159 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . 0.48 ' C ' ' HZ2' ' A' ' 26' ' ' LYS 0.26 4.0 tttp . . . . . 0 C--O 1.248 0.976 1 C-N-CA 131.827 4.051 . . . . 9.0399999999999991 116.897 -158.704 . . . . . . . . 3 2 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 . . . . . 0 CA--C 1.529 0.168 0 N-CA-C 107.711 -1.218 . . . . 3.3100000000000001 107.711 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 66.4 p -135.96 162.39 57.03 Favored Pre-proline 0 C--O 1.238 0.474 0 C-N-CA 124.96 1.304 . . . . 1.55 109.846 160.914 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -64.31 -22.78 66.22 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 121.826 1.684 . . . . 1.3400000000000001 112.091 166.551 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -69.68 -52.01 29.55 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.532 1.133 . . . . 3.5600000000000001 111.649 177.071 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -52.28 -44.22 64.86 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.563 1.145 . . . . 4.0599999999999996 111.041 175.196 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.537 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -77.35 -34.35 55.18 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 115.317 1.599 . . . . 5.8799999999999999 115.317 -178.936 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.39 -42.17 77.47 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 123.441 0.697 . . . . 1.23 112.001 165.039 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 74.0 mt -70.39 -34.19 72.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.264 0.938 . . . . 1.8400000000000001 112.37 173.911 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 5.1 m -60.56 -46.51 89.94 Favored 'General case' 0 N--CA 1.479 0.981 0 O-C-N 121.063 -1.023 . . . . 1.5800000000000001 110.937 167.463 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.5 m -57.86 -41.36 82.28 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.868 1.667 . . . . 1.6200000000000001 111.221 -179.003 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 19.0 tpp -52.93 -56.78 13.41 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 117.953 -1.023 . . . . 3.75 111.852 168.702 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -62.35 -32.8 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 CA-C-N 120.983 1.719 . . . . 2.3100000000000001 113.106 -176.425 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.4 m -60.83 -58.93 6.39 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.631 1.172 . . . . 1.1299999999999999 111.069 173.787 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 t -73.54 -30.03 62.82 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 117.332 -1.318 . . . . 3.1299999999999999 110.399 -171.141 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -53.82 -53.03 58.16 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 125.677 1.591 . . . . 2.4300000000000002 110.01 170.708 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -59.15 -29.04 67.13 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.123 1.157 . . . . 2.2799999999999998 114.123 175.141 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.9 tttp -64.67 -31.72 73.07 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 120.724 -1.235 . . . . 4.1699999999999999 112.57 176.258 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -94.84 -38.7 10.62 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.729 1.212 . . . . 2.1299999999999999 112.778 177.452 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.3 p -70.05 -25.97 63.8 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.109 1.322 . . . . 2.2599999999999998 113.343 174.304 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.24 40.74 2.94 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 126.807 2.146 . . . . 2.4100000000000001 113.871 171.729 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -96.27 -26.34 15.44 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 118.941 1.371 . . . . 5.0499999999999998 112.349 166.059 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.02 153.38 42.16 Favored 'General case' 0 C--O 1.245 0.856 0 C-N-CA 128.722 2.809 . . . . 5.4400000000000004 110.24 177.984 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 46.46 -108.52 0.27 Allowed Glycine 0 C--N 1.345 1.038 0 C-N-CA 127.255 2.36 . . . . 3.0 114.996 147.396 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 m -59.9 102.82 0.17 Allowed 'General case' 0 C--O 1.241 0.635 0 N-CA-C 108.77 -0.826 . . . . 2.7400000000000002 108.77 166.669 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.7 -15.47 56.41 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.04 0.755 . . . . 5.0 113.04 -176.381 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 10.7 mp -83.96 -49.23 9.17 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 126.012 1.725 . . . . 4.6299999999999999 110.986 177.098 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.4 p -111.31 170.36 8.17 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.939 2.096 . . . . 2.0800000000000001 113.331 -168.748 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 46.7 mt -116.55 103.73 10.7 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.456 1.502 . . . . 1.48 113.04 -162.796 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.94 172.47 10.87 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 121.18 -0.95 . . . . 2.1600000000000001 112.114 165.804 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.53 -48.64 2.86 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.593 1.957 . . . . 3.9500000000000002 114.594 -177.667 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -41.53 74.55 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.657 -0.652 . . . . 6.5199999999999996 112.239 -178.616 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 87.8 mt-10 -67.55 -44.38 78.41 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.369 -0.604 . . . . 1.96 109.369 -178.06 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.83 -52.31 66.0 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.728 1.211 . . . . 2.1499999999999999 112.156 177.264 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 15.5 ptmt -63.75 -25.81 68.36 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 120.288 1.404 . . . . 3.52 114.217 -176.204 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -81.84 -50.94 8.63 Favored 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 124.927 1.291 . . . . 3.27 110.634 -177.726 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.1 tt -46.68 -55.22 8.09 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 125.407 1.483 . . . . 2.1400000000000001 110.209 177.245 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.0 mt -51.59 -55.55 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 118.701 0.682 . . . . 1.3 110.689 -178.903 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -68.8 -23.45 64.29 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.984 0.735 . . . . 3.9700000000000002 112.984 -172.768 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.78 -14.99 22.85 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 126.81 2.044 . . . . 5.9500000000000002 113.258 -179.22 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -79.42 -54.82 5.55 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.977 1.311 . . . . 4.4800000000000004 109.487 161.374 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.0 mt -119.3 91.31 3.52 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.85 1.66 . . . . 3.2200000000000002 110.729 -179.167 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 4.6 t -84.74 71.18 10.86 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.282 -0.886 . . . . 3.0600000000000001 109.756 168.121 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 pp -171.41 -179.39 2.59 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 128.067 2.547 . . . . 3.8700000000000001 110.112 -172.222 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 65.12 13.4 57.59 Favored Glycine 0 N--CA 1.477 1.404 0 O-C-N 121.707 -0.621 . . . . 4.5700000000000003 112.339 -173.796 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 44.5 53.03 7.27 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 129.568 3.147 . . . . 6.0499999999999998 109.878 178.934 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.1 tpp -67.36 80.69 0.15 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.344 1.858 . . . . 1.95 113.962 -157.425 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -74.11 129.67 38.29 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.956 2.503 . . . . 5.2199999999999998 109.467 178.602 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -64.87 -10.29 27.46 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 116.348 1.981 . . . . 3.9199999999999999 116.348 -159.757 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.8 t -60.21 -28.81 68.29 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.245 -1.535 . . . . 4.2300000000000004 113.555 166.329 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.0 p -90.53 1.12 57.01 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.929 1.241 . . . . 2.5299999999999998 113.194 172.251 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 19.8 mm -82.18 -40.45 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 119.121 0.873 . . . . 2.0899999999999999 110.924 167.534 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -67.73 -52.47 37.26 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 118.649 0.658 . . . . 4.9699999999999998 112.751 -171.024 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -72.69 -26.47 61.63 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.929 -0.482 . . . . 3.2200000000000002 112.025 -179.173 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.32 -51.27 70.22 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 117.669 -1.158 . . . . 2.3700000000000001 109.551 165.771 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ttt -52.76 -46.26 67.42 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 119.932 1.242 . . . . 1.4299999999999999 111.838 174.132 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -68.69 -26.24 65.19 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 120.952 1.705 . . . . 3.52 113.442 177.651 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.1 t -71.69 -28.68 63.87 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 120.953 -1.092 . . . . 2.9399999999999999 111.741 172.239 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 11.8 mt -72.88 -58.82 3.05 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.915 -1.115 . . . . 1.8799999999999999 109.855 165.559 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -84.25 61.3 6.46 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.542 1.937 . . . . 1.5600000000000001 111.665 -177.253 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.0 mttp -52.01 -20.7 2.55 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 127.561 2.344 . . . . 3.1099999999999999 114.472 -171.253 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 35.1 p-10 -111.27 -0.85 16.28 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 129.074 2.95 . . . . 2.5099999999999998 114.125 -175.499 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.6 t 67.42 30.59 6.81 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.775 1.23 . . . . 2.2599999999999998 114.268 168.134 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -90.17 -9.13 49.32 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.42 1.488 . . . . 2.7400000000000002 112.826 -176.408 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.28 -9.64 1.43 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 129.69 3.196 . . . . 4.3200000000000003 116.9 178.088 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -106.51 142.0 36.89 Favored 'General case' 0 C--O 1.247 0.971 0 C-N-CA 125.701 1.6 . . . . 2.8300000000000001 112.205 173.738 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.5 mt -120.37 101.06 10.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-O 122.854 1.312 . . . . 1.5 111.867 -167.852 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.45 ' OD1' ' HE3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -74.27 158.45 34.04 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 129.053 2.941 . . . . 3.27 111.998 171.527 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.79 -25.8 67.41 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 120.636 -1.29 . . . . 2.5600000000000001 114.09 -174.425 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.455 ' HE2' ' SD ' ' B' ' 81' ' ' MET . 2.5 mtmt -81.55 -33.47 31.68 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 120.548 1.522 . . . . 3.3399999999999999 111.872 173.535 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -54.94 -53.59 53.67 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.027 0.831 . . . . 2.1699999999999999 109.003 165.27 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -66.01 -33.73 76.47 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 127.196 2.199 . . . . 2.1000000000000001 114.751 -175.943 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.33 -21.37 61.98 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 120.443 -1.411 . . . . 1.97 113.304 -175.348 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 p -60.13 -26.98 38.03 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 O-C-N 121.315 -0.865 . . . . 2.3300000000000001 112.477 171.697 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -68.0 -51.59 45.41 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 126.679 1.992 . . . . 2.4199999999999999 111.361 178.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.75 -46.85 67.65 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.178 0.991 . . . . 2.23 109.841 169.786 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 20.6 m -61.42 -55.53 30.33 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.974 0.909 . . . . 0.94999999999999996 111.238 -176.675 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 21.1 ptm -66.53 -36.33 82.43 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.814 0.672 . . . . 1.95 112.814 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.4 mt -66.54 -41.56 88.51 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.177 -0.916 . . . . 1.26 111.43 173.437 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.5 m -64.25 -36.73 85.05 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 120.051 1.296 . . . . 1.4099999999999999 112.731 175.57 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 38.1 mmm -61.17 -44.82 96.71 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.054 0.542 . . . . 2.0600000000000001 111.202 174.063 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.27 -38.5 81.8 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.772 0.829 . . . . 0.95999999999999996 112.236 -178.608 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -65.93 -27.46 68.2 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.319 0.859 . . . . 2.3700000000000001 113.319 175.036 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.14 -36.66 74.93 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 119.254 0.934 . . . . 2.5699999999999998 112.15 173.809 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -67.14 -43.58 82.0 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.885 0.874 . . . . 3.4500000000000002 110.847 175.926 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -52.6 -44.73 66.18 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.719 1.608 . . . . 2.9100000000000001 112.358 173.361 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -62.61 -27.23 69.06 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.069 1.748 . . . . 2.6800000000000002 112.541 178.892 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 45.3 mt -83.07 -18.6 39.06 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.403 1.081 . . . . 2.5699999999999998 112.84 177.156 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -90.26 -10.32 44.68 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.718 1.377 . . . . 3.2200000000000002 114.718 171.854 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 18.1 t70 . . . . . 0 N--CA 1.468 0.471 0 C-N-CA 126.034 1.734 . . . . 3.0600000000000001 112.591 169.011 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 9.6 t . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 112.256 0.465 . . . . 3.9500000000000002 112.256 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -66.95 -9.11 23.74 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.181 1.921 . . . . 2.4199999999999999 113.081 172.691 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.404 ' O ' HD13 ' B' ' 5' ' ' LEU . 0.3 OUTLIER -69.56 -37.7 77.11 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 117.098 -1.43 . . . . 2.8199999999999998 112.6 176.931 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 13.4 tm-20 -54.34 -42.04 69.78 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 121.427 1.921 . . . . 5.0 110.137 179.118 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 38.5 mtmt -55.05 -23.72 21.4 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.603 0.964 . . . . 7.3899999999999997 113.603 175.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.82 -49.03 61.87 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 120.731 -1.231 . . . . 0.94999999999999996 111.007 176.274 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -57.42 -48.91 77.88 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 119.393 0.997 . . . . 2.8900000000000001 109.886 178.858 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 13.9 p -64.15 -44.22 92.79 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.394 1.078 . . . . 2.0899999999999999 112.684 177.937 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 26.9 m -70.2 -32.16 69.94 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.64 1.109 . . . . 1.53 110.813 178.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -70.78 -50.26 37.7 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.12 0.968 . . . . 3.5699999999999998 111.045 176.682 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 6.3 p -59.83 -27.3 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-N 120.509 1.504 . . . . 2.2999999999999998 112.104 175.122 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 60.7 m -64.81 -57.8 7.93 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 116.921 -1.514 . . . . 0.92000000000000004 111.593 175.159 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.9 p -61.61 -41.48 97.53 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.147 1.34 . . . . 1.6100000000000001 109.07 175.317 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -64.45 -49.56 70.95 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 120.515 -0.474 . . . . 2.1299999999999999 111.604 -170.369 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 12.0 t60 -69.23 -44.69 71.5 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.774 -0.579 . . . . 2.4199999999999999 111.225 178.532 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -66.78 -39.47 87.83 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.015 -1.053 . . . . 4.2800000000000002 112.91 -175.289 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -80.18 -27.31 38.96 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.62 0.768 . . . . 2.29 112.424 173.016 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 57.0 m -68.91 -22.92 64.13 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.169 1.349 . . . . 2.4900000000000002 112.716 168.292 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.08 11.33 72.48 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 125.656 1.598 . . . . 1.77 115.45 178.127 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.478 HH11 ' HG3' ' B' ' 22' ' ' ARG . 7.9 mmt85 -80.77 -23.38 39.38 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.196 1.398 . . . . 4.29 114.181 177.994 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -164.01 149.64 10.86 Favored 'General case' 0 C--O 1.25 1.088 0 C-N-CA 126.481 1.913 . . . . 3.2400000000000002 108.738 -171.215 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.78 -142.32 16.6 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-O 121.702 0.612 . . . . 2.3100000000000001 111.855 -174.301 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 58.9 m -75.17 151.51 38.51 Favored 'General case' 0 C--O 1.242 0.661 0 O-C-N 121.331 -1.099 . . . . 3.8599999999999999 112.55 178.714 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -71.84 56.55 0.3 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.759 2.024 . . . . 5.9100000000000001 111.915 167.038 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 59.5 tp -160.2 -42.81 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.116 1.366 . . . . 4.0 110.0 -170.556 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.4 p -101.45 140.25 35.99 Favored 'General case' 0 C--O 1.251 1.15 0 C-N-CA 125.066 1.346 . . . . 1.77 110.297 173.842 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.45 ' H ' HD23 ' B' ' 29' ' ' LEU 0.263 1.8 pt? -98.58 94.72 6.83 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 122.334 1.064 . . . . 3.27 109.493 158.042 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 5.6 m -65.33 165.24 12.07 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 126.729 2.012 . . . . 3.0899999999999999 112.532 -176.004 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . 0.5 HH22 ' CG ' ' B' ' 53' ' ' ASP . 0.9 OUTLIER -30.07 -39.07 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 128.394 2.678 . . . . 5.25 117.14 -178.191 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.4 -37.9 11.22 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.793 1.405 . . . . 4.3300000000000001 114.793 174.115 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -53.44 -41.54 66.2 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.71 1.204 . . . . 2.0699999999999998 109.579 174.305 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.453 HD23 ' HB2' ' B' ' 56' ' ' MET . 24.7 tp -71.41 -40.89 70.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.108 0.963 . . . . 1.8200000000000001 113.473 179.7 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 24.1 ttmt -62.84 -45.09 94.21 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 120.837 -1.165 . . . . 3.1099999999999999 111.949 176.003 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -52.81 -56.83 12.86 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.378 1.471 . . . . 3.2200000000000002 111.993 167.006 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -60.05 -47.82 84.28 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.707 1.603 . . . . 2.5800000000000001 112.846 -174.71 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.8 mt -59.24 -48.27 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 CA-C-N 120.254 1.388 . . . . 1.05 109.547 175.485 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -62.53 -22.86 66.62 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.107 0.78 . . . . 4.0499999999999998 113.107 -179.489 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -82.06 -53.62 5.96 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 117.353 -1.308 . . . . 3.6899999999999999 113.383 168.806 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -67.45 -35.97 80.27 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.632 1.173 . . . . 4.2300000000000004 112.527 -172.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -92.03 -73.89 0.53 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.924 1.29 . . . . 3.1600000000000001 110.263 174.178 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 11.9 t 66.13 -40.76 0.35 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 127.908 2.483 . . . . 3.8399999999999999 113.616 -168.858 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 pp -62.5 174.31 1.02 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 128.063 2.545 . . . . 3.4900000000000002 113.787 172.087 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.04 -142.04 23.88 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 115.456 -0.793 . . . . 3.0699999999999998 111.836 167.131 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -119.32 57.47 0.89 Allowed 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 122.399 1.095 . . . . 5.1900000000000004 109.564 178.206 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.76 47.53 1.4 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 124.234 1.969 . . . . 2.5899999999999999 113.401 -175.059 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 37.5 mttp -81.42 152.56 27.35 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.121 2.168 . . . . 4.1299999999999999 112.169 172.192 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -47.44 -54.04 12.45 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.49 1.293 . . . . 3.3399999999999999 114.49 -163.155 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 9.0 t -61.25 -23.7 65.84 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 120.184 1.356 . . . . 3.1699999999999999 113.945 -176.292 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 9.8 t -86.71 -9.37 56.08 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.978 0.808 . . . . 2.1600000000000001 112.94 174.95 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 22.3 mt -97.52 -40.05 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 125.9 1.68 . . . . 1.3400000000000001 110.833 172.32 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.5 ' CG ' HH22 ' B' ' 31' ' ' ARG . 0.9 OUTLIER -67.52 -39.2 85.08 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 126.076 1.75 . . . . 4.0099999999999998 110.08 176.567 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -69.8 -44.92 69.07 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 118.559 0.618 . . . . 2.96 112.337 166.102 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 7.4 tt -57.85 -44.37 86.48 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.466 1.03 . . . . 2.2799999999999998 111.186 -177.893 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . 0.453 ' HB2' HD23 ' B' ' 34' ' ' LEU . 1.9 ppp? -67.06 -38.8 86.43 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.453 1.024 . . . . 2.1699999999999999 111.959 176.972 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 1.4 tmpt? -62.74 -23.39 67.16 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.905 1.282 . . . . 3.9700000000000002 112.812 169.317 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 22.1 m -92.31 -22.45 19.72 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.639 1.576 . . . . 2.6299999999999999 112.95 178.218 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 19.2 mt -67.09 -47.67 70.51 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 118.643 0.656 . . . . 1.9199999999999999 109.731 163.403 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -78.08 141.66 38.66 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.949 1.3 . . . . 2.5899999999999999 113.832 -173.266 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -115.5 3.31 14.04 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.018 1.327 . . . . 3.3999999999999999 112.2 178.523 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -117.37 -28.94 5.99 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.612 1.565 . . . . 2.7799999999999998 112.933 -162.378 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 46.0 m 67.83 29.37 6.74 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 129.227 3.011 . . . . 2.79 112.52 -161.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 37.2 p30 -85.31 -14.32 46.88 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 120.695 -1.253 . . . . 2.4700000000000002 112.383 -170.92 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 58.99 4.63 0.43 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 129.901 3.28 . . . . 4.7999999999999998 115.236 -168.2 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -105.22 122.34 45.73 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 127.472 2.309 . . . . 2.8399999999999999 110.589 176.535 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 32.1 mm -101.87 107.03 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 114.646 -1.161 . . . . 1.8100000000000001 109.823 175.391 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.48 158.29 32.22 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.829 2.051 . . . . 4.1900000000000004 112.516 173.243 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -50.39 -25.57 4.03 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.278 1.431 . . . . 3.1200000000000001 113.219 163.114 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm -91.72 -16.96 26.15 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 115.623 1.712 . . . . 5.1299999999999999 115.623 176.283 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -89.89 -44.18 10.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.586 1.154 . . . . 1.8899999999999999 109.725 172.703 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -54.42 -22.12 11.64 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.518 1.927 . . . . 1.8500000000000001 114.297 179.17 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 41.0 p -55.76 -29.57 59.82 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 119.869 -1.769 . . . . 2.2000000000000002 113.068 168.393 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 88.2 t -61.12 -34.83 61.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 CA-C-N 119.412 1.005 . . . . 1.7 111.034 173.497 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -66.56 -54.63 21.52 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.038 0.835 . . . . 2.4300000000000002 110.968 177.476 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 76.2 mt -56.86 -36.33 69.92 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.329 0.652 . . . . 1.4099999999999999 112.269 177.463 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 60.8 m -61.63 -46.63 88.99 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.185 0.994 . . . . 0.98999999999999999 111.072 177.087 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.2 mtm -61.26 -43.53 98.72 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 118.845 0.748 . . . . 1.74 112.252 178.32 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -57.6 -54.59 45.16 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 118.714 0.688 . . . . 2.6899999999999999 110.883 173.733 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 89.7 m -66.85 -30.43 70.61 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.298 1.221 . . . . 1.54 114.298 -176.676 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . 0.455 ' SD ' ' HE2' ' A' ' 70' ' ' LYS . 14.3 mtp -75.09 -33.56 61.65 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.777 1.171 . . . . 2.23 112.562 171.514 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.21 -50.21 66.73 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 119.333 0.97 . . . . 0.91000000000000003 111.376 172.158 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -60.67 -24.45 65.6 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.403 0.89 . . . . 3.0499999999999998 113.403 175.917 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -66.64 -46.92 74.23 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 117.955 -1.022 . . . . 2.7599999999999998 112.484 170.394 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -65.14 -30.16 71.07 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 120.429 1.468 . . . . 3.2799999999999998 112.108 177.626 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.443 ' HA ' ' HG2' ' B' ' 89' ' ' GLU . 0.5 OUTLIER -63.94 -46.64 83.82 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 127.407 2.283 . . . . 3.2000000000000002 111.953 175.15 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -81.13 4.24 20.71 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 119.704 -1.873 . . . . 2.3599999999999999 113.253 171.092 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 81.8 mt -109.57 -0.9 18.51 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 114.376 1.25 . . . . 2.0499999999999998 114.376 165.696 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . 0.443 ' HG2' ' HA ' ' B' ' 86' ' ' PHE . 21.4 pt-20 -97.23 -27.3 14.59 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.59 1.541 . . . . 5.6200000000000001 113.601 170.869 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -46.33 -42.51 14.87 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.519 1.128 . . . . 5.9299999999999997 111.273 149.015 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -85.14 -0.95 56.21 Favored 'General case' 0 CA--C 1.559 1.306 0 N-CA-C 116.258 1.947 . . . . 5.3300000000000001 116.258 177.303 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 19.0 mttp . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 116.279 -1.82 . . . . 5.96 115.468 -172.301 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.3 mp0 . . . . . 0 C--O 1.235 0.301 0 N-CA-C 108.758 -0.83 . . . . 4.04 108.758 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -55.24 157.05 6.85 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 127.583 2.353 . . . . 2.54 112.852 172.454 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -65.21 -28.96 55.75 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.41 2.073 . . . . 2.0899999999999999 113.5 -168.174 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 27.9 tp -66.57 -47.79 71.67 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 120.042 1.292 . . . . 4.0199999999999996 110.974 174.321 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -60.15 -34.13 73.14 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.794 -0.566 . . . . 4.9400000000000004 110.819 174.192 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.514 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 5.4 mmpt? -72.84 -33.16 65.98 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 120.152 -1.592 . . . . 4.3399999999999999 113.988 173.478 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.64 -45.73 85.54 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 118.808 0.731 . . . . 1.3700000000000001 110.729 170.432 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 55.8 mt -67.02 -35.19 79.38 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.945 -1.097 . . . . 1.71 112.872 174.328 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 84.8 m -55.54 -46.75 77.05 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.479 1.112 . . . . 1.72 110.709 169.165 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 81.6 m -57.24 -48.53 78.6 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.746 0.818 . . . . 1.76 109.678 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.1 tpp -51.3 -55.66 17.11 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.09 0.956 . . . . 3.1499999999999999 113.563 179.554 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.76 -29.15 46.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 123.689 0.795 . . . . 2.52 112.489 -177.599 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.5 m -72.75 -46.28 54.3 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.184 1.394 . . . . 1.02 110.578 -179.372 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.44 -37.27 77.7 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 118.634 -0.698 . . . . 2.1699999999999999 111.084 165.371 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -66.81 -60.19 2.88 Favored 'General case' 0 C--O 1.222 -0.343 0 O-C-N 123.532 0.52 . . . . 2.1000000000000001 110.845 -170.116 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.9 m170 -72.12 -1.94 16.76 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.892 1.441 . . . . 2.2999999999999998 114.892 -178.322 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -88.56 -62.58 1.46 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.413 1.085 . . . . 4.3099999999999996 112.535 164.957 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -72.64 -39.3 67.31 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.795 1.18 . . . . 2.5899999999999999 113.261 -179.215 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.0 t -62.29 -22.74 66.26 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.498 -0.751 . . . . 2.25 111.818 -176.035 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -157.03 106.8 0.3 Allowed Glycine 0 C--N 1.343 0.924 0 N-CA-C 116.181 1.232 . . . . 2.3100000000000001 116.181 164.479 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -79.86 -13.55 59.31 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 114.736 -0.732 . . . . 5.0800000000000001 111.777 132.307 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -165.14 -167.94 1.3 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.0 2.12 . . . . 3.8500000000000001 109.022 -161.879 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 39.2 53.94 2.62 Favored Glycine 0 N--CA 1.474 1.184 0 C-N-CA 125.936 1.732 . . . . 3.4300000000000002 113.84 160.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.2 t 56.11 138.55 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.686 1.994 . . . . 2.96 114.186 -167.424 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.0 mmmt -70.32 -18.61 63.1 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 120.864 -1.147 . . . . 5.6900000000000004 113.983 172.751 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.5 mt -102.16 -6.61 23.04 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.518 1.127 . . . . 3.6000000000000001 113.076 -171.338 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.2 p -136.98 139.45 41.47 Favored 'General case' 0 C--O 1.247 0.962 0 C-N-CA 126.231 1.812 . . . . 1.03 109.771 -174.478 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -94.61 103.31 15.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.064 0.946 . . . . 1.8300000000000001 110.136 170.408 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -74.15 161.31 30.12 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 119.973 -1.704 . . . . 2.2599999999999998 111.113 165.7 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -39.57 -46.77 1.82 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.285 1.834 . . . . 4.2999999999999998 114.481 -167.605 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.478 ' H ' ' HD3' ' A' ' 32' ' ' LYS . 0.6 OUTLIER -69.36 -42.27 75.46 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.927 1.084 . . . . 4.3399999999999999 113.927 -179.108 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -60.56 -48.7 80.6 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.846 1.658 . . . . 1.5900000000000001 108.641 176.426 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.1 tp -61.4 -43.39 98.95 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.654 0.782 . . . . 1.8899999999999999 111.502 178.253 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -66.48 -37.91 86.15 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 118.363 -0.827 . . . . 3.6600000000000001 112.732 -173.049 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -56.86 -54.44 46.46 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 117.792 -1.099 . . . . 3.9100000000000001 112.543 166.376 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.6 tt -53.42 -60.81 2.82 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.907 0.883 . . . . 1.99 110.514 -179.214 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.9 mt -56.96 -51.65 65.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 N-CA-C 108.831 -0.803 . . . . 0.81999999999999995 108.831 -175.801 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -61.96 -35.79 79.5 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.172 0.896 . . . . 4.0 113.115 -175.328 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 60.8 mttm -66.28 -34.87 78.97 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.503 1.047 . . . . 2.96 112.956 172.116 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -72.47 -51.61 19.42 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.454 1.102 . . . . 4.6600000000000001 111.793 179.521 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -82.12 25.82 0.56 Allowed 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 126.45 1.9 . . . . 2.6899999999999999 113.025 -176.453 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.0 m -60.87 6.6 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 126.544 1.938 . . . . 3.1099999999999999 115.766 177.866 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.597 HD12 ' H ' ' A' ' 44' ' ' LEU . 5.0 mp -60.67 -21.51 62.9 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.417 1.887 . . . . 4.0199999999999996 112.8 162.333 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 119.26 14.87 5.75 Favored Glycine 0 N--CA 1.473 1.163 0 C-N-CA 126.335 1.921 . . . . 2.9100000000000001 114.552 175.929 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -88.06 -174.28 4.61 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.291 0.848 . . . . 5.54 113.291 -174.069 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 77.07 -8.05 1.75 Allowed 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.994 1.85 . . . . 3.1000000000000001 115.994 154.575 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.2 mptt -8.82 114.51 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 130.075 3.35 . . . . 6.0199999999999996 114.92 178.405 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -9.91 -56.12 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 130.656 3.582 . . . . 4.4500000000000002 119.891 -149.007 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.1 t -77.57 -17.35 57.95 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.855 1.057 . . . . 2.9399999999999999 113.855 -178.036 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.9 t -75.41 -10.65 59.64 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.0 1.273 . . . . 2.1600000000000001 112.08 173.554 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 70.3 mt -73.98 -27.41 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.693 1.197 . . . . 1.3700000000000001 111.483 161.095 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -91.98 -30.29 16.17 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.672 0.789 . . . . 3.6800000000000002 112.339 -174.384 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -68.44 -37.82 80.59 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.436 -0.79 . . . . 2.29 111.507 161.739 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 58.8 tp -57.49 -46.72 83.41 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 116.747 -1.596 . . . . 1.6899999999999999 110.574 168.706 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.8 mtp -51.35 -48.5 62.45 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 121.239 1.836 . . . . 1.8200000000000001 112.248 173.596 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.68 -21.26 62.64 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.413 1.485 . . . . 3.9199999999999999 113.005 175.975 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -82.22 -39.14 23.51 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 120.51 -1.369 . . . . 1.8200000000000001 113.476 167.326 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 84.4 mt -83.77 -37.43 22.63 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.4 1.48 . . . . 2.0899999999999999 114.771 -172.808 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.428 ' C ' ' HE2' ' A' ' 61' ' ' LYS . 7.2 t70 -79.1 129.04 34.03 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.605 0.717 . . . . 2.54 110.419 177.568 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.428 ' HE2' ' C ' ' A' ' 60' ' ' ASP . 0.8 OUTLIER -101.69 -17.52 16.26 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.6 0.76 . . . . 3.3799999999999999 112.741 178.125 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.7 m120 -95.27 -26.03 16.1 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 115.097 1.518 . . . . 2.3700000000000001 115.097 -170.745 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.6 m 61.61 36.42 16.73 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.735 1.614 . . . . 2.3599999999999999 111.48 -163.334 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 48.4 p30 -92.34 -11.93 33.73 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 127.134 2.174 . . . . 2.4100000000000001 111.828 178.039 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 65.4 18.46 11.33 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 128.758 2.823 . . . . 5.3899999999999997 113.053 -177.153 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -139.18 139.43 37.55 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 122.703 1.239 . . . . 3.0600000000000001 112.377 170.26 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 1.9 mt -98.19 97.82 6.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 124.074 0.95 . . . . 1.8 109.644 -171.531 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -47.64 143.56 3.74 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 127.814 2.445 . . . . 2.3900000000000001 110.665 162.393 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -47.08 -36.99 8.88 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 122.196 0.998 . . . . 2.5299999999999998 112.337 172.619 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -69.79 -29.59 66.93 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.088 1.755 . . . . 3.0800000000000001 114.346 175.965 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.416 ' O ' HG12 ' A' ' 74' ' ' VAL . 51.2 mt-10 -74.13 -54.73 7.19 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 108.324 -0.991 . . . . 1.8999999999999999 108.324 166.418 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -53.99 -25.61 21.86 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 127.063 2.145 . . . . 1.96 114.627 -178.552 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.3 t -62.07 -31.9 72.38 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.767 -1.208 . . . . 1.6299999999999999 111.714 173.027 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.416 HG12 ' O ' ' A' ' 71' ' ' GLU . 2.0 p -74.61 -23.83 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-N 119.635 1.107 . . . . 2.0499999999999998 112.123 -177.483 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -63.65 -50.74 68.08 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.131 0.972 . . . . 2.04 110.115 169.466 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 44.7 mt -59.38 -41.47 89.44 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.394 1.078 . . . . 1.8500000000000001 111.161 177.24 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 88.0 m -58.96 -52.51 65.47 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.314 1.046 . . . . 0.90000000000000002 111.72 171.726 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 36.1 mtp -56.53 -45.94 80.88 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.839 0.855 . . . . 1.8600000000000001 112.281 179.275 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 92.7 mt -62.63 -47.07 85.34 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 123.338 0.655 . . . . 1.3700000000000001 111.488 177.179 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 79.1 m -64.45 -34.88 79.22 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.543 0.942 . . . . 1.76 113.543 178.564 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.5 mmm -65.67 -42.51 91.24 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 118.009 0.368 . . . . 2.3700000000000001 111.065 174.598 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.24 -35.8 78.48 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.761 -0.638 . . . . 1.1599999999999999 112.308 179.769 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -76.98 -30.23 55.86 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.187 1.18 . . . . 2.5099999999999998 114.187 177.683 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -58.55 -49.44 77.42 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.987 0.812 . . . . 2.1200000000000001 110.926 167.936 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.44 -33.13 75.02 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.107 1.363 . . . . 4.5999999999999996 111.84 178.292 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -59.98 -45.51 92.47 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.86 1.264 . . . . 2.48 112.625 174.468 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -63.26 -34.13 77.0 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.867 1.267 . . . . 2.6600000000000001 111.922 177.058 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 71.2 mt -74.68 -7.84 54.51 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.222 1.409 . . . . 2.5699999999999998 113.477 178.166 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -101.38 -1.09 34.22 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.217 1.407 . . . . 3.5699999999999998 114.139 170.518 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.8 t70 . . . . . 0 CA--C 1.543 0.709 0 C-N-CA 125.844 1.658 . . . . 3.5699999999999998 111.977 179.13 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . 0.552 HG23 ' H ' ' B' ' 6' ' ' GLU . 4.7 t . . . . . 0 C--O 1.236 0.362 0 N-CA-C 108.01 -1.107 . . . . 3.2400000000000002 108.01 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -63.74 -16.68 56.18 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 121.726 1.618 . . . . 1.7 112.22 167.58 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 24.8 tp -68.38 -50.65 51.48 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.64 1.109 . . . . 2.8999999999999999 112.204 -177.111 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . 0.552 ' H ' HG23 ' B' ' 3' ' ' THR . 2.6 tm-20 -47.95 -54.58 12.33 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.055 1.342 . . . . 4.0300000000000002 110.63 167.303 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -70.34 -26.33 63.7 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.496 -0.752 . . . . 4.8499999999999996 112.278 -171.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.61 -38.93 74.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.894 1.278 . . . . 0.93000000000000005 111.933 170.623 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.93 -44.24 81.18 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.897 1.226 . . . . 1.8899999999999999 110.388 171.906 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 59.1 m -55.6 -43.46 76.05 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.616 1.566 . . . . 1.8799999999999999 111.991 172.232 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.15 -32.12 58.93 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 121.036 -1.04 . . . . 1.77 113.17 175.949 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -55.98 -49.07 74.62 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.959 1.254 . . . . 3.2799999999999998 110.218 167.755 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 29.9 t -59.21 -30.6 44.26 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 C-N-CA 124.938 1.295 . . . . 2.25 112.906 172.152 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 29.8 m -71.39 -45.49 62.66 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 120.881 -1.137 . . . . 0.82999999999999996 111.785 175.483 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.22 -32.29 64.29 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.923 0.783 . . . . 1.8899999999999999 110.248 167.604 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -64.06 -58.24 7.25 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 118.473 -0.775 . . . . 2.0499999999999998 110.563 179.632 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 47.2 m-70 -57.23 -43.94 83.35 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 120.589 1.54 . . . . 4.5499999999999998 112.184 178.494 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -56.71 -36.8 70.08 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.086 1.354 . . . . 5.21 113.961 -177.794 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -108.87 -34.11 6.75 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.725 1.009 . . . . 2.3100000000000001 113.725 -179.308 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -67.96 -27.5 66.65 Favored 'General case' 0 C--O 1.249 1.067 0 C-N-CA 125.251 1.42 . . . . 1.75 111.774 175.463 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.81 4.51 60.8 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 128.119 2.771 . . . . 1.8100000000000001 115.222 177.551 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 17.9 mtp180 -78.83 -113.1 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.117 1.459 . . . . 4.1600000000000001 110.575 172.496 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.51 -178.16 1.7 Allowed 'General case' 0 C--O 1.248 0.979 0 C-N-CA 124.954 1.302 . . . . 3.9199999999999999 113.018 178.144 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 62.97 -145.73 50.17 Favored Glycine 0 C--N 1.34 0.783 0 C-N-CA 125.036 1.303 . . . . 2.1600000000000001 111.531 171.412 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.6 m -66.51 153.37 43.09 Favored 'General case' 0 C--O 1.248 0.984 0 CA-C-O 123.723 1.725 . . . . 3.6600000000000001 110.31 155.28 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -82.71 -4.05 57.29 Favored 'General case' 0 CA--C 1.552 1.048 0 O-C-N 120.364 -1.46 . . . . 6.9100000000000001 113.555 175.593 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 4.9 mp -103.04 0.39 31.97 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 128.175 2.59 . . . . 3.5499999999999998 112.592 171.924 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 81.9 p -132.13 157.57 43.89 Favored 'General case' 0 C--O 1.245 0.846 0 C-N-CA 125.356 1.462 . . . . 1.1299999999999999 112.0 -178.562 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -95.29 128.45 42.14 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.395 1.478 . . . . 2.1299999999999999 110.552 167.229 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 23.0 t -101.1 171.99 7.28 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.27 1.428 . . . . 2.0 112.062 162.754 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 48.6 ttm-85 -58.87 -20.29 49.85 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.986 1.714 . . . . 3.8500000000000001 114.96 -165.143 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -95.74 -39.8 9.68 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.46 1.482 . . . . 5.7999999999999998 113.791 169.704 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -46.48 -44.87 17.92 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.224 1.01 . . . . 1.73 111.806 168.679 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 8.6 tp -77.67 -44.65 27.38 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 119.44 -0.314 . . . . 2.1200000000000001 111.687 -175.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . 0.465 ' HG2' HG21 ' B' ' 52' ' ' ILE . 52.3 mttm -54.87 -46.38 74.71 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 118.858 0.754 . . . . 3.1299999999999999 111.662 172.837 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -56.54 -53.92 51.95 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 123.852 0.72 . . . . 2.9300000000000002 111.469 174.379 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 64.0 tp -56.6 -57.67 11.36 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 125.26 1.424 . . . . 2.2999999999999998 112.375 -177.109 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 34.5 mt -56.95 -39.24 64.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.87 0.868 . . . . 1.53 110.268 179.225 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -68.62 -9.25 48.68 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 120.689 -1.257 . . . . 4.0700000000000003 113.768 -176.387 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -104.8 -60.72 1.56 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.067 0.947 . . . . 3.7799999999999998 109.219 164.107 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -82.6 67.3 8.6 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 127.473 2.309 . . . . 5.6600000000000001 110.543 -176.578 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -173.73 29.58 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 127.861 2.465 . . . . 2.6899999999999999 111.075 166.878 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 33.5 t -50.96 -16.25 0.41 Allowed 'General case' 0 CA--C 1.557 1.246 0 N-CA-C 117.71 2.485 . . . . 3.46 117.71 -159.688 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.482 HD23 ' H ' ' B' ' 44' ' ' LEU . 1.9 pt? -96.93 -7.4 33.32 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 116.226 1.936 . . . . 3.4700000000000002 116.226 174.459 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -110.35 105.96 2.04 Favored Glycine 0 N--CA 1.469 0.882 0 C-N-CA 125.148 1.356 . . . . 3.71 112.547 -175.751 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -75.4 84.95 2.53 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-O 122.247 1.023 . . . . 6.0099999999999998 111.218 179.17 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 8.0 mmt -84.93 117.87 24.19 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 126.378 1.871 . . . . 3.2799999999999998 113.093 -178.289 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -70.71 140.94 51.55 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.892 1.277 . . . . 3.1600000000000001 110.126 171.431 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -53.21 -47.94 68.54 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 114.333 1.235 . . . . 3.8700000000000001 114.333 -168.147 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 15.4 t -70.83 -19.31 62.67 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.025 1.12 . . . . 4.2400000000000002 114.025 178.835 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 38.0 m -76.12 -18.92 58.93 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 120.884 -1.135 . . . . 3.9399999999999999 111.884 172.35 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . 0.465 HG21 ' HG2' ' B' ' 35' ' ' LYS . 11.9 mm -66.28 -34.22 68.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 118.828 0.74 . . . . 1.75 110.908 167.531 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -78.31 -21.88 48.99 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.044 0.838 . . . . 3.75 113.13 -177.83 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.636 ' HA ' ' HE3' ' B' ' 57' ' ' LYS . 9.8 t70 -77.78 -41.19 38.28 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 118.438 0.563 . . . . 2.71 111.357 166.23 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 50.7 tp -59.98 -48.31 82.21 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-O 118.411 -0.804 . . . . 2.3599999999999999 111.227 173.143 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 2.5 ppp? -59.93 -40.46 89.0 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.203 0.91 . . . . 2.1600000000000001 110.187 -179.493 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . 0.636 ' HE3' ' HA ' ' B' ' 54' ' ' ASP . 11.7 ttpp -61.51 -36.06 79.47 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.099 1.76 . . . . 3.3599999999999999 113.227 172.6 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 5.6 t -75.16 -34.06 61.55 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.844 -1.16 . . . . 1.97 111.581 176.417 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 70.9 mt -69.09 -34.26 74.83 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 117.437 -1.268 . . . . 1.8500000000000001 111.389 170.568 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -96.8 90.34 5.22 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.474 1.51 . . . . 1.99 113.919 -179.339 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . 0.412 ' H ' ' HD2' ' B' ' 61' ' ' LYS . 3.8 mptt -67.18 -19.8 65.63 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.904 1.281 . . . . 3.6600000000000001 113.28 -178.732 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . 0.4 ' HB2' ' H ' ' B' ' 64' ' ' ASP . 1.7 m120 -78.7 -31.76 46.67 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.161 0.892 . . . . 2.3100000000000001 112.886 173.065 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 12.5 t 63.51 24.03 13.89 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.951 1.3 . . . . 2.8900000000000001 113.637 -159.29 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . 0.4 ' H ' ' HB2' ' B' ' 62' ' ' ASN . 54.3 p-10 -81.57 -18.43 44.89 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.496 1.518 . . . . 2.5899999999999999 112.52 176.477 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 76.88 1.53 3.23 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 131.504 3.921 . . . . 4.3600000000000003 113.186 179.066 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -92.77 112.8 24.88 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 125.465 1.506 . . . . 2.4199999999999999 107.109 164.503 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 2.7 mt -97.65 107.46 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 O-C-N 121.045 -1.035 . . . . 1.5 109.816 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -56.71 154.04 9.64 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.487 1.115 . . . . 3.7400000000000002 110.272 173.691 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -49.4 -46.11 47.0 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 120.727 -1.233 . . . . 2.4199999999999999 110.842 163.176 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -53.28 -31.18 42.54 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 127.958 2.503 . . . . 4.0599999999999996 115.319 173.054 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -87.19 -53.69 4.71 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.476 1.511 . . . . 1.75 109.371 176.84 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -58.42 -31.28 67.57 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 129.12 2.968 . . . . 2.3399999999999999 113.982 -177.54 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 23.3 t -56.74 -23.16 40.72 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 120.703 1.592 . . . . 2.3900000000000001 112.837 178.786 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 78.2 t -64.79 -25.71 38.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 124.051 0.94 . . . . 1.47 112.011 176.423 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -57.2 -53.16 61.29 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.489 1.516 . . . . 2.3999999999999999 110.803 169.206 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 25.7 mt -57.93 -43.48 86.32 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.18 1.392 . . . . 1.3500000000000001 109.985 179.387 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 65.3 m -58.26 -53.08 62.36 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 117.807 -1.092 . . . . 0.84999999999999998 111.478 176.654 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.6 mtm -57.1 -47.76 80.28 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.602 1.092 . . . . 1.6000000000000001 112.019 -179.536 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 84.0 mt -68.68 -39.45 80.58 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.786 0.834 . . . . 1.6200000000000001 112.677 -178.174 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.8 t -73.16 -31.83 64.49 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.645 -0.659 . . . . 1.6499999999999999 111.877 177.66 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 47.6 mtt -63.77 -43.74 95.48 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.787 0.721 . . . . 2.8399999999999999 110.994 169.637 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.2 -37.53 85.68 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.412 0.523 . . . . 0.68999999999999995 112.412 176.349 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -70.07 -35.77 74.47 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.612 0.967 . . . . 2.3100000000000001 113.612 172.645 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -65.88 -37.4 86.03 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 119.306 0.957 . . . . 2.6200000000000001 112.28 175.199 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -68.19 -42.37 80.01 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.337 1.055 . . . . 2.6499999999999999 111.983 173.028 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -52.51 -43.97 65.42 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.912 1.285 . . . . 2.3500000000000001 112.185 175.758 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -63.08 -25.74 68.51 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.809 1.643 . . . . 2.4300000000000002 112.438 179.023 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 39.4 mt -85.3 -12.33 52.6 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.638 1.175 . . . . 2.1499999999999999 113.072 178.158 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . 0.485 ' CD ' ' HZ2' ' B' ' 92' ' ' LYS . 14.3 mm-40 -93.19 -8.11 43.35 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.277 1.831 . . . . 3.6000000000000001 114.234 169.307 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -89.44 -46.93 8.34 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.836 2.055 . . . . 4.1299999999999999 111.425 169.801 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -71.17 0.27 8.17 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.433 1.493 . . . . 3.8100000000000001 114.848 -172.003 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . 0.485 ' HZ2' ' CD ' ' B' ' 89' ' ' GLU . 16.7 pttm . . . . . 0 C--O 1.249 1.033 0 N-CA-C 117.186 2.291 . . . . 5.2000000000000002 117.186 -168.464 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 . . . . . 0 CA--C 1.536 0.415 0 N-CA-C 109.541 -0.54 . . . . 3.52 109.541 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.455 HG21 ' HA ' ' B' ' 41' ' ' GLU . 67.1 p -133.96 157.86 76.74 Favored Pre-proline 0 N--CA 1.471 0.619 0 C-N-CA 124.463 1.105 . . . . 1.49 111.1 -169.571 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.99 -21.54 32.27 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 122.305 2.004 . . . . 1.4199999999999999 112.216 176.7 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.24 -44.56 52.56 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.479 1.111 . . . . 2.2999999999999998 110.886 176.45 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -67.15 -33.63 75.84 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.451 -0.781 . . . . 4.0 111.7 170.134 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -62.97 -35.9 81.72 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 119.957 -1.714 . . . . 5.9400000000000004 112.037 168.765 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.59 -56.17 17.98 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 120.405 1.457 . . . . 1.1299999999999999 110.954 176.451 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 70.2 mt -57.58 -39.97 77.97 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.567 1.147 . . . . 1.48 112.847 -178.384 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 19.7 p -67.3 -39.17 85.9 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 117.83 -1.081 . . . . 2.4300000000000002 112.097 174.089 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.0 m -65.48 -32.51 74.17 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.375 0.989 . . . . 1.5 111.562 179.921 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -55.34 -57.12 13.13 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 118.227 0.467 . . . . 3.5499999999999998 110.016 168.91 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 74.9 t -60.93 -37.79 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.024 0.53 . . . . 1.9299999999999999 111.797 -176.573 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.7 m -56.26 -57.92 10.18 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.216 1.006 . . . . 1.0700000000000001 111.424 175.974 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.74 -28.45 55.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 118.688 -0.672 . . . . 2.9700000000000002 110.885 -170.749 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -63.05 -41.55 99.52 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.855 1.662 . . . . 1.8500000000000001 112.596 173.892 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 18.7 m170 -66.14 -20.93 66.3 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.756 1.021 . . . . 2.2200000000000002 113.756 175.873 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -65.34 -36.76 85.0 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.77 1.168 . . . . 5.1600000000000001 111.906 172.545 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -102.81 -38.46 7.41 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 114.176 1.176 . . . . 2.1899999999999999 114.176 -170.292 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.3 t -59.02 -32.87 70.12 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 120.106 1.321 . . . . 1.95 112.686 179.61 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -93.56 34.16 4.76 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 126.845 2.164 . . . . 1.3200000000000001 113.95 179.705 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.41 52.76 0.28 Allowed 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.202 1.501 . . . . 4.0899999999999999 110.089 162.912 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . 0.254 6.3 tp10 -6.53 -92.99 0.0 OUTLIER 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.854 1.057 . . . . 9.5399999999999991 113.854 -114.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 43.24 63.47 2.06 Favored Glycine 0 C--N 1.34 0.798 0 C-N-CA 124.71 1.148 . . . . 3.71 110.979 172.255 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.9 t 66.25 141.08 0.03 OUTLIER 'General case' 0 C--O 1.25 1.125 0 C-N-CA 125.745 1.618 . . . . 2.96 113.361 -175.309 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.4 tttp -127.59 117.5 22.15 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.133 1.373 . . . . 4.5599999999999996 110.608 -154.556 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 97.45 -17.27 0.06 Allowed 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 130.419 3.488 . . . . 4.1299999999999999 110.513 -163.27 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 47.3 p -109.74 156.63 20.06 Favored 'General case' 0 C--O 1.245 0.86 0 C-N-CA 125.939 1.695 . . . . 1.28 112.348 176.564 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -109.58 105.42 14.72 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 125.764 1.625 . . . . 2.4199999999999999 109.651 169.85 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.4 t -64.77 159.59 22.03 Favored 'General case' 0 C--N 1.318 -0.763 0 O-C-N 121.955 -0.465 . . . . 2.2999999999999998 111.304 168.749 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.4 ttp85 -45.34 -40.09 7.46 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.56 1.544 . . . . 4.0700000000000003 115.014 -175.305 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 24.6 tptp -52.7 -57.92 8.54 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 119.203 -2.186 . . . . 5.0800000000000001 115.217 163.791 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -61.76 -41.33 97.54 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.558 1.543 . . . . 1.8300000000000001 109.715 -167.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.37 -43.03 95.79 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.717 1.207 . . . . 2.54 111.668 177.443 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -63.57 -44.33 94.42 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.539 -1.351 . . . . 4.9400000000000004 111.61 176.989 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -59.17 -44.5 92.15 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.668 0.787 . . . . 4.3899999999999997 112.504 176.352 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.3 tt -58.16 -54.31 48.44 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.226 1.41 . . . . 1.8400000000000001 111.324 176.566 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 27.6 mt -58.78 -46.17 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 119.0 0.818 . . . . 1.21 109.87 -175.45 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -72.93 -3.33 25.16 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.987 1.106 . . . . 4.0300000000000002 113.987 -174.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 56.6 mmtt -99.22 -49.89 4.32 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.346 1.858 . . . . 3.1800000000000002 111.534 168.392 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.505 ' HA ' HG21 ' B' ' 3' ' ' THR . 1.1 mp0 -75.04 -48.44 23.99 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.162 0.985 . . . . 5.4500000000000002 112.244 -173.89 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -89.59 -48.46 7.28 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.966 1.306 . . . . 2.8100000000000001 110.202 176.329 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 9.7 t 75.66 -40.59 0.42 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 128.1 2.56 . . . . 4.4500000000000002 113.673 -175.314 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -38.97 135.19 0.92 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.183 1.793 . . . . 5.3099999999999996 114.598 -169.71 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -81.85 -23.04 58.54 Favored Glycine 0 N--CA 1.477 1.384 0 C-N-CA 125.273 1.416 . . . . 4.54 111.514 169.432 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -57.04 -16.65 7.64 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 127.923 2.489 . . . . 6.1200000000000001 112.563 169.041 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 9.9 tpt -66.57 -28.04 68.21 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.642 1.577 . . . . 4.96 113.377 169.683 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.42 109.51 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 130.078 3.351 . . . . 8.3499999999999996 112.382 -171.139 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -50.04 -52.32 35.28 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.985 1.714 . . . . 5.3099999999999996 114.147 -170.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.9 t -73.11 -15.35 61.48 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 120.098 -1.626 . . . . 3.46 114.005 177.643 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 20.1 t -75.5 -10.48 59.49 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.661 1.118 . . . . 3.27 112.393 169.391 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 82.2 mt -70.92 -29.49 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-N 119.103 0.865 . . . . 1.4099999999999999 111.278 172.795 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.25 -32.51 70.06 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 118.775 0.716 . . . . 3.2000000000000002 111.38 174.537 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -81.38 -40.07 24.05 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.862 1.265 . . . . 2.6099999999999999 112.862 176.366 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.4 tt -66.26 -42.57 88.3 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 117.767 -1.111 . . . . 2.0099999999999998 111.503 176.493 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ppp? -65.04 -40.42 94.77 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.592 1.087 . . . . 2.04 110.084 177.013 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.48 -38.97 82.21 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.068 0.947 . . . . 3.52 112.375 172.173 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.3 t -57.98 -27.09 63.15 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.773 1.17 . . . . 2.4100000000000001 113.963 176.139 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 12.5 mt -74.27 -24.84 59.33 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.339 -0.85 . . . . 2.0 112.372 178.584 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -102.31 115.64 30.98 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.58 1.552 . . . . 2.3700000000000001 111.685 -154.702 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -81.5 -14.04 57.42 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.133 1.16 . . . . 3.8900000000000001 114.133 -169.585 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 36.9 p-10 -124.49 -10.56 7.4 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.519 1.528 . . . . 1.95 113.963 -178.097 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.3 m 58.57 42.27 21.01 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.516 1.527 . . . . 3.2000000000000002 111.861 -173.577 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.4 p30 -72.98 -29.24 62.9 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.073 1.749 . . . . 2.3599999999999999 111.347 -175.896 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 114.76 -6.2 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.456 1 C-N-CA 135.225 5.41 . . . . 4.4000000000000004 113.431 175.795 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -132.54 129.36 38.96 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.021 1.728 . . . . 4.1299999999999999 110.812 -168.506 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 10.6 mm -92.46 99.9 10.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 126.076 1.75 . . . . 1.0700000000000001 108.979 -173.02 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.92 161.91 6.07 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.727 2.011 . . . . 3.1600000000000001 111.467 165.624 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.404 ' CE1' ' HB3' ' B' ' 80' ' ' CYS . 0.3 OUTLIER -55.78 -43.0 76.35 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.658 -1.276 . . . . 2.2599999999999998 113.318 -177.537 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.558 ' HE2' ' SD ' ' B' ' 81' ' ' MET . 3.4 mtmt -73.3 -19.23 61.09 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 120.502 -1.374 . . . . 3.1000000000000001 112.964 176.415 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -69.25 -56.46 7.51 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 107.85 -1.167 . . . . 2.1000000000000001 107.85 166.074 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -58.03 -28.94 64.93 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 127.915 2.486 . . . . 2.1099999999999999 114.844 -177.976 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 53.1 m -53.04 -30.15 33.97 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 120.456 -1.402 . . . . 1.6799999999999999 113.048 168.122 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 97.8 t -65.58 -31.89 55.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 CA-C-N 120.251 1.387 . . . . 2.04 111.559 179.094 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -67.28 -51.56 51.4 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.122 0.969 . . . . 1.8300000000000001 109.473 176.396 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 59.9 mt -57.62 -37.1 72.7 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.859 1.264 . . . . 1.6200000000000001 111.647 174.253 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 28.0 m -66.48 -48.83 68.62 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.758 0.823 . . . . 0.87 111.023 176.082 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 19.4 ttp -62.93 -47.08 84.78 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.969 0.907 . . . . 2.4900000000000002 111.656 -177.038 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 97.4 mt -65.73 -43.41 89.13 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.318 0.647 . . . . 1.3200000000000001 112.203 177.385 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 7.7 t -65.21 -32.83 74.7 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 119.689 1.131 . . . . 1.8700000000000001 112.691 177.158 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 27.5 mtp -68.18 -34.62 76.63 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 118.689 -0.672 . . . . 1.78 112.546 170.864 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.63 -40.65 88.85 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.627 1.103 . . . . 0.94999999999999996 112.42 173.244 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -61.78 -24.6 66.94 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 113.56 0.948 . . . . 2.0099999999999998 113.56 172.002 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -72.95 -41.21 64.68 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.537 1.062 . . . . 2.0899999999999999 112.682 172.3 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -66.66 -37.57 85.07 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 118.569 0.622 . . . . 2.79 111.084 179.23 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.96 -55.43 23.55 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.968 1.307 . . . . 2.23 111.322 167.8 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -58.02 -26.73 62.8 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.263 1.425 . . . . 2.3500000000000001 113.127 -176.898 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 76.0 mt -75.64 -20.56 58.42 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.625 1.17 . . . . 1.51 113.657 175.454 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -91.52 -37.14 13.32 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.967 0.907 . . . . 3.52 113.359 169.067 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 . . . . . 0 CA--C 1.541 0.607 0 C-N-CA 125.278 1.431 . . . . 3.5099999999999998 114.197 -175.845 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . 0.505 HG21 ' HA ' ' A' ' 41' ' ' GLU . 72.4 p . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 111.999 0.37 . . . . 2.29 111.999 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -71.69 -17.18 29.77 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 121.944 1.762 . . . . 1.4399999999999999 113.371 -178.43 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tt -65.02 -39.04 92.81 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.402 1.001 . . . . 3.1099999999999999 111.57 176.081 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -60.24 -42.73 95.87 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.694 0.759 . . . . 4.9199999999999999 111.424 174.178 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -67.15 -29.88 69.71 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.065 -1.022 . . . . 4.4000000000000004 112.626 175.631 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.33 -42.99 82.67 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.734 1.214 . . . . 0.81999999999999995 110.744 171.837 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.83 -38.45 90.8 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.267 -0.895 . . . . 1.4399999999999999 112.026 173.92 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.15 -43.46 95.72 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.075 -1.016 . . . . 1.3100000000000001 111.286 171.187 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 93.8 m -57.62 -38.78 75.55 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.783 1.233 . . . . 1.23 111.425 -178.702 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -59.75 -38.83 82.86 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.758 1.022 . . . . 3.7200000000000002 113.758 172.87 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 21.1 t -69.88 -31.81 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 CA-C-N 119.627 1.103 . . . . 2.23 111.259 175.559 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 44.6 m -77.85 -30.28 50.9 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 126.947 2.099 . . . . 1.29 113.327 -174.807 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 12.7 p -78.13 -29.58 48.92 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.164 0.893 . . . . 1.6699999999999999 110.612 162.502 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.77 -57.29 13.3 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 118.261 0.482 . . . . 2.0600000000000001 110.59 -175.872 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 14.0 m80 -68.7 -8.62 44.3 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.673 1.36 . . . . 2.25 114.673 174.986 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -75.42 -49.97 17.28 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 120.903 -1.123 . . . . 4.1900000000000004 111.332 169.55 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -93.77 -23.99 17.97 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.185 0.994 . . . . 2.0 113.67 -174.104 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 97.6 p -65.59 -11.65 46.13 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 115.865 1.802 . . . . 2.8799999999999999 115.865 -175.578 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.79 -0.2 83.98 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-O 117.457 -1.746 . . . . 2.7999999999999998 114.344 171.769 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -62.43 -31.36 72.05 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 120.496 2.148 . . . . 3.3300000000000001 112.66 178.733 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -177.51 -148.84 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 128.71 2.804 . . . . 3.2200000000000002 108.939 165.385 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 26.29 87.43 0.01 OUTLIER Glycine 0 N--CA 1.477 1.376 0 C-N-CA 128.459 2.933 . . . . 4.3499999999999996 113.551 167.464 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 6.0 m 43.58 150.17 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 129.331 3.052 . . . . 3.4399999999999999 117.104 -172.001 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 71.8 tttt -80.32 -12.38 59.61 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 119.503 -1.998 . . . . 6.9299999999999997 113.579 179.53 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 62.7 tp -71.85 -54.56 9.71 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 119.265 0.939 . . . . 3.2200000000000002 109.828 164.058 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 35.8 p -93.94 162.43 13.9 Favored 'General case' 0 C--O 1.254 1.301 0 C-N-CA 125.503 1.521 . . . . 1.3200000000000001 114.832 -159.059 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 24.6 mt -105.87 86.59 2.41 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.422 2.289 . . . . 1.76 111.024 173.401 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 7.9 t -71.72 -178.41 2.25 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 119.768 -1.832 . . . . 2.9300000000000002 112.288 170.353 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -41.06 -60.2 1.28 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.634 1.574 . . . . 4.6900000000000004 114.758 -163.794 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.69 -32.7 58.06 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 120.12 1.327 . . . . 4.46 112.147 -174.398 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -52.5 -52.2 55.65 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.558 1.543 . . . . 1.8600000000000001 111.539 172.458 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.65 -48.21 80.32 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.919 1.288 . . . . 2.3999999999999999 111.748 -178.663 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -57.25 -46.14 83.3 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 121.018 -1.051 . . . . 4.5300000000000002 112.892 177.842 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -57.41 -47.57 81.38 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 118.074 -0.965 . . . . 3.0699999999999998 113.03 175.287 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.47 -53.09 40.86 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.619 1.168 . . . . 1.79 111.654 175.227 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 38.6 mt -55.78 -52.49 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 CA-C-N 118.949 0.795 . . . . 1.0700000000000001 109.18 177.581 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -66.94 -10.57 50.49 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 114.043 1.127 . . . . 4.8399999999999999 114.043 -174.917 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 34.6 mmtm -95.68 -39.22 10.0 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.584 1.954 . . . . 3.7200000000000002 113.392 176.649 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . 0.455 ' HA ' HG21 ' A' ' 3' ' ' THR . 20.7 mt-10 -118.71 -35.2 3.76 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 118.163 -0.922 . . . . 5.5099999999999998 113.066 -166.34 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -109.19 57.76 0.61 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.528 1.931 . . . . 2.6000000000000001 108.975 171.243 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 76.8 m -54.59 -56.46 18.7 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.061 -0.971 . . . . 4.1299999999999999 113.523 -167.169 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 95.7 mt 59.09 -23.89 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 129.256 3.023 . . . . 4.9199999999999999 118.973 164.437 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.44 -55.92 4.67 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 125.679 1.609 . . . . 3.8500000000000001 112.28 177.914 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -66.83 1.04 2.04 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.989 1.107 . . . . 5.6799999999999997 113.989 171.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.08 57.02 1.72 Allowed 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 125.008 2.337 . . . . 2.46 112.593 172.248 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -87.39 162.62 17.22 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 129.997 3.319 . . . . 4.1900000000000004 110.652 174.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -56.94 -36.46 70.27 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 120.761 -1.212 . . . . 4.0999999999999996 113.5 -173.389 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 7.0 m -72.08 -5.56 36.14 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 116.245 1.943 . . . . 2.9700000000000002 116.245 175.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 62.0 p -107.8 -39.69 5.49 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 120.426 1.466 . . . . 2.0299999999999998 111.516 165.982 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 11.8 mm -56.88 -49.3 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 126.678 1.991 . . . . 1.5600000000000001 113.245 176.759 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -76.31 -22.96 54.35 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.282 0.845 . . . . 3.1800000000000002 113.282 -166.891 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -77.77 -39.66 43.38 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.124 0.569 . . . . 3.7999999999999998 111.494 167.285 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.92 -42.83 90.63 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 122.994 0.518 . . . . 2.3900000000000001 110.537 174.707 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 7.2 tpt -57.77 -53.01 63.06 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.76 2.424 . . . . 1.97 112.137 169.171 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -54.76 -43.81 73.08 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 120.675 -1.266 . . . . 4.7699999999999996 112.646 174.444 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 73.4 m -82.46 -24.63 34.17 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.923 1.289 . . . . 2.1200000000000001 112.35 -171.067 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 mt -60.77 -57.79 11.21 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 126.445 1.898 . . . . 2.7000000000000002 110.942 157.192 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -89.92 65.75 6.73 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.645 1.578 . . . . 1.53 111.508 -168.721 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . 0.465 ' HE2' HG21 ' B' ' 74' ' ' VAL . 55.7 mttm -58.08 -31.91 67.54 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 115.177 1.547 . . . . 3.1499999999999999 115.177 -160.772 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -88.86 -5.49 57.99 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.288 1.218 . . . . 2.04 114.288 176.394 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 11.2 t 61.22 25.64 15.6 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.544 1.938 . . . . 2.29 114.065 178.838 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 55.7 p-10 -72.48 -16.15 61.8 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.838 1.255 . . . . 2.98 111.572 178.675 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 63.97 7.53 3.39 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 130.904 3.682 . . . . 4.4900000000000002 114.815 -177.485 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -89.92 127.73 36.07 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 107.053 -1.462 . . . . 3.0600000000000001 107.053 158.454 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 97.5 mt -111.81 110.35 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 N-CA-C 108.8 -0.815 . . . . 1.3300000000000001 108.8 169.68 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -87.58 164.31 16.16 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 128.577 2.751 . . . . 4.1799999999999997 110.54 166.514 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -43.73 -38.81 3.36 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.704 1.601 . . . . 2.4700000000000002 114.746 171.076 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 tpmt? -65.91 -28.42 68.92 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.04 0.936 . . . . 6.1600000000000001 112.938 179.834 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -85.27 -53.13 5.43 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.83 1.252 . . . . 2.02 109.858 167.517 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -47.63 -38.26 14.34 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 126.802 2.041 . . . . 2.5 114.603 -175.487 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 1.1 t -62.27 -17.13 57.7 Favored 'General case' 0 CA--C 1.549 0.904 0 O-C-N 120.342 -1.474 . . . . 3.1499999999999999 114.345 176.824 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.465 HG21 ' HE2' ' B' ' 61' ' ' LYS . 76.0 t -59.33 -45.1 93.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 O-C-N 120.269 -1.519 . . . . 1.5 110.991 169.75 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -60.29 -51.45 69.49 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.551 0.74 . . . . 1.71 110.249 175.893 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 31.9 mt -55.96 -39.28 71.52 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.745 0.818 . . . . 1.3700000000000001 112.383 176.576 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 95.0 m -60.61 -53.53 56.37 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.759 1.223 . . . . 0.89000000000000001 111.87 176.715 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 33.1 mtm -63.78 -36.33 83.52 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 118.727 0.694 . . . . 1.73 112.399 -177.134 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 82.1 mt -67.77 -45.82 73.81 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.91 0.884 . . . . 1.4199999999999999 111.947 176.814 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . 0.404 ' HB3' ' CE1' ' A' ' 69' ' ' PHE . 61.7 m -59.79 -37.63 79.67 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 118.083 -0.96 . . . . 1.5 112.719 173.744 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . 0.558 ' SD ' ' HE2' ' A' ' 70' ' ' LYS . 21.9 mtp -66.44 -36.25 82.33 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.476 1.034 . . . . 2.5299999999999998 113.204 174.817 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.04 -47.65 73.67 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.856 0.753 . . . . 1.02 111.635 173.999 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -65.01 -30.46 71.44 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.429 0.9 . . . . 2.8100000000000001 113.429 176.354 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -61.84 -52.59 63.54 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 118.983 0.811 . . . . 3.0899999999999999 112.268 174.322 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -61.74 -47.22 86.21 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.229 1.411 . . . . 3.0 111.935 -179.774 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.27 -46.97 69.49 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.517 1.527 . . . . 3.4399999999999999 111.717 177.346 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -61.57 -29.93 70.33 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.347 1.059 . . . . 2.79 112.931 178.133 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 68.4 mt -77.19 -11.88 59.88 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.043 0.937 . . . . 2.3199999999999998 113.24 179.657 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . 0.454 ' O ' ' HE2' ' B' ' 92' ' ' LYS . 24.4 mm-40 -106.13 0.84 25.75 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.54 1.536 . . . . 5.1500000000000004 114.72 170.992 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -110.64 -50.91 2.91 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.235 1.814 . . . . 2.9700000000000002 112.46 -178.406 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -90.38 14.74 12.1 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 125.358 1.463 . . . . 3.8999999999999999 113.623 -177.136 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . 0.454 ' HE2' ' O ' ' B' ' 89' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 115.814 -2.041 . . . . 5.0 115.974 -177.246 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.239 0.525 0 N-CA-C 109.332 -0.618 . . . . 5.9400000000000004 109.332 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.765 HG23 ' H ' ' A' ' 6' ' ' GLU . 3.5 t -55.58 146.91 42.39 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.425 1.49 . . . . 2.2999999999999998 112.751 178.465 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -62.35 -14.75 40.65 Favored 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 122.084 1.856 . . . . 1.72 112.69 169.345 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.401 HD12 HG21 ' B' ' 15' ' ' THR . 1.1 tt -76.99 -34.64 57.52 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.387 0.994 . . . . 2.3500000000000001 111.705 173.313 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.765 ' H ' HG23 ' A' ' 3' ' ' THR . 2.8 tm-20 -59.77 -47.08 87.13 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.618 1.099 . . . . 4.7999999999999998 108.835 166.375 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.42 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -59.03 -27.26 65.3 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.916 -1.115 . . . . 4.0099999999999998 112.685 175.176 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -75.1 -48.56 23.21 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.798 1.239 . . . . 1.1299999999999999 112.589 172.992 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.4 mt -57.99 -42.67 85.62 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.693 1.133 . . . . 1.6200000000000001 111.538 172.479 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 8.2 m -57.36 -51.54 69.0 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.346 1.858 . . . . 1.8600000000000001 111.137 170.555 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.7 m -58.78 -44.22 90.64 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.272 1.396 . . . . 1.51 111.731 178.112 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 5.8 tmm? -55.95 -58.82 6.29 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.615 0.766 . . . . 3.6800000000000002 110.538 172.609 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.1 p -66.78 -26.6 37.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 CA-C-N 119.769 1.168 . . . . 2.1699999999999999 112.931 -177.75 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 98.7 m -60.86 -61.27 2.7 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.399 1.079 . . . . 0.89000000000000001 109.71 175.878 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.78 -31.87 65.19 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-O 118.383 -0.817 . . . . 2.9199999999999999 109.954 -173.746 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -65.11 -50.43 66.12 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.115 0.87 . . . . 2.27 112.547 171.854 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -68.28 -19.69 64.72 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.061 0.846 . . . . 1.98 111.887 -178.05 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.8 mtpp -68.93 -53.47 20.73 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 120.822 -1.174 . . . . 3.5499999999999998 111.928 163.48 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -73.53 -32.75 64.38 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.689 1.366 . . . . 2.5 114.689 -175.981 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.5 p -67.41 -22.37 65.54 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 121.298 1.863 . . . . 2.4100000000000001 112.439 172.736 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.53 -2.68 82.05 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.169 1.366 . . . . 1.7 114.959 171.425 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.415 ' HE ' ' CD ' ' A' ' 36' ' ' GLU . 49.6 tpt85 -64.0 -19.17 64.98 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.53 1.665 . . . . 4.3499999999999996 114.943 -172.222 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -155.68 -178.71 7.48 Favored 'General case' 0 C--O 1.247 0.938 0 C-N-CA 129.701 3.2 . . . . 3.8100000000000001 107.808 165.673 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 24.96 99.41 0.01 OUTLIER Glycine 0 C--N 1.346 1.133 0 C-N-CA 126.946 2.212 . . . . 2.8500000000000001 114.651 149.364 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t 60.28 136.78 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.822 1.649 . . . . 2.71 112.819 -176.931 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -80.5 -9.72 59.76 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.933 1.086 . . . . 5.1500000000000004 113.933 171.244 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 73.9 mt -79.91 -40.0 29.17 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 118.986 0.812 . . . . 3.77 110.597 174.523 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.7 p -121.94 150.18 42.37 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-O 122.877 1.322 . . . . 1.4299999999999999 112.545 -161.645 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.51 120.85 43.05 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 114.041 -1.436 . . . . 2.6299999999999999 111.706 176.888 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.5 p -68.85 169.43 11.5 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.911 1.285 . . . . 2.9199999999999999 113.202 167.636 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 46.2 ttt85 -50.35 -26.77 5.27 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 115.549 1.685 . . . . 4.3799999999999999 115.549 176.656 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.86 -28.71 14.59 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.575 1.324 . . . . 4.3499999999999996 114.575 174.455 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -58.37 -52.44 65.59 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.563 1.074 . . . . 1.6100000000000001 109.021 163.615 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.9 tt -57.01 -45.89 82.73 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 128.142 2.577 . . . . 3.8500000000000001 112.168 175.573 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.3 ttmt -70.38 -38.19 74.67 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 118.692 0.678 . . . . 3.79 111.63 -178.871 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.415 ' CD ' ' HE ' ' A' ' 22' ' ' ARG . 25.2 tt0 -60.1 -47.63 85.09 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 118.265 -0.874 . . . . 4.7800000000000002 111.729 169.097 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 tt -56.17 -59.87 4.31 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.46 1.104 . . . . 2.4399999999999999 110.652 179.289 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.7 mt -63.63 -54.37 33.15 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.523 0 CA-C-O 118.626 -0.702 . . . . 1.55 109.408 -177.843 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.1 ttpp -72.0 -8.24 53.4 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 120.978 1.717 . . . . 4.1900000000000004 114.097 -172.691 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -90.77 -54.28 4.04 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 120.288 1.404 . . . . 4.5599999999999996 112.874 165.365 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -71.91 -33.24 68.14 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.82 1.191 . . . . 5.1100000000000003 111.511 -177.362 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.4 mt -111.53 65.32 0.62 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.81 1.644 . . . . 2.8100000000000001 109.42 163.401 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 15.2 t -75.33 36.12 0.12 Allowed 'General case' 0 CA--C 1.55 0.975 0 O-C-N 120.68 -1.263 . . . . 4.5700000000000003 112.798 172.619 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 31.3 mt -96.23 169.88 9.63 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.488 1.515 . . . . 4.8600000000000003 111.466 -175.398 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.43 -25.44 74.8 Favored Glycine 0 N--CA 1.475 1.278 0 C-N-CA 123.929 0.776 . . . . 3.73 112.502 -179.481 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -59.09 -34.51 72.08 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.752 2.021 . . . . 5.2999999999999998 111.402 173.58 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.53 66.34 2.77 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 124.511 2.101 . . . . 2.6499999999999999 112.878 -172.376 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 ptpp? -72.78 161.95 30.09 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 112.315 -2.22 . . . . 4.6100000000000003 110.692 156.39 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -49.38 -44.91 45.32 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 118.916 0.78 . . . . 5.4000000000000004 112.518 -179.253 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.2 m -61.33 -19.31 61.66 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.797 1.406 . . . . 3.04 114.797 178.558 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.8 m -83.85 -27.18 28.89 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.555 1.071 . . . . 2.6400000000000001 112.675 170.219 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 88.4 mt -80.91 -32.94 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 126.195 1.798 . . . . 2.1099999999999999 111.113 -178.88 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -61.93 -55.84 25.4 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.555 1.142 . . . . 3.8100000000000001 112.028 176.875 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -66.67 -26.16 66.91 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.764 0.653 . . . . 3.3599999999999999 112.764 177.163 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.1 tt -69.95 -38.92 76.28 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.354 -0.841 . . . . 2.9399999999999999 110.657 172.261 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.4 ttt -59.72 -49.59 77.14 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-O 117.85 -1.071 . . . . 2.3799999999999999 111.83 165.515 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -66.08 -22.97 66.43 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 121.171 1.805 . . . . 5.1900000000000004 113.124 179.041 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 29.0 t -81.15 -38.9 26.41 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.035 1.334 . . . . 2.23 112.043 176.545 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 84.3 mt -81.8 -44.98 16.23 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 119.065 0.848 . . . . 1.8100000000000001 112.153 175.593 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -77.51 63.72 2.71 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.96 1.304 . . . . 2.73 111.327 -177.379 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -58.73 -22.31 57.33 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 125.813 1.645 . . . . 4.5800000000000001 113.936 -172.923 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -106.87 0.83 24.22 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 114.703 1.371 . . . . 2.4100000000000001 114.703 173.569 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.5 t 62.0 27.61 16.73 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.868 1.432 . . . . 3.2799999999999998 114.868 169.201 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.3 p-10 -86.69 2.6 48.01 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.171 1.788 . . . . 2.2400000000000002 111.914 -174.742 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.69 1.34 3.96 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 129.813 3.245 . . . . 4.3399999999999999 113.565 -173.802 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -119.59 131.99 55.62 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 123.691 1.71 . . . . 3.25 111.251 -179.392 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 3.6 mp -110.01 106.55 20.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 N-CA-C 107.653 -1.24 . . . . 2.3199999999999998 107.653 171.536 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -79.75 166.06 22.16 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.404 1.481 . . . . 3.4500000000000002 110.923 168.471 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -45.29 -38.26 5.49 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.556 1.142 . . . . 2.1499999999999999 112.817 171.77 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.87 -26.98 68.56 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 115.287 1.588 . . . . 5.29 115.287 177.012 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -90.74 -47.06 7.86 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.488 1.915 . . . . 2.5600000000000001 109.414 170.789 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -57.97 -34.35 69.86 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 126.825 2.05 . . . . 2.5600000000000001 114.399 -173.84 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.6 t -59.21 -18.74 39.43 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.878 1.217 . . . . 1.8799999999999999 112.884 -178.163 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 84.9 t -65.49 -25.35 36.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.804 0.841 . . . . 2.0099999999999998 112.024 172.135 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -63.21 -52.66 61.35 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.071 1.348 . . . . 2.6200000000000001 110.226 173.093 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.1 mt -58.28 -39.7 79.94 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.423 1.089 . . . . 2.2200000000000002 110.06 177.34 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.6 m -62.82 -52.44 63.14 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 117.707 -1.14 . . . . 1.2 112.045 174.254 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 70.2 mtm -55.66 -45.43 77.71 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.876 1.216 . . . . 1.97 111.754 -179.553 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 47.4 mt -76.68 -40.57 48.44 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.806 0.842 . . . . 1.49 112.444 -177.098 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 42.4 t -62.54 -36.66 83.33 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.53 1.059 . . . . 2.04 111.943 171.469 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 83.2 mtp -64.27 -39.46 93.98 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.223 0.92 . . . . 2.1000000000000001 112.149 170.408 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.11 -45.98 82.9 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 119.293 0.951 . . . . 1.0600000000000001 112.164 177.351 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -64.52 -36.12 83.18 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.248 0.833 . . . . 2.48 113.248 175.136 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.83 -46.33 89.94 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.016 0.825 . . . . 2.4900000000000002 112.079 174.542 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -67.33 -37.32 83.12 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.953 -0.467 . . . . 2.8500000000000001 111.163 -177.943 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.93 -54.98 26.96 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.027 1.331 . . . . 2.04 111.053 169.727 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -60.84 -30.66 70.24 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.318 1.047 . . . . 2.3999999999999999 112.612 -175.852 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 69.6 mt -74.56 -15.36 60.85 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.042 0.937 . . . . 2.0800000000000001 113.243 176.052 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -97.8 -23.99 15.64 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.295 1.221 . . . . 3.29 114.295 167.633 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 . . . . . 0 CA--C 1.542 0.649 0 C-N-CA 125.446 1.499 . . . . 4.0099999999999998 113.79 179.966 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.617 0 CA-C-O 118.508 -0.758 . . . . 3.0699999999999998 111.559 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -69.39 -31.59 21.85 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.489 2.126 . . . . 2.8799999999999999 115.237 -156.337 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 8.5 tt -68.67 -54.38 16.61 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 120.351 1.432 . . . . 3.9399999999999999 111.378 171.856 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -57.66 -43.6 85.08 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.718 0.807 . . . . 6.1799999999999997 111.241 -178.545 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.36 -38.03 40.2 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 125.449 1.5 . . . . 4.3300000000000001 112.926 175.371 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.08 -43.58 61.64 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.604 0.761 . . . . 1.1899999999999999 110.409 179.981 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 73.2 mt -60.54 -36.39 78.34 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 123.513 0.725 . . . . 2.0499999999999998 112.088 174.051 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.4 m -55.19 -45.31 75.82 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 118.61 0.641 . . . . 1.48 112.074 170.338 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.4 t -72.35 -29.82 64.16 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.084 -0.96 . . . . 2.04 112.612 179.352 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 43.3 mtp -61.32 -51.61 68.12 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 118.151 -0.928 . . . . 3.0699999999999998 111.529 176.02 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 26.3 m -62.65 -33.28 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 CA-C-N 119.037 0.835 . . . . 2.52 112.15 176.592 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 54.0 m -67.93 -37.94 82.24 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.19 1.396 . . . . 1.03 113.049 -178.224 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . 0.401 HG21 HD12 ' A' ' 5' ' ' LEU . 0.8 OUTLIER -70.59 -38.35 74.0 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 118.798 0.726 . . . . 1.6200000000000001 111.277 165.408 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -65.88 -49.68 67.21 Favored 'General case' 0 N--CA 1.462 0.139 0 O-C-N 123.929 0.768 . . . . 2.0600000000000001 111.439 -167.422 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -64.73 -23.49 67.27 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.903 0.774 . . . . 3.71 112.44 -179.095 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -78.81 -52.04 8.91 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.659 -0.651 . . . . 4.6200000000000001 111.45 178.187 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -66.86 -43.0 84.74 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.069 -1.019 . . . . 2.1200000000000001 112.137 178.181 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 83.8 p -74.9 -16.7 60.65 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.137 1.162 . . . . 1.4099999999999999 114.137 176.491 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.65 -23.56 49.74 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-O 117.683 -1.621 . . . . 1.54 113.748 170.881 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.92 -19.18 60.77 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 119.939 1.87 . . . . 4.6100000000000003 114.037 -165.442 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -124.49 122.67 38.26 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 119.096 0.862 . . . . 3.77 108.875 169.805 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.11 -1.23 2.87 Favored Glycine 0 N--CA 1.477 1.428 0 C-N-CA 127.968 2.699 . . . . 3.1899999999999999 117.793 -144.718 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 52.8 p -56.66 75.74 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.973 0 CA-C-O 121.463 0.649 . . . . 5.5999999999999996 109.885 141.986 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -75.87 118.98 19.23 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 119.657 -1.902 . . . . 6.2999999999999998 111.208 -173.0 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 86.3 mt 96.37 -8.2 0.08 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 130.376 3.47 . . . . 4.5800000000000001 112.751 -179.361 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 45.2 p -108.19 144.09 36.1 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 124.904 1.282 . . . . 1.8899999999999999 111.635 168.047 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 29.1 mt -97.73 114.21 26.16 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.388 1.875 . . . . 1.72 112.527 177.361 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 20.3 p -68.86 167.86 14.72 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.533 1.533 . . . . 3.5600000000000001 113.798 165.292 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -58.58 -0.62 0.11 Allowed 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 115.958 1.836 . . . . 4.0899999999999999 115.958 172.554 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.0 -44.79 3.24 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.577 1.551 . . . . 3.8700000000000001 112.819 169.693 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -54.08 -44.97 71.63 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.478 1.036 . . . . 1.9299999999999999 109.538 171.819 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 56.1 tp -67.6 -44.08 78.95 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.599 1.559 . . . . 2.4100000000000001 112.448 179.449 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -55.39 -43.7 75.44 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.856 -0.592 . . . . 3.3300000000000001 111.147 172.537 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -60.73 -52.92 63.07 Favored 'General case' 0 C--O 1.224 -0.279 0 O-C-N 123.824 0.702 . . . . 2.8399999999999999 110.761 178.085 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.6 tt -59.14 -58.89 6.65 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.668 1.187 . . . . 2.1600000000000001 110.565 -178.534 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 25.7 mt -54.56 -46.47 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 119.304 0.956 . . . . 1.05 110.073 179.159 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -74.32 -17.91 60.78 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 115.111 1.522 . . . . 6.1500000000000004 115.111 -177.354 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -93.15 -14.32 27.34 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.358 1.863 . . . . 3.4199999999999999 112.66 171.811 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -96.54 -37.09 10.53 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.13 1.772 . . . . 5.21 111.537 176.497 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -127.33 120.86 29.52 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.637 1.575 . . . . 2.04 109.446 174.152 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 4.7 t -131.58 -9.42 3.62 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 115.255 1.576 . . . . 3.4500000000000002 115.255 174.088 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -47.46 -16.19 0.06 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 128.654 2.782 . . . . 3.5499999999999998 118.432 175.878 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.88 169.05 12.62 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-N 120.106 1.321 . . . . 3.5699999999999998 114.711 178.295 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 26.0 tp10 62.98 -22.19 0.05 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 129.775 3.23 . . . . 5.5300000000000002 117.203 172.776 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 32.9 tpp -75.74 82.11 2.7 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.459 -1.401 . . . . 2.4700000000000002 111.332 -179.621 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 41.9 mttt -89.45 173.98 8.04 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.668 2.387 . . . . 3.7599999999999998 110.771 179.753 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 44.8 tp10 -48.79 -52.72 22.44 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.856 0.862 . . . . 3.8700000000000001 111.202 171.574 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 2.8 m -64.67 -27.61 69.04 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.372 1.249 . . . . 3.1699999999999999 114.372 177.417 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 3.8 m -74.0 -31.72 63.07 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.399 -0.813 . . . . 2.9399999999999999 111.479 176.828 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 28.9 mm -68.72 -38.47 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.66 0.784 . . . . 1.46 111.11 171.575 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -70.55 -43.68 69.03 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.654 0.983 . . . . 3.3599999999999999 113.654 -167.542 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.99 -27.43 26.45 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 113.474 0.916 . . . . 3.7799999999999998 113.474 175.748 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 60.6 tp -56.22 -48.42 76.49 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 118.661 -0.685 . . . . 2.0 110.199 167.82 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.9 ppp? -62.03 -32.17 72.64 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.605 1.093 . . . . 2.79 113.681 -177.154 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 44.9 mttp -65.59 -25.25 67.32 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.041 0.837 . . . . 5.8499999999999996 112.685 174.494 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.1 t -92.17 -32.29 15.15 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.928 1.291 . . . . 1.96 113.896 177.007 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 69.3 mt -74.43 -25.44 59.45 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.947 0.899 . . . . 2.1699999999999999 112.81 175.143 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -80.81 121.5 26.02 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 122.457 1.122 . . . . 1.3799999999999999 111.013 174.32 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -85.57 -13.77 47.83 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.059 1.133 . . . . 5.8799999999999999 114.059 -156.533 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 45.5 p-10 -141.95 -6.46 0.97 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.385 2.274 . . . . 2.52 115.324 -169.566 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 68.73 43.59 1.26 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.927 1.291 . . . . 2.27 113.098 -175.086 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 40.0 p30 -87.96 -16.86 32.62 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.941 1.297 . . . . 2.1899999999999999 112.004 165.027 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 70.47 14.78 7.33 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 130.258 3.423 . . . . 6.6900000000000004 114.819 179.099 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -124.26 143.79 50.34 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.362 1.065 . . . . 3.6099999999999999 110.665 161.36 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 6.3 mm -97.34 105.38 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 O-C-N 121.33 -0.856 . . . . 1.4299999999999999 110.143 179.135 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.02 155.69 39.93 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.998 1.319 . . . . 2.8999999999999999 111.437 166.355 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -46.44 -47.2 19.1 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.711 1.374 . . . . 3.4399999999999999 114.711 177.224 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . 0.301 0.3 OUTLIER -85.38 -1.15 56.7 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 120.329 -1.482 . . . . 4.6500000000000004 114.598 177.688 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -77.03 -53.85 7.29 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 108.866 -0.79 . . . . 2.2400000000000002 108.866 152.15 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -52.82 -29.84 30.0 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 127.579 2.352 . . . . 2.29 115.272 -173.827 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 26.8 t -57.14 -21.63 34.04 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 120.588 -1.32 . . . . 1.74 113.679 170.589 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 87.5 t -66.83 -45.88 86.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 120.109 1.322 . . . . 2.23 110.666 174.991 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . 0.454 ' CZ ' HD11 ' B' ' 79' ' ' LEU . 30.1 t80 -56.38 -46.39 80.12 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.146 0.978 . . . . 1.7 111.512 172.532 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 33.7 mt -61.19 -41.88 97.59 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.426 -0.797 . . . . 1.79 111.533 178.231 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 93.7 m -56.53 -49.9 73.41 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.307 0.958 . . . . 1.3300000000000001 111.883 171.333 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 76.7 mtp -60.35 -46.4 90.05 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.838 0.744 . . . . 2.2999999999999998 111.922 -177.895 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.454 HD11 ' CZ ' ' B' ' 75' ' ' PHE . 82.3 mt -62.35 -50.67 70.65 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.064 0.546 . . . . 1.98 110.884 175.172 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 88.2 m -59.11 -33.02 70.36 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.151 0.887 . . . . 2.5499999999999998 113.279 179.942 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 63.8 mtt -74.45 -34.67 63.23 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.043 0.937 . . . . 3.9900000000000002 113.468 172.78 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.79 -41.35 71.76 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.737 1.153 . . . . 1.3200000000000001 111.662 176.446 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -57.52 -23.22 49.0 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.781 1.232 . . . . 2.8900000000000001 112.636 172.912 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -67.75 -42.72 81.36 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.178 -0.952 . . . . 2.0699999999999998 111.782 173.629 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -80.94 -32.63 34.51 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.291 1.036 . . . . 2.6400000000000001 111.563 -177.816 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -54.91 -37.28 66.16 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.255 1.822 . . . . 2.8900000000000001 111.644 166.56 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -74.27 -16.68 60.94 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.838 1.255 . . . . 2.0800000000000001 113.042 174.946 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 6.7 mp -79.29 -25.94 42.36 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 120.489 -1.382 . . . . 3.0 113.107 168.906 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -62.55 -22.03 66.03 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 113.187 0.81 . . . . 7.3300000000000001 113.187 169.87 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -85.33 -56.6 3.45 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.174 1.79 . . . . 4.1399999999999997 111.285 171.575 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.15 -8.24 29.58 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 115.472 1.656 . . . . 3.6099999999999999 115.472 -173.002 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.971 0 C-N-CA 126.608 1.963 . . . . 5.5899999999999999 115.691 -179.43 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.446 -0.673 0 N-CA-C 103.958 -2.608 . . . . 6.0700000000000003 103.958 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.41 162.71 13.57 Favored Pre-proline 0 N--CA 1.475 0.823 0 O-C-N 121.68 -0.638 . . . . 1.47 110.345 169.376 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.75 -21.22 21.88 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 121.447 1.431 . . . . 1.3300000000000001 111.569 173.731 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -77.08 -43.27 34.95 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.903 1.681 . . . . 3.1899999999999999 112.386 176.442 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -51.05 -49.36 60.72 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.887 0.875 . . . . 3.7400000000000002 109.249 168.015 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -64.44 -38.1 89.84 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 120.889 -1.132 . . . . 3.9100000000000001 113.781 174.952 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.04 -52.19 64.93 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.605 1.093 . . . . 0.96999999999999997 112.306 178.986 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.0 mt -66.64 -31.98 73.01 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.156 0.582 . . . . 2.0600000000000001 111.895 176.873 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.2 m -58.71 -52.05 67.36 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 117.899 -1.048 . . . . 1.6200000000000001 111.378 166.969 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 49.9 m -55.84 -41.27 74.05 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.918 1.235 . . . . 1.24 111.632 179.868 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 75.4 mmm -58.09 -54.43 47.08 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 122.951 0.501 . . . . 3.6800000000000002 111.495 174.521 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.4 t -63.96 -31.97 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 CA-C-N 119.019 0.827 . . . . 2.1699999999999999 112.083 179.03 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.7 m -64.0 -57.67 9.0 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.358 1.463 . . . . 0.75 111.244 -179.395 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 t -67.07 -36.1 81.26 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 118.854 -0.593 . . . . 2.9900000000000002 109.601 178.363 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -56.39 -48.07 77.64 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-O 117.746 -1.121 . . . . 1.8100000000000001 110.935 175.632 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.1 m80 -60.99 -43.65 98.56 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 120.816 1.643 . . . . 2.1800000000000002 112.584 173.283 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -62.69 -23.1 66.96 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.145 1.378 . . . . 4.1699999999999999 114.311 -176.069 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -95.38 -47.73 6.17 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.537 1.062 . . . . 2.7400000000000002 111.191 161.891 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.408 ' HA ' ' OE1' ' A' ' 33' ' ' GLU . 15.7 t -54.38 -39.25 67.03 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.461 1.904 . . . . 1.8500000000000001 115.286 -168.689 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.86 7.37 42.95 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 125.43 1.491 . . . . 2.48 115.472 179.747 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 -118.57 96.66 5.38 Favored 'General case' 0 C--O 1.221 -0.424 0 N-CA-C 106.854 -1.535 . . . . 4.21 106.854 174.994 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 88.26 148.67 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 127.897 2.479 . . . . 3.6499999999999999 111.623 -168.896 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.9 -145.44 49.76 Favored Glycine 0 CA--C 1.526 0.741 0 C-N-CA 124.182 0.896 . . . . 2.6499999999999999 112.168 177.155 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.4 m -88.35 164.53 15.5 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 122.085 -0.656 . . . . 3.0099999999999998 112.466 170.199 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -16.13 63.24 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 114.499 1.296 . . . . 7.9699999999999998 114.499 179.42 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.446 ' H ' HD23 ' A' ' 27' ' ' LEU . 2.5 pt? -117.13 10.95 14.02 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.496 1.919 . . . . 3.46 112.497 179.209 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.2 p -122.53 134.43 54.55 Favored 'General case' 0 C--O 1.249 1.043 0 N-CA-C 114.421 1.267 . . . . 1.0900000000000001 114.421 171.97 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 69.8 mt -95.62 104.27 16.18 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.413 1.085 . . . . 1.7 109.821 167.488 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.0 t -58.71 150.49 23.38 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.421 -0.799 . . . . 1.8500000000000001 109.965 161.284 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 34.3 ttp85 -45.47 -30.31 1.37 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 115.831 1.789 . . . . 3.1299999999999999 115.831 -172.56 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -36.9 38.87 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.029 1.122 . . . . 3.9500000000000002 114.029 176.012 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.408 ' OE1' ' HA ' ' A' ' 20' ' ' SER . 20.1 mt-10 -59.34 -50.63 73.22 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.827 0.851 . . . . 1.54 109.351 169.685 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.3 tp -57.84 -46.61 84.51 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.405 1.082 . . . . 1.8600000000000001 111.902 178.032 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -49.34 -50.88 37.76 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.395 1.078 . . . . 3.9900000000000002 112.92 -178.373 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -89.6 -11.96 41.12 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 115.25 1.574 . . . . 4.54 115.25 -178.678 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.4 tt -63.81 -60.93 2.67 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 120.063 1.301 . . . . 1.96 109.432 160.285 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.3 mt -58.03 -43.18 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 N-CA-C 110.215 -0.291 . . . . 0.95999999999999996 110.215 -175.353 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.8 mtpt -64.25 -12.15 38.37 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 114.15 1.166 . . . . 4.7000000000000002 114.15 -179.492 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -109.15 -24.02 11.35 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.186 1.794 . . . . 4.3899999999999997 112.335 -178.392 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 72.4 mt-10 -65.93 -48.07 72.63 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.793 1.178 . . . . 3.9900000000000002 111.372 163.056 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 77.3 mt -124.68 149.74 46.86 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.629 1.572 . . . . 2.4100000000000001 111.419 -163.516 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 1.7 t -156.01 11.86 0.3 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.149 1.38 . . . . 3.8300000000000001 112.713 179.184 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.97 28.79 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 126.382 1.873 . . . . 3.8700000000000001 116.005 178.034 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.5 -49.86 3.69 Favored Glycine 0 N--CA 1.474 1.201 0 C-N-CA 125.924 1.726 . . . . 2.9100000000000001 115.033 170.17 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.59 -35.3 80.56 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.841 1.257 . . . . 7.6600000000000001 112.7 -177.62 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 45.2 tpp -83.86 68.82 10.1 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 123.053 1.406 . . . . 2.3199999999999998 112.597 -179.025 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -66.14 163.27 17.98 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.227 1.411 . . . . 5.4299999999999997 112.726 174.59 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.59 -46.64 14.43 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.832 0.853 . . . . 4.7599999999999998 111.452 160.768 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.1 t -70.45 -37.71 74.38 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 114.852 1.427 . . . . 2.4100000000000001 114.852 175.077 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.0 m -62.91 -32.53 73.83 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 121.148 1.794 . . . . 1.9299999999999999 111.636 176.871 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.3 mt -63.85 -30.53 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 124.795 1.238 . . . . 1.6799999999999999 113.765 179.917 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -81.08 -24.45 37.77 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.813 1.188 . . . . 3.3900000000000001 112.64 -179.739 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -73.84 -42.15 61.25 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.406 -0.809 . . . . 3.0699999999999998 111.0 168.165 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 43.3 tp -57.75 -45.37 85.97 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.886 1.274 . . . . 2.0699999999999998 110.758 168.581 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -56.75 -47.2 80.59 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 125.543 1.537 . . . . 2.1200000000000001 110.886 175.315 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -26.34 64.75 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 121.205 -0.934 . . . . 3.9700000000000002 113.405 174.113 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 t -88.68 -32.8 17.81 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 120.714 -1.242 . . . . 2.23 113.468 176.917 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.441 ' CD2' ' HA ' ' A' ' 72' ' ' TYR . 7.1 mt -58.42 -50.59 73.16 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.815 1.246 . . . . 2.6400000000000001 110.938 165.06 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -102.57 76.47 1.53 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.375 1.87 . . . . 1.8899999999999999 112.791 -161.78 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -60.42 -21.33 62.12 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 113.67 0.989 . . . . 3.04 113.67 -167.689 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 51.6 p30 -100.5 -8.29 23.28 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.662 1.585 . . . . 2.2000000000000002 114.351 177.657 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 73.4 m 54.89 33.64 20.38 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.201 1.4 . . . . 2.5499999999999998 114.069 -174.687 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.4 p30 -71.02 -15.54 62.56 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.547 1.539 . . . . 2.1400000000000001 111.872 176.35 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 66.04 4.53 3.1 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 131.558 3.943 . . . . 4.0300000000000002 116.131 -174.9 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -103.99 126.86 51.43 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 127.193 2.197 . . . . 2.52 109.056 167.527 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 1.6 mm -104.3 100.74 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 O-C-N 120.953 -1.092 . . . . 1.05 111.024 -175.041 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -75.28 156.86 35.2 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 127.421 2.289 . . . . 2.54 111.275 170.561 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -45.41 -41.36 9.14 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.125 1.528 . . . . 3.5499999999999998 115.125 -179.994 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.6 pttm -80.14 -10.22 59.75 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 113.912 1.078 . . . . 3.23 113.912 -178.595 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -80.93 -53.67 6.24 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 108.043 -1.095 . . . . 1.79 108.043 158.278 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.441 ' HA ' ' CD2' ' A' ' 59' ' ' LEU . 30.9 t80 -54.48 -36.38 64.07 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.343 2.257 . . . . 2.79 116.178 -170.891 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.6 p -67.69 -23.12 65.26 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 120.725 -1.234 . . . . 2.29 112.79 -170.77 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 p -60.74 -28.13 42.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 CA-C-N 118.56 0.618 . . . . 2.2200000000000002 112.586 176.517 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -74.72 -58.9 3.0 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.921 0.889 . . . . 2.3100000000000001 110.469 -175.752 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.494 ' H ' HD23 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -61.83 -24.53 66.94 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 118.045 -0.978 . . . . 2.0299999999999998 113.126 172.452 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 53.7 m -58.59 -53.72 55.21 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.874 0.87 . . . . 0.84999999999999998 110.946 165.411 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 61.8 mtm -60.95 -40.18 92.31 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.822 0.737 . . . . 1.49 112.356 178.451 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 60.7 mt -60.09 -51.42 69.69 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.784 0.72 . . . . 1.48 110.729 174.698 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 82.0 m -63.84 -35.07 79.41 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.098 0.777 . . . . 1.8400000000000001 113.098 178.024 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 75.3 mtp -62.81 -44.35 96.38 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.892 1.224 . . . . 2.0800000000000001 111.325 171.57 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.44 -47.82 82.39 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.932 -0.556 . . . . 0.82999999999999996 111.452 177.249 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -62.85 -32.16 73.33 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.941 0.792 . . . . 3.1299999999999999 113.085 177.005 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -67.74 -39.98 84.17 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 119.88 1.218 . . . . 2.2599999999999998 111.358 177.133 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -72.69 -39.47 67.0 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.001 0.819 . . . . 2.98 110.965 178.465 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -53.62 -42.34 67.63 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.008 1.723 . . . . 2.3900000000000001 111.464 170.653 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -58.92 -29.31 66.99 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.23 1.012 . . . . 2.4199999999999999 112.886 -179.448 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.9 mp -74.7 -23.55 58.62 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.57 0.748 . . . . 2.23 112.916 174.494 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -91.82 -14.58 29.53 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.809 1.644 . . . . 2.6499999999999999 114.359 175.858 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 31.9 t70 . . . . . 0 CA--C 1.54 0.562 0 C-N-CA 128.045 2.538 . . . . 3.71 113.067 -170.475 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 17.2 p . . . . . 0 N--CA 1.469 0.476 0 N-CA-C 113.037 0.754 . . . . 1.8300000000000001 113.037 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -62.75 -18.93 66.87 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.701 2.267 . . . . 2.3900000000000001 112.257 166.713 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 9.7 tt -68.39 -51.99 37.94 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-O 118.482 -0.771 . . . . 2.7400000000000002 110.387 166.477 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.05 -30.62 71.74 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.755 1.161 . . . . 3.79 111.974 176.973 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -33.54 68.18 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 119.523 -1.986 . . . . 5.3300000000000001 111.963 172.494 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.03 -40.03 94.23 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 119.691 1.132 . . . . 1.8100000000000001 112.648 169.76 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 68.2 mt -64.77 -35.55 81.45 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.287 0.949 . . . . 2.1800000000000002 111.872 171.018 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 36.5 m -60.96 -52.01 66.83 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 118.061 -0.971 . . . . 1.3500000000000001 110.182 170.416 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 93.1 m -50.93 -38.75 52.23 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.069 1.348 . . . . 1.6499999999999999 111.802 175.776 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 5.1 ttp -53.45 -51.52 62.41 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.585 0.754 . . . . 3.3900000000000001 112.022 174.229 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 34.5 m -74.66 -27.84 21.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 N-CA-C 113.251 0.834 . . . . 2.25 113.251 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 17.9 m -59.22 -54.84 42.37 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.656 1.182 . . . . 1.29 110.745 176.446 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.93 -32.12 51.41 Favored 'General case' 0 C--O 1.224 -0.252 0 O-C-N 123.62 0.575 . . . . 3.6499999999999999 110.463 -175.989 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -54.49 -44.52 72.72 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.312 0.505 . . . . 1.96 110.718 172.418 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.21 -27.32 63.79 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.821 1.415 . . . . 2.02 114.821 179.04 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -63.71 -45.6 89.26 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 120.833 -1.167 . . . . 5.0700000000000003 111.537 172.541 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.503 ' CD2' HD13 ' B' ' 37' ' ' LEU . 21.5 m-85 -87.7 -10.27 51.7 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.428 1.091 . . . . 2.0299999999999998 113.098 -178.383 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 68.2 m -58.05 -56.52 20.96 Favored 'General case' 0 C--O 1.241 0.624 0 O-C-N 120.883 -1.136 . . . . 1.8300000000000001 112.009 164.018 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.12 -20.31 53.24 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-O 117.407 -1.774 . . . . 2.52 114.77 -168.439 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -47.85 -46.51 31.2 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.402 1.481 . . . . 3.7799999999999998 113.118 -169.572 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 57.0 mp0 -130.74 153.53 48.92 Favored 'General case' 0 C--O 1.248 0.981 0 CA-C-O 124.014 1.864 . . . . 3.5899999999999999 111.912 167.744 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.92 -8.15 2.65 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.32 1.438 . . . . 2.3700000000000001 113.903 -172.309 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 15.1 m 57.1 -142.83 0.73 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.485 1.114 . . . . 6.1500000000000004 109.781 -159.782 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 24.1 mttt 68.25 -172.48 0.19 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.274 1.83 . . . . 11.44 112.541 172.522 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 mp -82.91 -0.8 50.1 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.829 1.251 . . . . 3.71 112.843 173.683 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 21.8 p -113.57 152.47 30.25 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 115.765 1.765 . . . . 1.1200000000000001 115.765 -155.578 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -101.43 108.39 19.97 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 127.205 2.202 . . . . 2.0899999999999999 113.022 -172.215 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 12.9 t -84.1 162.46 20.29 Favored 'General case' 0 C--N 1.315 -0.896 0 O-C-N 120.247 -1.533 . . . . 2.0899999999999999 112.16 176.835 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 24.0 ttt85 -45.14 -41.11 7.69 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.603 1.561 . . . . 4.0099999999999998 114.426 -178.17 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.82 -36.36 42.71 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.898 -1.126 . . . . 6.3099999999999996 113.277 174.279 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -60.5 -46.11 91.32 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 120.041 1.291 . . . . 1.8 110.393 176.349 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 8.2 tp -65.69 -36.78 84.61 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.008 1.723 . . . . 1.9399999999999999 113.076 178.7 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -64.91 -28.03 69.26 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.362 1.065 . . . . 5.2599999999999998 112.363 174.506 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.03 -77.19 0.08 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.061 -0.971 . . . . 3.2400000000000002 108.541 158.822 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . 0.503 HD13 ' CD2' ' B' ' 19' ' ' TYR . 23.3 tp -48.69 -43.2 36.79 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.276 1.83 . . . . 2.1000000000000001 114.502 -163.684 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 58.6 mt -57.15 -64.51 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 120.191 1.36 . . . . 1.3 107.49 174.474 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 25.4 mtpt -62.09 -26.37 68.25 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.398 0.888 . . . . 4.6100000000000003 113.398 -174.803 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.73 -36.48 50.8 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.113 1.765 . . . . 5.7699999999999996 113.308 -179.534 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -122.17 -29.48 4.19 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.145 1.165 . . . . 6.04 114.145 -170.189 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -118.36 79.44 1.38 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.168 1.787 . . . . 3.9199999999999999 107.098 169.446 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 93.4 m -68.53 -47.81 65.96 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.36 -0.836 . . . . 3.9500000000000002 112.448 -155.722 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 6.7 mp 61.84 -34.86 0.11 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 129.755 3.222 . . . . 5.2999999999999998 118.604 170.519 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.68 -51.22 4.39 Favored Glycine 0 N--CA 1.473 1.164 0 C-N-CA 126.598 2.047 . . . . 2.6899999999999999 112.788 174.411 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -68.72 -4.36 15.58 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.497 1.119 . . . . 5.2000000000000002 112.217 168.322 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.55 63.84 0.42 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 124.542 2.115 . . . . 2.29 111.063 163.698 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -76.46 147.89 37.59 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 127.269 2.228 . . . . 3.7799999999999998 109.147 174.457 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.16 -37.1 66.56 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.674 1.361 . . . . 4.8300000000000001 114.674 -157.348 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 8.5 t -74.74 -24.17 58.68 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.884 1.439 . . . . 2.6800000000000002 114.884 174.389 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 4.8 m -63.55 -18.23 63.63 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 120.06 1.3 . . . . 2.2999999999999998 111.957 173.895 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 42.7 mm -67.62 -25.7 33.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 C-N-CA 124.805 1.242 . . . . 1.5800000000000001 111.834 174.299 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -70.75 -34.45 71.85 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.958 0.799 . . . . 5.0599999999999996 111.944 173.391 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.61 -32.95 47.73 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.203 1.001 . . . . 3.54 111.732 174.821 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.87 -44.38 93.25 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 118.414 -0.803 . . . . 2.48 111.211 167.453 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 14.0 mtp -57.64 -49.35 76.76 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.86 1.209 . . . . 1.8 110.71 171.453 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -60.87 -29.32 69.47 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.303 1.441 . . . . 3.4700000000000002 113.142 -178.607 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 33.2 t -76.09 -22.03 56.05 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 115.086 1.513 . . . . 3.5299999999999998 115.086 172.021 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mp -109.21 -45.91 3.66 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.736 1.614 . . . . 3.0600000000000001 114.775 -172.401 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -85.11 88.49 7.47 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.485 1.514 . . . . 1.6000000000000001 111.26 -163.587 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -62.82 -29.36 70.66 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.614 1.565 . . . . 5.1100000000000003 114.634 -173.431 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -85.04 -16.31 41.15 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 117.83 -1.081 . . . . 2.0499999999999998 112.711 169.059 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 20.6 m 49.64 66.1 1.22 Allowed 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 126.261 1.825 . . . . 3.9199999999999999 112.28 176.224 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -136.69 -102.12 0.2 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.377 0.671 . . . . 3.29 110.804 -148.851 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -145.19 -10.17 0.57 Allowed 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 115.592 1.701 . . . . 6.1500000000000004 115.592 167.17 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -137.87 146.12 43.0 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 125.357 1.463 . . . . 2.3900000000000001 112.961 175.541 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 2.6 mt -100.02 109.3 24.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 C-N-CA 127.89 2.476 . . . . 1.4399999999999999 107.284 173.321 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.07 160.2 30.02 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.752 1.621 . . . . 2.4900000000000002 111.181 168.334 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -56.46 -31.26 63.81 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 121.078 -1.014 . . . . 2.3999999999999999 112.999 -174.463 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.6 -11.06 43.74 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.304 1.841 . . . . 3.5899999999999999 112.81 -179.465 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -75.02 -57.18 4.06 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 108.468 -0.938 . . . . 1.6899999999999999 108.468 153.494 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -54.84 -24.88 25.15 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.653 2.381 . . . . 1.8500000000000001 115.663 -174.607 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 1.8 m -49.54 -31.08 9.61 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 120.754 -1.216 . . . . 2.4700000000000002 112.689 170.121 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 95.4 t -74.21 -25.46 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.159 0.583 . . . . 1.6499999999999999 111.959 -179.777 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -61.31 -56.98 14.29 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-N 119.199 0.908 . . . . 2.7599999999999998 111.037 171.039 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . 0.524 HD22 ' H ' ' B' ' 76' ' ' LEU . 2.7 mm? -56.75 -45.57 81.95 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.51 0.724 . . . . 3.04 110.772 179.242 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 76.4 m -53.19 -54.5 35.02 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.118 1.367 . . . . 1.1899999999999999 112.154 176.707 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 12.7 tmm? -65.73 -43.99 87.39 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.948 1.299 . . . . 3.2799999999999998 112.412 -176.293 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -55.27 -50.4 69.62 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.631 0.772 . . . . 2.23 110.978 170.149 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 9.6 t -61.71 -36.11 79.98 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.117 0.784 . . . . 2.6800000000000002 113.117 -179.254 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 94.0 mtp -67.79 -35.95 79.59 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.244 1.017 . . . . 2.46 113.004 173.926 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.91 -30.27 50.53 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 119.453 1.024 . . . . 1.1599999999999999 112.969 175.623 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -74.75 -18.39 60.5 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.668 -1.27 . . . . 2.9199999999999999 111.719 -177.537 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -55.9 -32.97 64.21 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.527 1.531 . . . . 2.5699999999999998 114.055 161.262 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -105.9 -28.94 10.3 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 127.408 2.283 . . . . 3.04 112.126 -167.752 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.67 -41.14 61.16 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.382 1.073 . . . . 3.1099999999999999 110.369 159.336 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -65.94 -24.23 66.77 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.288 1.835 . . . . 2.54 113.218 173.099 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 75.1 mt -90.05 -3.68 57.81 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.453 1.501 . . . . 2.9199999999999999 113.935 178.306 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . 0.454 ' CD ' ' HZ3' ' B' ' 92' ' ' LYS . 72.4 mm-40 -90.45 -4.72 56.8 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.085 0.954 . . . . 3.8900000000000001 112.685 162.014 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -119.02 -66.96 1.02 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.335 1.454 . . . . 3.0499999999999998 111.268 -174.798 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -81.75 47.83 1.13 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.401 1.481 . . . . 3.3300000000000001 111.372 169.544 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . 0.454 ' HZ3' ' CD ' ' B' ' 89' ' ' GLU . 22.2 tttp . . . . . 0 C--O 1.251 1.148 0 C-N-CA 129.748 3.219 . . . . 5.0199999999999996 115.839 -173.316 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 . . . . . 0 CA--C 1.534 0.355 0 N-CA-C 118.412 2.745 . . . . 7.0099999999999998 118.412 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 76.4 p -147.91 161.0 36.45 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 118.603 0.638 . . . . 2.04 112.146 -154.88 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -62.36 -23.86 75.4 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 121.933 1.755 . . . . 1.5600000000000001 111.836 165.384 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -69.87 -48.38 58.97 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.994 1.318 . . . . 2.5699999999999998 111.083 177.411 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -63.77 -44.01 94.69 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 122.522 1.153 . . . . 3.3900000000000001 110.611 177.363 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -66.04 -19.98 66.03 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.686 -1.259 . . . . 4.2300000000000004 112.282 175.105 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -81.94 -45.12 15.84 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.167 1.387 . . . . 1.29 112.379 171.54 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.4 pp -63.37 -30.14 71.32 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 121.999 2.182 . . . . 2.96 112.157 171.588 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 30.0 m -53.09 -56.75 13.8 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.223 1.009 . . . . 1.47 109.371 164.622 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.76 -34.72 73.35 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.926 1.291 . . . . 1.71 114.008 179.503 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -56.88 -44.46 82.28 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.335 1.054 . . . . 3.46 112.444 170.193 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.2 t -71.66 -32.03 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 CA-C-O 118.597 -0.716 . . . . 1.8999999999999999 112.178 173.235 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 54.3 m -57.34 -56.61 19.62 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 119.758 1.163 . . . . 0.93000000000000005 111.641 175.476 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -57.93 -43.12 86.12 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 123.344 0.657 . . . . 2.0699999999999998 110.068 173.537 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -64.5 -45.2 88.3 Favored 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 120.677 -0.409 . . . . 1.9099999999999999 111.99 -173.265 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.32 -45.59 92.56 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 120.379 -1.451 . . . . 2.1499999999999999 112.061 176.336 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.17 -41.36 67.15 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.948 0.721 . . . . 5.8600000000000003 112.948 -176.513 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -72.74 -43.4 62.98 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.083 0.856 . . . . 2.1899999999999999 112.99 173.096 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.2 m -72.45 -26.2 61.74 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 120.307 1.412 . . . . 2.8500000000000001 111.964 -179.407 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.02 -35.44 89.33 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 124.689 1.138 . . . . 2.04 113.164 173.891 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.3 ttt85 -45.55 -50.1 13.31 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 128.073 2.549 . . . . 5.1699999999999999 115.609 -168.775 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -138.6 161.95 35.83 Favored 'General case' 0 C--O 1.25 1.127 0 C-N-CA 126.167 1.787 . . . . 4.7199999999999998 111.465 -177.255 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.52 -87.81 0.27 Allowed Glycine 0 C--N 1.346 1.123 0 C-N-CA 127.234 2.349 . . . . 2.3500000000000001 109.62 179.678 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -146.36 -179.54 6.82 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 121.559 -0.965 . . . . 4.75 110.04 142.75 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.73 156.35 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.489 1.916 . . . . 6.4000000000000004 113.011 147.106 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.0 mt 78.85 -50.7 0.45 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 128.185 2.594 . . . . 3.0699999999999998 110.712 -169.857 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.6 p -86.18 136.6 33.13 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 113.243 0.831 . . . . 2.1200000000000001 113.243 -176.326 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 28.3 mt -90.7 107.4 19.15 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.56 -0.904 . . . . 1.54 108.56 149.394 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.0 t -71.01 161.22 31.52 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 120.646 -1.284 . . . . 1.8799999999999999 111.177 163.425 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 22.4 ttt180 -42.2 -35.34 0.93 Allowed 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.757 1.623 . . . . 3.48 114.209 179.819 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 mmmm -71.38 -55.74 7.35 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 116.071 1.878 . . . . 4.5599999999999996 116.071 173.507 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -49.9 -35.65 24.46 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.2 1.4 . . . . 2.0600000000000001 110.002 171.606 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.7 tp -81.57 -49.07 10.98 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.968 0.907 . . . . 1.8700000000000001 110.902 -174.814 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -55.34 -38.22 68.48 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.06 0.846 . . . . 6.3300000000000001 111.384 175.885 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -79.19 -8.61 59.14 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.83 1.419 . . . . 3.7599999999999998 114.83 -174.73 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 50.8 tp -92.27 -55.28 3.48 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.855 1.262 . . . . 2.8500000000000001 111.212 169.611 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 23.0 mt -57.86 -49.07 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 O-C-N 121.668 -0.645 . . . . 1.24 110.08 -174.133 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.09 -3.94 15.23 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 113.475 0.917 . . . . 4.3899999999999997 113.475 -178.008 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.6 mmtp -95.37 -45.82 6.97 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.948 1.299 . . . . 2.7000000000000002 110.88 167.942 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -64.82 -53.0 53.69 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.227 1.411 . . . . 5.2800000000000002 111.81 -177.131 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -82.47 41.5 0.71 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.029 1.332 . . . . 2.7799999999999998 112.245 -175.621 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 53.4 t -58.04 -33.52 69.09 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.17 1.388 . . . . 3.7799999999999998 112.646 177.916 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -71.42 -6.34 39.57 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.896 1.443 . . . . 4.5800000000000001 114.896 174.332 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -133.67 -8.96 2.09 Favored Glycine 0 N--CA 1.472 1.045 0 CA-C-O 118.195 -1.336 . . . . 3.7000000000000002 115.881 -178.173 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 52.32 41.38 30.47 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.157 1.783 . . . . 7.9100000000000001 113.509 -179.436 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.4 tpt -39.33 104.97 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.609 1.564 . . . . 2.3100000000000001 112.102 -173.509 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -73.53 158.79 34.22 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.393 0.516 . . . . 6.0199999999999996 112.393 -160.641 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.54 -47.02 73.68 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 119.761 1.164 . . . . 5.6299999999999999 111.822 175.447 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.8 t -65.34 -3.67 4.45 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 115.183 1.549 . . . . 2.7999999999999998 115.183 173.782 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -114.1 -18.46 11.67 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.833 1.253 . . . . 2.7599999999999998 113.086 170.317 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 24.8 mt -76.71 -31.15 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 125.908 1.683 . . . . 1.23 110.527 172.029 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -70.2 -41.22 73.96 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 118.127 -0.94 . . . . 2.8500000000000001 113.197 177.166 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -65.92 -44.59 84.7 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 120.385 1.448 . . . . 2.8700000000000001 110.348 168.316 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 49.1 tp -54.67 -48.45 72.35 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.109 -0.948 . . . . 1.96 110.403 179.847 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.6 ttt -55.9 -50.39 70.82 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.192 1.36 . . . . 1.5600000000000001 112.144 172.249 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.56 -18.56 30.72 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.549 1.54 . . . . 4.7400000000000002 113.322 175.345 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.5 m -101.17 -22.85 14.57 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 127.077 2.151 . . . . 2.3700000000000001 113.763 179.067 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.7 mp -72.9 -46.17 54.16 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.573 -1.33 . . . . 2.8700000000000001 110.79 162.328 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -78.48 63.13 3.25 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.826 2.05 . . . . 1.9399999999999999 112.577 -166.295 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -51.06 -39.62 56.41 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 125.804 1.642 . . . . 3.4300000000000002 113.962 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -82.02 -8.02 59.64 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.777 1.399 . . . . 2.6400000000000001 114.777 176.004 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.4 t 63.36 39.55 9.27 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.871 1.268 . . . . 2.3199999999999998 114.202 166.855 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 42.3 p-10 -109.45 1.96 20.23 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 127.946 2.499 . . . . 2.6000000000000001 112.976 -175.074 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 78.66 -7.35 1.8 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 128.157 2.583 . . . . 3.75 115.639 -178.385 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -116.0 141.94 47.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.049 1.34 . . . . 3.8500000000000001 109.895 -179.659 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 22.4 mm -100.22 103.82 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 O-C-N 120.514 -1.366 . . . . 1.1100000000000001 111.569 175.994 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.48 162.22 29.52 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 125.139 1.376 . . . . 2.3999999999999999 112.132 164.057 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.32 -40.72 74.86 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 120.544 -1.348 . . . . 2.0600000000000001 113.16 -174.818 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.63 -14.65 62.94 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 120.977 -1.077 . . . . 3.3700000000000001 112.744 174.855 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -84.88 -51.93 6.37 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.34 -0.85 . . . . 2.0699999999999998 110.789 168.682 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -52.97 -45.0 67.58 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 127.195 2.198 . . . . 2.1299999999999999 114.513 -171.571 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.0 t -54.09 -27.28 31.85 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.225 1.194 . . . . 1.9099999999999999 114.225 -171.214 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.3 m -68.24 -22.97 27.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 O-C-N 120.759 -1.213 . . . . 2.46 113.48 -179.556 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -60.54 -62.83 1.58 Allowed 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 123.704 0.802 . . . . 1.8700000000000001 110.542 171.712 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.408 ' H ' HD12 ' A' ' 76' ' ' LEU . 3.8 mp -60.91 -30.93 70.47 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.347 1.059 . . . . 2.3900000000000001 111.404 179.71 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.5 m -59.73 -58.93 6.42 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.958 0.903 . . . . 0.77000000000000002 111.318 172.167 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 13.6 ptp -65.32 -34.0 77.31 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 118.405 0.548 . . . . 1.6499999999999999 112.228 -178.493 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -54.18 46.42 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.489 1.116 . . . . 2.98 110.794 173.557 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 7.6 t -64.3 -33.76 76.57 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.024 0.53 . . . . 1.6399999999999999 112.08 179.741 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.8 mtp -61.46 -44.18 97.55 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 118.957 0.798 . . . . 2.5099999999999998 112.954 168.616 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.45 -40.84 89.65 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.176 0.898 . . . . 1.1299999999999999 111.293 178.66 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -64.27 -22.39 66.93 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 118.77 -0.633 . . . . 2.7000000000000002 112.705 175.098 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -67.44 -40.9 85.47 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 120.146 1.339 . . . . 1.9199999999999999 111.682 174.013 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -71.91 -40.54 68.76 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.976 0.911 . . . . 2.6899999999999999 110.463 178.806 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -52.89 -48.3 67.26 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.142 1.377 . . . . 2.96 111.871 170.068 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -58.37 -24.38 59.71 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.992 1.717 . . . . 2.7000000000000002 113.618 179.355 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.2 mp -72.27 -17.79 61.86 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.41 1.005 . . . . 2.54 113.37 171.998 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -112.58 6.26 18.31 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 126.889 2.076 . . . . 3.77 114.892 173.985 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 . . . . . 0 CA--C 1.546 0.813 0 O-C-N 120.262 -1.524 . . . . 4.4400000000000004 112.169 162.362 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 71.8 p . . . . . 0 N--CA 1.472 0.659 0 CA-C-O 119.659 -0.21 . . . . 1.9199999999999999 110.938 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.01 -13.07 35.85 Favored 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 122.43 2.086 . . . . 1.4199999999999999 112.757 167.053 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -82.01 -44.14 17.05 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.638 1.175 . . . . 2.73 112.986 -179.58 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -57.56 -40.88 79.92 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 122.343 1.068 . . . . 4.3200000000000003 110.045 168.981 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 49.9 mttm -76.79 -27.84 55.4 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 121.125 -0.985 . . . . 4.5599999999999996 112.259 179.599 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.81 -43.08 80.5 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.876 0.762 . . . . 0.90000000000000002 111.532 169.257 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 42.9 mt -58.22 -39.02 77.96 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.576 1.15 . . . . 1.52 111.12 169.557 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 71.1 m -65.19 -42.59 93.45 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.006 0.922 . . . . 1.48 112.131 171.977 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 63.2 m -58.48 -46.45 86.64 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 120.328 1.422 . . . . 1.3700000000000001 111.047 171.152 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 82.3 mtp -57.24 -49.37 76.25 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.531 1.532 . . . . 3.2000000000000002 111.756 173.754 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.73 -27.36 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.188 0.904 . . . . 1.8999999999999999 112.647 177.279 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 94.1 m -67.96 -54.75 16.21 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.127 1.371 . . . . 0.97999999999999998 110.458 174.012 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.2 p -59.28 -35.95 74.66 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.346 0.975 . . . . 1.97 110.702 173.538 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . 0.448 ' CE1' HD23 ' B' ' 29' ' ' LEU . 27.8 t80 -67.79 -45.72 74.01 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 118.729 -0.653 . . . . 2.1800000000000002 110.96 179.801 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -69.75 -46.78 65.1 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 120.432 1.469 . . . . 2.1600000000000001 111.345 176.42 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -58.69 -44.78 90.37 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.22 1.408 . . . . 5.8799999999999999 113.71 179.306 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -81.14 -19.9 42.48 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 120.641 -1.287 . . . . 2.3100000000000001 112.094 171.235 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 26.9 m -67.79 -22.33 65.19 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 121.112 1.778 . . . . 1.71 112.94 170.207 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.15 7.58 81.78 Favored Glycine 0 CA--C 1.53 1.02 0 C-N-CA 126.467 1.984 . . . . 1.77 114.73 176.216 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 5.0 mmm-85 -76.46 -14.22 60.06 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.477 1.638 . . . . 4.6900000000000004 113.868 178.897 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 171.28 -174.16 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 129.713 3.205 . . . . 3.2799999999999998 110.852 -176.572 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 62.72 -139.1 44.94 Favored Glycine 0 N--CA 1.472 1.096 0 O-C-N 120.731 -1.231 . . . . 1.8600000000000001 110.651 -179.624 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 8.1 t -82.28 158.89 23.3 Favored 'General case' 0 C--O 1.245 0.819 0 CA-C-N 118.054 0.927 . . . . 4.1799999999999997 110.418 157.012 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.6 51.23 1.44 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.89 1.676 . . . . 6.9199999999999999 111.421 172.476 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 63.3 tp -168.07 -35.05 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 126.878 2.071 . . . . 2.9199999999999999 110.678 -170.431 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 25.6 p -102.98 152.75 20.97 Favored 'General case' 0 C--O 1.248 1.001 0 C-N-CA 126.794 2.038 . . . . 1.6000000000000001 111.622 173.801 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.448 HD23 ' CE1' ' B' ' 16' ' ' PHE . 0.0 OUTLIER -122.4 78.48 1.51 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.919 1.287 . . . . 2.21 110.214 -163.807 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.463 ' HA ' ' HA ' ' B' ' 66' ' ' GLU . 1.0 OUTLIER -54.96 150.51 10.09 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.536 1.935 . . . . 2.1400000000000001 112.967 177.738 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 23.5 ttp85 -40.34 -55.23 2.26 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.547 0.943 . . . . 3.2400000000000002 113.547 178.144 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.22 -27.35 61.93 Favored 'General case' 0 CA--C 1.554 1.116 0 N-CA-C 117.15 2.278 . . . . 4.2300000000000004 117.15 177.655 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -76.6 -52.95 8.72 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.181 1.792 . . . . 1.76 108.022 175.284 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.07 -31.59 69.26 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.095 0.558 . . . . 3.2599999999999998 112.314 -173.192 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.58 -15.06 63.41 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.154 1.168 . . . . 5.6699999999999999 114.154 175.777 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.57 -61.95 1.59 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 118.22 -0.895 . . . . 4.0800000000000001 112.555 156.625 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . 0.417 HD23 ' C ' ' B' ' 37' ' ' LEU . 3.6 tt -45.18 -54.0 7.47 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.449 1.499 . . . . 2.0899999999999999 111.577 -174.115 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 11.8 mt -58.6 -68.14 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 119.075 0.852 . . . . 1.22 110.448 -173.742 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -12.57 42.94 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 113.546 0.943 . . . . 4.1799999999999997 113.546 -176.513 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.12 -53.77 6.1 Favored 'General case' 0 N--CA 1.444 -0.763 0 O-C-N 120.479 -1.388 . . . . 6.7000000000000002 111.3 165.84 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -75.8 -32.33 59.81 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 120.461 1.482 . . . . 3.73 112.104 -172.998 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -126.1 110.99 14.15 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.985 2.114 . . . . 2.4100000000000001 110.106 168.578 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 29.4 p -99.26 2.43 45.58 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 121.375 -0.828 . . . . 4.21 112.706 164.821 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 7.2 mp -77.01 155.3 32.67 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.081 0.953 . . . . 4.6200000000000001 112.263 -160.825 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.52 -73.8 1.13 Allowed Glycine 0 N--CA 1.469 0.875 0 C-N-CA 124.709 1.147 . . . . 5.4699999999999998 110.774 -175.073 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -154.71 7.37 0.29 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.164 1.386 . . . . 5.5700000000000003 113.458 165.289 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 5.7 tpt -50.07 117.65 2.46 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.287 1.435 . . . . 3.2799999999999998 114.075 -156.231 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 ttmp? -164.09 162.56 23.04 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.344 1.457 . . . . 3.9900000000000002 110.162 -161.45 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.77 3.51 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 116.653 2.094 . . . . 4.2400000000000002 116.653 170.5 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 2.6 p -73.75 -42.9 60.45 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 119.834 -1.791 . . . . 6.0 113.666 159.25 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 2.8 p -103.92 -16.28 15.4 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.299 1.839 . . . . 2.4399999999999999 113.572 -176.284 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 30.1 mt -71.81 -34.17 50.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 N-CA-C 114.621 1.341 . . . . 2.0 114.621 -176.588 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.09 -29.99 65.97 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 120.464 1.484 . . . . 2.8599999999999999 112.301 -174.204 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -71.24 -45.16 63.87 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.421 1.489 . . . . 2.4700000000000002 112.142 169.829 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 53.4 tp -56.87 -51.09 70.4 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 124.251 1.02 . . . . 2.2000000000000002 109.977 173.093 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 8.6 tpt -52.66 -48.74 66.26 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 127.095 2.158 . . . . 2.1899999999999999 111.861 175.868 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.39 -27.28 62.19 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.741 0.816 . . . . 3.8100000000000001 113.186 172.206 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . 0.402 ' O ' ' HE3' ' B' ' 61' ' ' LYS . 9.3 t -87.8 -30.3 20.34 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.242 1.417 . . . . 2.1400000000000001 113.396 176.74 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 30.5 mt -67.94 -49.15 63.48 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 121.223 -0.923 . . . . 1.8700000000000001 110.605 171.555 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -81.51 81.05 7.74 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 122.895 1.331 . . . . 1.54 112.562 -173.523 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . 0.402 ' HE3' ' O ' ' B' ' 58' ' ' SER . 1.6 mptm? -61.36 -17.04 52.09 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 114.257 1.206 . . . . 3.1200000000000001 114.257 178.607 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -78.3 -33.27 49.46 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.097 0.862 . . . . 2.25 112.915 171.105 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 57.8 m 54.35 56.78 6.5 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.437 1.495 . . . . 2.3599999999999999 111.526 -159.662 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 9.3 p30 -101.21 -72.58 0.67 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.572 1.149 . . . . 2.3599999999999999 109.656 -172.042 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 167.62 -25.71 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.831 1 C-N-CA 133.386 4.674 . . . . 5.9800000000000004 113.854 -177.886 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . 0.463 ' HA ' ' HA ' ' B' ' 30' ' ' SER . 1.2 mt-10 -125.31 133.76 52.5 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 126.624 1.97 . . . . 2.5800000000000001 110.458 -171.091 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 34.1 mt -87.88 112.14 23.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 122.118 0.961 . . . . 1.3300000000000001 109.572 173.876 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.75 163.09 27.91 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.535 1.934 . . . . 2.5600000000000001 111.085 166.527 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -57.1 -37.76 72.4 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 120.866 -1.147 . . . . 2.3199999999999998 113.803 -176.871 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 5.0 mtmp? -77.9 -29.68 50.27 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 120.476 -1.39 . . . . 3.4100000000000001 112.343 177.257 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -60.86 -52.05 66.7 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-N 119.911 1.232 . . . . 1.8600000000000001 108.866 163.229 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -58.0 -29.36 65.22 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 119.61 -1.931 . . . . 2.1899999999999999 114.186 -179.436 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 32.7 p -58.27 -26.14 62.61 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.397 -1.439 . . . . 2.5800000000000001 113.802 171.851 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 47.3 t -64.74 -44.98 96.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.042 0.937 . . . . 1.8300000000000001 109.953 172.939 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -58.12 -54.88 41.94 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 119.103 -0.475 . . . . 1.6599999999999999 111.115 176.805 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 91.4 mt -52.99 -45.74 67.99 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.169 0.987 . . . . 2.04 111.791 -179.748 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 25.3 m -64.11 -51.1 65.58 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.107 0.563 . . . . 1.01 112.286 -179.206 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 67.9 mtm -62.69 -39.69 94.79 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 118.245 0.475 . . . . 2.0099999999999998 111.729 -179.367 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.38 -48.45 67.38 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.353 0.661 . . . . 2.6699999999999999 111.719 179.381 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 84.6 m -65.91 -28.47 68.96 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.079 0.77 . . . . 2.04 113.079 179.657 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 48.0 mtm -72.69 -31.46 65.04 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.034 1.124 . . . . 3.0099999999999998 114.034 169.205 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.67 -43.15 56.71 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.861 1.209 . . . . 0.96999999999999997 112.033 173.738 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.89 -15.64 23.02 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.531 1.308 . . . . 2.2599999999999998 114.531 172.877 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -66.12 -38.12 87.42 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.514 0.726 . . . . 2.54 112.099 172.228 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -90.09 -25.48 20.74 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.736 1.214 . . . . 3.5099999999999998 112.657 -179.12 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.97 -18.9 61.98 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 124.925 1.29 . . . . 3.6099999999999999 112.43 167.9 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -88.57 -16.49 32.44 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.387 1.875 . . . . 2.8399999999999999 112.801 168.903 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 87.7 mt -94.99 -32.15 13.29 Favored 'General case' 0 C--O 1.222 -0.395 0 CA-C-O 116.999 -1.477 . . . . 3.1600000000000001 112.792 -179.951 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -55.48 -25.31 36.19 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 120.297 1.408 . . . . 8.0899999999999999 114.022 168.158 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -81.38 -53.74 6.06 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 128.245 2.618 . . . . 3.3100000000000001 112.492 168.498 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -77.73 -16.9 58.12 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 116.701 2.112 . . . . 3.23 116.701 -170.444 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? . . . . . 0 N--CA 1.469 0.498 0 N-CA-C 119.818 3.266 . . . . 5.5499999999999998 119.818 -159.767 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.543 0.692 0 N-CA-C 106.15 -1.796 . . . . 3.9900000000000002 106.15 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 72.9 p -152.19 169.77 9.02 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 128.264 2.626 . . . . 1.8899999999999999 108.829 -168.921 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.89 -37.46 3.67 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 CA-C-N 120.73 1.296 . . . . 1.8300000000000001 111.372 167.612 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 26.4 mt -62.87 -49.68 73.9 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-O 117.729 -1.129 . . . . 3.23 112.792 -174.916 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -38.34 66.76 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.955 1.252 . . . . 4.4500000000000002 111.057 -178.839 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -73.86 -42.79 60.28 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 120.361 -1.462 . . . . 3.4399999999999999 113.431 171.475 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.566 ' HB1' ' HB2' ' B' ' 8' ' ' ALA . . . -75.13 -30.81 60.92 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 114.717 1.377 . . . . 2.3100000000000001 114.717 -174.782 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.3 mt -67.49 -35.57 79.41 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.908 1.683 . . . . 1.8899999999999999 110.066 166.958 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 56.9 m -67.96 -36.2 79.66 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 118.139 -0.934 . . . . 2.1699999999999999 111.038 170.893 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.9 m -56.61 -41.4 76.98 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 120.004 1.274 . . . . 1.78 111.3 167.38 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.5 tpt -63.34 -44.6 94.41 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.586 0.754 . . . . 4.4800000000000004 112.465 172.835 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 37.5 t -61.83 -33.65 58.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 O-C-N 120.478 -1.388 . . . . 2.23 112.229 173.958 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.9 m -71.24 -41.63 69.88 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.828 1.651 . . . . 1.3500000000000001 112.183 -177.804 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.0 p -69.0 -37.61 78.79 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 117.966 -1.016 . . . . 1.98 109.193 167.904 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -59.69 -57.16 14.12 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.462 0.574 . . . . 2.02 111.147 -173.538 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -59.57 -50.0 75.57 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-O 122.274 1.035 . . . . 2.8300000000000001 111.594 178.097 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -57.8 -34.14 69.31 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.923 -1.111 . . . . 3.5899999999999999 113.683 -178.695 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -97.0 -19.81 18.5 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.992 1.317 . . . . 2.1000000000000001 112.472 177.137 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.4 p -71.11 -29.51 65.37 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-N 121.624 2.011 . . . . 2.1400000000000001 111.952 171.081 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.24 -8.99 80.7 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 126.854 2.168 . . . . 1.8700000000000001 115.217 173.657 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.3 ttm-85 -66.18 -23.38 66.45 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 119.194 1.497 . . . . 4.5199999999999996 113.574 -177.948 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -166.72 158.78 13.32 Favored 'General case' 0 C--O 1.247 0.95 0 C-N-CA 124.404 1.082 . . . . 4.9800000000000004 112.468 -174.672 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.71 -134.25 52.42 Favored Glycine 0 C--N 1.339 0.743 0 C-N-CA 125.268 1.413 . . . . 2.5499999999999998 111.234 172.201 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.9 m -62.52 139.71 58.61 Favored 'General case' 0 C--O 1.246 0.918 0 O-C-N 121.824 -0.81 . . . . 3.77 110.697 165.364 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -89.51 -20.12 24.22 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 115.332 1.605 . . . . 6.21 115.332 -171.065 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.48 ' H ' HD23 ' A' ' 27' ' ' LEU . 2.5 pt? -81.27 -18.76 44.82 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.285 1.034 . . . . 5.2699999999999996 112.793 168.091 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.84 157.1 34.92 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 125.262 1.425 . . . . 1.6299999999999999 114.25 -169.553 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 88.3 mt -99.44 112.91 25.02 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.283 1.833 . . . . 1.6299999999999999 110.606 -177.085 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.35 168.55 16.52 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.983 1.313 . . . . 2.3799999999999999 112.526 170.611 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -51.46 -22.85 3.36 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 127.53 2.332 . . . . 4.0700000000000003 116.316 -175.442 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.68 -39.68 8.55 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 121.178 -0.951 . . . . 4.0199999999999996 112.96 173.972 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -48.29 -48.07 36.01 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.134 0.973 . . . . 1.6200000000000001 110.912 168.011 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.4 -48.38 67.53 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.91 1.284 . . . . 2.3599999999999999 112.444 178.306 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -51.96 -43.91 63.75 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.479 -1.388 . . . . 3.6899999999999999 112.643 174.407 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -68.18 -43.28 78.49 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.706 1.203 . . . . 3.2799999999999998 111.719 177.705 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.6 mt -53.43 -53.68 47.84 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.783 1.174 . . . . 2.7400000000000002 112.926 175.17 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.2 mt -55.15 -48.97 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.137 0.88 . . . . 0.85999999999999999 110.686 -178.481 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -64.94 -27.31 68.76 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 112.586 0.588 . . . . 3.8500000000000001 112.586 -176.738 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -87.62 -48.66 7.72 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.922 1.689 . . . . 2.7999999999999998 112.518 -179.068 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -73.34 -50.59 21.2 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.482 1.513 . . . . 4.4800000000000004 111.946 -175.26 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -95.59 61.73 2.31 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.498 1.519 . . . . 2.8500000000000001 109.313 -177.458 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.6 t -63.64 5.17 0.21 Allowed 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 126.05 1.74 . . . . 3.8300000000000001 115.552 -173.927 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.479 HD12 ' H ' ' A' ' 44' ' ' LEU . 5.0 mp -69.87 -24.23 63.39 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.163 1.785 . . . . 4.4500000000000002 111.968 166.926 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.17 -108.39 3.67 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 125.013 1.292 . . . . 4.7800000000000002 112.211 171.706 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 62.27 -75.65 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.843 2.057 . . . . 5.3700000000000001 112.17 -167.526 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.44 107.44 0.11 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 127.124 2.17 . . . . 2.0800000000000001 115.318 -159.095 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -67.48 151.31 47.59 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.12 0.968 . . . . 5.1500000000000004 109.811 168.752 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -60.69 -33.7 73.24 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 116.027 1.862 . . . . 3.73 116.027 -159.757 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.4 t -84.23 -16.72 42.24 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 114.145 1.165 . . . . 3.1499999999999999 114.145 171.941 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.4 t -76.2 -21.32 56.6 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.259 1.39 . . . . 2.5099999999999998 112.074 174.606 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 21.9 mm -55.92 -40.7 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 124.056 0.943 . . . . 1.54 110.994 163.546 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -69.67 -39.55 76.93 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 123.423 0.689 . . . . 3.3999999999999999 110.609 -172.88 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.98 -33.86 68.47 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.167 0.987 . . . . 2.7200000000000002 113.331 171.935 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.9 -56.55 20.59 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-N 118.831 0.741 . . . . 2.6000000000000001 109.828 171.017 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.6 ptm -71.95 -25.52 61.91 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.918 1.081 . . . . 1.8999999999999999 113.918 -176.804 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.5 ttmp? -64.6 -24.96 67.76 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.316 1.046 . . . . 4.2300000000000004 111.939 168.657 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.3 t -78.29 -25.35 46.61 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.035 1.124 . . . . 2.3999999999999999 114.035 168.3 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.5 mp -73.95 -53.85 9.19 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.174 0.99 . . . . 2.5899999999999999 113.324 178.597 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -75.45 81.92 2.51 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 122.355 1.074 . . . . 1.8200000000000001 112.295 -169.881 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.7 tmtp? -62.19 -7.46 4.18 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 115.118 1.525 . . . . 5.4699999999999998 115.118 -171.141 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.13 -26.69 13.86 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.838 1.655 . . . . 2.79 112.913 172.365 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.1 m 57.84 32.46 21.95 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.322 1.049 . . . . 3.04 112.902 -160.9 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 p30 -75.55 -6.42 50.21 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.779 0.832 . . . . 3.4900000000000002 111.876 166.433 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.35 -3.9 2.46 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 129.505 3.122 . . . . 4.0999999999999996 113.425 171.977 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -106.85 121.4 44.33 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 123.484 1.612 . . . . 2.8100000000000001 110.123 166.565 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 49.9 mt -81.29 103.6 8.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 123.013 1.387 . . . . 1.4199999999999999 108.721 178.517 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.79 151.01 30.56 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 112.844 -1.98 . . . . 4.0300000000000002 109.45 178.979 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.19 -38.14 70.56 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 120.611 -1.306 . . . . 2.6800000000000002 113.375 -177.474 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -59.18 -22.22 60.63 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.335 2.254 . . . . 4.3899999999999997 115.787 172.256 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -94.83 -47.45 6.45 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.248 1.419 . . . . 3.46 109.81 173.091 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -51.36 -26.14 7.2 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 127.432 2.293 . . . . 2.2799999999999998 115.845 -170.853 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 47.3 p -64.18 -18.7 64.73 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 120.155 -1.591 . . . . 1.9099999999999999 113.295 175.839 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.5 m -63.95 -24.22 35.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 119.54 1.064 . . . . 2.52 112.822 170.385 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -60.05 -57.23 13.74 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.633 1.173 . . . . 2.1200000000000001 111.423 173.538 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.6 mp -55.59 -41.07 72.86 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 125.827 1.651 . . . . 3.04 110.56 173.332 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 44.3 m -61.14 -50.9 71.31 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 117.172 -1.394 . . . . 0.71999999999999997 111.742 178.826 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 2.5 mpp? -52.42 -45.89 66.12 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 120.865 1.666 . . . . 2.1200000000000001 111.562 174.735 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 46.5 mt -69.69 -49.25 55.23 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.624 0.77 . . . . 1.27 111.444 -175.716 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 99.3 m -65.37 -30.21 71.01 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.614 0.968 . . . . 1.6799999999999999 113.614 176.654 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 69.3 mtp -70.17 -37.0 75.07 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 120.01 1.277 . . . . 1.73 111.203 171.874 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.64 -37.05 84.01 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.181 0.901 . . . . 0.85999999999999999 112.616 173.102 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.0 m-30 -68.25 -23.33 64.77 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.987 0.915 . . . . 2.3100000000000001 112.575 174.6 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -68.0 -48.5 65.58 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.438 0.695 . . . . 2.3300000000000001 111.52 174.571 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -62.49 -43.11 99.62 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.968 1.707 . . . . 2.6600000000000001 111.643 178.673 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.43 -45.52 65.99 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.303 1.441 . . . . 2.3900000000000001 111.964 174.174 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -66.79 -27.76 67.83 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.803 1.241 . . . . 2.8700000000000001 112.533 178.69 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 84.4 mt -78.01 -17.65 56.85 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.581 1.152 . . . . 1.9399999999999999 113.511 175.829 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -101.35 1.44 38.54 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 114.485 1.291 . . . . 2.8199999999999998 114.485 173.725 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 21.1 t70 . . . . . 0 CA--C 1.541 0.617 0 C-N-CA 125.06 1.344 . . . . 4.1200000000000001 111.729 171.169 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.4 p . . . . . 0 C--O 1.238 0.486 0 N-CA-C 109.351 -0.611 . . . . 2.04 109.351 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -71.65 -13.71 29.95 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.877 2.385 . . . . 1.8700000000000001 111.886 163.88 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 8.8 tt -76.34 -42.95 43.15 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 123.916 0.887 . . . . 2.9500000000000002 111.322 177.501 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -60.52 -30.29 69.64 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 118.617 0.644 . . . . 4.1500000000000004 111.28 177.032 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.48 -25.75 38.66 Favored 'General case' 0 CA--C 1.548 0.869 0 O-C-N 120.786 -1.196 . . . . 3.9199999999999999 114.166 169.334 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . 0.566 ' HB2' ' HB1' ' A' ' 8' ' ' ALA . . . -62.19 -42.58 99.42 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.012 -1.055 . . . . 1.3899999999999999 111.301 171.255 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 41.1 mt -69.71 -36.63 76.07 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.638 1.175 . . . . 1.55 111.441 -175.02 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.79 -47.01 67.21 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.821 0.848 . . . . 1.5600000000000001 112.002 168.268 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.3 t -65.44 -25.06 67.35 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 120.093 1.315 . . . . 2.6499999999999999 111.966 -178.571 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 85.9 mtp -59.2 -60.11 4.38 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.143 0.977 . . . . 2.8300000000000001 110.869 169.479 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 28.1 m -61.78 -22.95 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 120.378 -1.451 . . . . 2.1600000000000001 113.112 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 90.5 m -75.48 -40.15 57.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 126.269 1.828 . . . . 0.79000000000000004 113.185 178.7 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 10.7 p -75.33 -35.29 61.22 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.112 1.323 . . . . 1.72 109.923 169.25 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -54.28 -61.38 2.34 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.85 0.86 . . . . 2.0800000000000001 109.91 -179.273 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 42.4 m170 -71.15 -24.86 62.34 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 115.005 1.483 . . . . 2.6600000000000001 115.005 178.672 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -70.19 -33.92 72.32 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 122.026 2.194 . . . . 4.0999999999999996 113.657 174.199 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -92.0 -36.18 13.55 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.155 0.889 . . . . 2.0899999999999999 112.479 175.765 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t -64.83 -29.75 70.72 Favored 'General case' 0 C--O 1.247 0.963 0 N-CA-C 113.844 1.053 . . . . 1.98 113.844 171.355 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.29 -12.24 84.77 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 126.583 2.04 . . . . 1.6699999999999999 114.675 178.893 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -76.88 -44.6 31.35 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 118.783 1.292 . . . . 3.4399999999999999 112.361 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -123.65 144.57 49.55 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 118.768 0.713 . . . . 3.2000000000000002 111.888 -171.35 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.77 -129.69 30.66 Favored Glycine 0 C--N 1.341 0.845 0 C-N-CA 125.628 1.585 . . . . 2.2799999999999998 112.791 175.528 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 12.0 t -57.62 132.47 53.32 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.609 0.719 . . . . 3.6600000000000001 110.578 166.218 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -80.89 -12.75 59.36 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.575 1.15 . . . . 7.29 113.938 177.729 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 57.5 tp -84.17 -39.98 18.72 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.62 1.168 . . . . 2.7599999999999998 111.116 171.011 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 3.1 p -108.0 148.77 29.26 Favored 'General case' 0 C--O 1.253 1.256 0 C-N-CA 125.495 1.518 . . . . 1.5900000000000001 113.421 -173.208 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 2.4 pp -122.56 112.04 17.52 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 113.104 -1.862 . . . . 1.96 111.48 -174.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 79.9 p -97.12 -170.02 1.96 Allowed 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 122.144 0.973 . . . . 1.76 113.392 -178.989 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 25.6 ttt-85 -56.08 -8.12 0.43 Allowed 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 117.948 2.573 . . . . 3.5099999999999998 117.948 -172.349 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.89 -50.73 3.75 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 113.734 1.012 . . . . 4.2599999999999998 113.734 164.295 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -54.69 -34.06 61.77 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.771 1.228 . . . . 1.9199999999999999 112.029 178.015 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 54.6 tp -70.23 -49.4 50.43 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.28 1.032 . . . . 1.9399999999999999 112.335 174.548 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -78.83 -24.4 44.46 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.373 -1.454 . . . . 3.8599999999999999 114.65 -174.021 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -46.26 -71.68 0.07 Allowed 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 117.802 -1.094 . . . . 3.23 110.503 149.903 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.18 -57.75 6.18 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.612 1.165 . . . . 1.8300000000000001 113.215 -175.726 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 22.8 mt -53.98 -44.98 63.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 119.269 0.94 . . . . 0.97999999999999998 110.13 -176.558 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 22.9 mmmt -74.56 -5.61 43.82 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.559 1.318 . . . . 5.3399999999999999 114.559 -179.847 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 8.7 mmtp -102.78 -22.11 13.95 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 120.749 1.613 . . . . 3.9500000000000002 113.699 168.351 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -91.02 -87.9 0.19 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.315 1.046 . . . . 3.8700000000000001 108.491 170.875 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -77.37 37.77 0.22 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.099 1.76 . . . . 2.23 112.842 -175.936 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 39.8 t -51.05 -27.64 8.51 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.645 1.978 . . . . 4.0800000000000001 113.488 178.604 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.584 ' H ' HD12 ' B' ' 44' ' ' LEU . 3.3 mp -60.16 -37.06 79.01 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.369 2.268 . . . . 4.2800000000000002 113.641 178.92 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -81.83 40.53 2.65 Favored Glycine 0 N--CA 1.473 1.131 0 C-N-CA 124.798 1.19 . . . . 4.0599999999999996 113.983 -169.107 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . 0.427 ' HG3' ' H ' ' B' ' 47' ' ' MET 0.266 6.2 pt-20 46.08 -68.67 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 129.521 3.128 . . . . 4.96 114.928 -165.288 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . 0.427 ' H ' ' HG3' ' B' ' 46' ' ' GLU . 6.9 mmt 59.16 60.82 2.26 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 124.672 2.177 . . . . 3.0299999999999998 113.235 173.074 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.3 mppt? -65.51 159.46 24.44 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 111.604 -2.544 . . . . 3.6699999999999999 111.489 168.256 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.56 -41.85 6.83 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 128.275 2.63 . . . . 5.8600000000000003 115.66 -170.202 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 6.0 t -91.35 -32.97 15.47 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.456 1.102 . . . . 3.6600000000000001 113.151 177.405 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 35.9 t -62.74 -33.83 75.94 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 120.204 -1.56 . . . . 1.8600000000000001 111.398 174.074 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 3.7 mm -59.97 -38.42 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 126.974 2.11 . . . . 1.5700000000000001 112.878 166.815 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.85 -31.02 24.02 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 124.791 1.236 . . . . 2.7000000000000002 111.472 -168.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -81.67 -30.97 32.46 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.201 1.401 . . . . 4.6699999999999999 111.645 170.468 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 16.0 tp -57.74 -45.61 85.61 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.525 -0.75 . . . . 2.0899999999999999 110.061 162.355 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 3.2 ttt -58.68 -41.91 87.3 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-O 118.069 -0.967 . . . . 1.6200000000000001 113.279 173.66 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 31.0 mttp -61.02 -29.48 69.74 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 120.358 1.435 . . . . 4.8499999999999996 112.134 176.455 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 2.2 p -79.21 -37.34 38.42 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.258 0.836 . . . . 2.8700000000000001 113.258 173.643 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . 0.461 HD11 ' HB2' ' B' ' 75' ' ' PHE . 0.4 OUTLIER -67.85 -53.15 29.01 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 125.828 1.651 . . . . 2.5 110.603 179.733 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -76.85 68.08 3.0 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 123.671 1.7 . . . . 1.6299999999999999 111.19 -179.317 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -53.0 -26.51 15.6 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.905 2.482 . . . . 3.75 114.03 178.827 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -73.5 -34.39 65.27 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 118.199 -0.905 . . . . 2.8199999999999998 112.873 171.744 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 65.8 m 53.54 65.49 1.5 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.609 1.164 . . . . 3.25 111.388 -157.841 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -110.34 -74.2 0.66 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.78 1.232 . . . . 2.5800000000000001 109.893 -175.979 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 173.58 -25.23 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 131.362 3.865 . . . . 6.4800000000000004 112.765 -178.096 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -132.28 142.6 49.44 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 127.131 2.172 . . . . 3.5099999999999998 111.443 -169.342 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 46.5 mm -83.23 110.29 17.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 125.15 1.38 . . . . 1.23 109.383 172.937 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -74.45 163.18 28.08 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.86 1.664 . . . . 3.0800000000000001 110.557 161.552 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.62 -36.31 78.31 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 120.16 -1.588 . . . . 2.8100000000000001 112.627 178.446 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -71.89 -15.78 62.12 Favored 'General case' 0 CA--C 1.556 1.194 0 O-C-N 120.631 -1.293 . . . . 6.3399999999999999 111.876 177.433 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -81.14 -58.8 2.9 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.293 1.437 . . . . 1.8700000000000001 108.898 164.172 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -45.93 -45.3 15.37 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.344 2.257 . . . . 1.98 114.032 -175.532 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 56.3 m -53.76 -27.52 29.22 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.291 0.849 . . . . 2.27 113.291 178.477 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 87.5 t -62.16 -36.53 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 119.995 1.271 . . . . 1.6000000000000001 111.211 178.959 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . 0.461 ' HB2' HD11 ' B' ' 59' ' ' LEU . 13.9 t80 -51.45 -62.08 1.84 Allowed 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.446 0.698 . . . . 1.75 111.062 174.135 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 77.9 mt -72.61 -22.72 60.92 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.993 0.917 . . . . 2.2000000000000002 112.328 -175.483 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.7 m -60.62 -56.16 24.69 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.631 1.173 . . . . 0.91000000000000003 110.197 169.378 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 58.1 mtm -55.58 -42.32 74.61 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 118.299 0.5 . . . . 1.5 112.099 -179.507 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 31.1 mt -71.18 -40.01 71.49 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.688 0.795 . . . . 1.4099999999999999 112.366 -177.145 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 14.7 t -64.42 -34.12 77.44 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.88 0.696 . . . . 2.2599999999999998 112.88 177.458 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 2.9 mtm -70.96 -36.59 72.63 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.596 -0.69 . . . . 3.6299999999999999 112.012 170.161 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.68 -34.66 78.36 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.76 1.164 . . . . 1.03 112.755 175.383 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -68.43 -35.6 77.84 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 119.182 0.901 . . . . 2.4500000000000002 112.343 171.922 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -64.93 -41.58 95.4 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.179 0.992 . . . . 1.8300000000000001 112.633 173.95 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -72.47 -29.78 63.96 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.043 0.937 . . . . 3.5600000000000001 111.347 179.054 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -58.75 -52.16 66.91 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.201 1.0 . . . . 2.4500000000000002 111.094 167.731 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -58.24 -32.62 68.51 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.161 1.385 . . . . 2.7200000000000002 112.13 -179.869 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 42.4 mt -72.34 -16.24 61.87 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.468 1.285 . . . . 1.8400000000000001 114.468 175.972 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . 0.536 ' CD ' ' HZ3' ' B' ' 92' ' ' LYS . 72.8 mm-40 -97.95 -18.23 18.76 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.743 1.217 . . . . 4.5 113.839 172.915 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -101.17 -40.79 7.01 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.21 1.804 . . . . 2.9300000000000002 113.268 -169.282 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -89.34 24.23 2.28 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 124.598 1.159 . . . . 2.8500000000000001 112.989 177.65 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . 0.536 ' HZ3' ' CD ' ' B' ' 89' ' ' GLU . 38.4 mttp . . . . . 0 C--O 1.246 0.916 0 C-N-CA 126.828 2.051 . . . . 4.7000000000000002 115.14 174.496 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 . . . . . 0 CA--C 1.535 0.388 0 N-CA-C 109.215 -0.661 . . . . 4.3899999999999997 109.215 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.4 p -136.05 153.24 76.71 Favored Pre-proline 0 N--CA 1.468 0.461 0 C-N-CA 124.814 1.246 . . . . 1.8200000000000001 108.145 169.912 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.18 -17.75 59.45 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.221 1.947 . . . . 1.3700000000000001 112.486 176.333 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 17.1 tp -85.74 -44.64 12.35 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 118.044 -0.979 . . . . 3.02 112.524 -179.09 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -58.2 -49.47 76.95 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.84 1.2 . . . . 4.0499999999999998 109.48 165.615 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -29.9 67.19 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.473 -0.767 . . . . 4.46 112.213 178.767 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.8 -51.2 58.5 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 117.449 -1.262 . . . . 1.05 112.112 172.369 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.7 mt -55.85 -48.3 75.76 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 120.208 1.367 . . . . 1.54 111.01 174.94 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 36.9 m -52.81 -49.93 64.67 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 125.175 1.39 . . . . 1.6399999999999999 110.405 173.292 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 86.4 m -61.38 -45.8 92.85 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 120.077 1.308 . . . . 1.7 112.494 177.858 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 79.0 mtp -54.24 -48.45 71.1 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.427 1.091 . . . . 3.3700000000000001 111.711 175.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 78.0 t -78.53 -33.81 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.484 0.714 . . . . 2.9500000000000002 112.059 -176.405 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.1 m -56.37 -55.84 28.53 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.458 1.103 . . . . 1.28 110.322 170.28 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.8 t -67.84 -33.35 74.6 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 117.376 -1.297 . . . . 2.4199999999999999 110.15 -172.822 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -55.17 -48.88 73.15 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.702 0.683 . . . . 1.8100000000000001 111.504 172.962 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 23.1 m170 -64.68 -34.95 79.52 Favored 'General case' 0 CA--C 1.549 0.925 0 O-C-N 120.863 -1.148 . . . . 3.6699999999999999 112.736 178.291 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.4 tmtm? -61.12 -25.22 66.83 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.692 1.197 . . . . 5.8200000000000003 113.503 173.468 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.408 ' CE2' HD23 ' A' ' 37' ' ' LEU . 69.3 m-85 -88.27 -30.51 19.6 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 120.677 -1.264 . . . . 3.1099999999999999 112.084 168.924 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.5 p -60.26 -19.5 55.03 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 117.425 2.38 . . . . 3.1299999999999999 117.425 -172.092 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.61 -7.67 53.33 Favored Glycine 0 CA--C 1.537 1.412 0 CA-C-O 118.394 -1.226 . . . . 1.75 115.721 -178.893 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 88.5 mtt-85 -77.54 53.07 1.03 Allowed 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 120.278 2.039 . . . . 5.3899999999999997 112.785 176.197 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 121.2 175.33 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 131.221 3.808 . . . . 4.1100000000000003 108.945 -176.031 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 9.68 113.18 0.0 OUTLIER Glycine 0 N--CA 1.481 1.66 0 C-N-CA 128.615 3.007 . . . . 2.6699999999999999 117.964 178.187 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.3 m 69.86 155.51 0.13 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.59 1.156 . . . . 2.6699999999999999 113.69 166.153 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -101.05 52.26 0.85 Allowed 'General case' 0 N--CA 1.483 1.194 0 O-C-N 120.541 -1.35 . . . . 5.5599999999999996 111.136 171.883 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 tt -161.03 -58.3 0.05 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.345 1.058 . . . . 3.2599999999999998 112.338 -172.515 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.9 p -84.64 156.07 21.7 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 127.453 2.301 . . . . 1.4399999999999999 113.284 -173.883 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 18.6 mt -92.07 94.77 9.41 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 114.704 -1.134 . . . . 1.6699999999999999 109.303 161.05 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.0 m -74.37 133.55 42.49 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 125.231 1.413 . . . . 3.7999999999999998 109.304 170.486 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -0.12 -70.34 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 127.687 2.395 . . . . 4.3899999999999997 117.107 -173.476 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.56 -36.68 83.43 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 119.481 -2.012 . . . . 4.0499999999999998 114.539 -175.583 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -57.74 -41.63 82.23 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.846 1.659 . . . . 2.77 110.563 175.518 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -66.05 -40.67 91.15 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.755 1.222 . . . . 2.3599999999999999 110.711 178.944 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.1 mtpt -65.3 -41.55 93.99 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 120.712 -1.242 . . . . 3.3100000000000001 113.154 175.327 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -56.23 -51.46 68.01 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-O 117.995 -1.002 . . . . 5.0800000000000001 112.543 170.075 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.408 HD23 ' CE2' ' A' ' 19' ' ' TYR . 1.7 tm? -52.61 -57.64 9.36 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.078 0.854 . . . . 2.9700000000000002 111.154 -178.506 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 46.0 mt -54.43 -46.35 70.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 118.367 0.531 . . . . 0.79000000000000004 110.784 -178.807 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -70.08 -9.6 55.96 Favored 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 113.767 1.025 . . . . 4.5999999999999996 113.767 -176.624 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.38 -13.34 9.79 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.527 1.931 . . . . 4.4100000000000001 113.15 -178.089 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -71.45 -51.91 21.32 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.801 1.641 . . . . 4.5599999999999996 108.776 158.062 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -115.81 124.18 50.08 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.471 2.309 . . . . 2.75 108.439 179.779 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 62.0 m -107.27 -8.86 16.24 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.767 1.025 . . . . 3.8399999999999999 113.767 -178.68 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -60.99 154.77 21.67 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 119.559 1.072 . . . . 3.96 113.409 172.172 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -72.85 11.88 4.2 Favored Glycine 0 CA--C 1.537 1.423 0 N-CA-C 116.281 1.273 . . . . 3.9399999999999999 116.281 -169.315 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -85.45 -27.03 25.98 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.964 2.105 . . . . 5.6900000000000004 112.08 178.366 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.69 86.92 7.34 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 123.2 1.476 . . . . 2.6299999999999999 112.151 -178.518 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 72.7 mttt -132.14 170.63 14.72 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 127.662 2.385 . . . . 4.9800000000000004 111.245 -177.552 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.96 -46.8 71.71 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.293 -0.88 . . . . 4.2000000000000002 113.039 -164.81 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.8 m -63.04 -25.49 68.4 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.366 1.617 . . . . 2.77 115.366 176.403 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.6 p -94.56 6.78 47.8 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.513 1.125 . . . . 2.8900000000000001 112.735 171.554 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 28.2 mt -125.32 -35.48 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.885 1.274 . . . . 1.3300000000000001 113.448 -173.546 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -82.55 -29.47 30.31 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.478 1.035 . . . . 3.9700000000000002 112.244 179.27 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -66.62 -45.09 80.23 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 118.513 0.597 . . . . 2.46 110.052 158.683 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.5 tp -59.75 -39.38 84.57 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 118.552 -0.737 . . . . 1.79 110.636 -177.806 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.1 tpt -51.75 -59.5 4.23 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 119.241 0.928 . . . . 2.1499999999999999 109.996 165.853 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.19 -19.16 19.04 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 125.808 1.643 . . . . 3.96 115.008 176.367 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.8 m -98.98 -29.42 12.93 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.723 2.009 . . . . 3.1600000000000001 113.515 -178.006 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 97.5 mt -83.27 -42.81 16.76 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.494 1.518 . . . . 1.8899999999999999 111.814 170.873 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -73.76 81.28 1.59 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.418 2.287 . . . . 2.0099999999999998 111.663 -175.694 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -51.7 -32.45 30.06 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 115.247 1.573 . . . . 3.0600000000000001 115.247 -173.014 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -81.88 -11.96 58.67 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.973 1.101 . . . . 1.9399999999999999 113.973 178.793 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.8 t 55.4 45.53 25.16 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.558 1.143 . . . . 2.4399999999999999 111.72 -169.387 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -102.33 -131.89 0.27 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.575 1.95 . . . . 2.96 107.796 178.876 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -142.47 1.06 1.34 Allowed 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 120.337 1.426 . . . . 3.7599999999999998 114.741 164.326 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -103.07 134.17 46.95 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 126.485 1.914 . . . . 2.3500000000000001 109.324 173.548 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.7 mm -96.47 114.06 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 126.581 1.952 . . . . 1.4299999999999999 109.914 171.965 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -88.77 157.2 18.57 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.879 1.271 . . . . 2.6899999999999999 108.759 163.401 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -49.85 -42.17 46.82 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.326 -1.484 . . . . 2.3100000000000001 114.44 -177.394 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.457 ' H ' ' HD2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -69.85 -11.43 60.85 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 114.524 1.305 . . . . 3.1800000000000002 114.524 176.791 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -84.84 -56.06 3.77 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 124.929 1.292 . . . . 1.8 108.004 162.157 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -50.02 -45.14 51.71 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.192 1.797 . . . . 2.3100000000000001 115.771 -176.209 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.9 m -65.03 -8.61 16.84 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 120.793 -1.192 . . . . 2.0099999999999998 113.468 -177.313 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 99.7 t -62.24 -37.02 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 119.585 1.084 . . . . 2.2200000000000002 110.939 167.32 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -65.66 -52.35 52.35 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.18 0.992 . . . . 2.1299999999999999 110.036 178.083 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -55.67 -44.51 77.33 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.627 1.171 . . . . 2.2799999999999998 110.783 176.844 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.3 m -58.53 -52.32 66.15 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.764 0.826 . . . . 0.87 111.855 173.831 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 73.3 mtm -61.92 -35.58 78.82 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.229 0.922 . . . . 1.45 112.404 -179.476 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.75 -50.5 42.74 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 123.857 0.863 . . . . 2.98 111.623 175.715 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 28.1 m -60.66 -33.79 73.33 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 118.42 -0.8 . . . . 1.3799999999999999 112.737 174.428 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 62.6 mtp -70.58 -37.36 73.94 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.008 0.822 . . . . 2.1800000000000002 111.795 172.554 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.51 -41.63 92.97 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 119.571 1.078 . . . . 0.85999999999999999 111.047 173.5 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -70.85 -32.7 69.8 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.702 1.137 . . . . 2.3900000000000001 113.614 175.406 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -58.41 -52.28 66.28 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.407 1.083 . . . . 3.0600000000000001 110.718 168.189 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -67.95 -41.59 82.25 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.558 1.143 . . . . 4.1600000000000001 112.643 -177.262 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.63 -48.93 79.73 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.909 1.684 . . . . 2.6400000000000001 110.576 173.055 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -58.59 -36.96 74.82 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 123.974 0.91 . . . . 3.4199999999999999 111.991 -179.89 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 54.5 mt -72.87 -15.89 61.59 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.37 1.068 . . . . 2.7200000000000002 113.264 177.365 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -106.41 -7.85 17.44 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.433 1.493 . . . . 3.7599999999999998 114.505 175.963 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 11.2 t70 . . . . . 0 N--CA 1.47 0.573 0 C-N-CA 125.412 1.485 . . . . 3.48 112.375 -175.114 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 44.3 p . . . . . 0 N--CA 1.468 0.461 0 CA-C-O 119.276 -0.392 . . . . 2.25 111.279 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -62.06 -21.21 72.0 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 121.887 1.725 . . . . 1.3899999999999999 111.696 171.122 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -85.96 -39.54 16.8 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-O 116.683 -1.627 . . . . 2.8199999999999998 113.837 178.101 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -57.69 -37.9 74.25 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 121.925 2.148 . . . . 5.1799999999999997 110.665 166.663 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -72.95 -26.71 61.47 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.087 -1.008 . . . . 4.7999999999999998 112.718 178.14 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.05 -44.53 38.67 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.218 0.607 . . . . 1.0600000000000001 112.004 171.454 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 58.2 mt -57.13 -45.61 83.35 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.987 1.315 . . . . 1.79 110.936 175.843 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 20.6 p -68.16 -43.57 77.94 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 116.875 -1.536 . . . . 2.2400000000000002 112.501 175.385 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 52.7 m -55.55 -43.18 75.61 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 120.567 1.531 . . . . 1.54 111.028 172.312 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -51.88 66.35 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.121 0.968 . . . . 4.0499999999999998 110.019 178.815 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 75.7 t -64.26 -31.78 54.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 O-C-N 121.158 -0.964 . . . . 1.8999999999999999 112.907 176.436 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 81.2 m -60.72 -57.89 10.76 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.543 1.137 . . . . 1.1399999999999999 109.841 176.135 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.44 -28.34 61.91 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 123.918 0.761 . . . . 3.1499999999999999 110.006 -173.598 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -55.85 -53.87 51.46 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-O 119.129 -0.462 . . . . 1.9199999999999999 110.571 166.573 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 49.0 m80 -70.28 -33.62 71.79 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 120.18 1.355 . . . . 2.6600000000000001 113.076 -178.609 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -64.26 -27.52 69.1 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.042 1.127 . . . . 4.9000000000000004 114.042 174.483 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -100.23 -34.55 9.97 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.993 1.317 . . . . 2.3199999999999998 112.995 177.8 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 7.4 t -82.03 -33.19 30.1 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 126.003 1.721 . . . . 2.0899999999999999 113.331 -178.69 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.54 -11.17 83.47 Favored Glycine 0 CA--C 1.525 0.68 0 O-C-N 120.949 -1.095 . . . . 1.6100000000000001 112.514 170.046 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -57.52 -41.14 80.28 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.671 1.236 . . . . 4.6100000000000003 112.402 -167.791 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -139.22 152.88 47.7 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 126.606 1.962 . . . . 4.9699999999999998 111.676 179.529 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 60.75 2.2 2.35 Favored Glycine 0 CA--C 1.535 1.324 0 O-C-N 121.112 -0.993 . . . . 2.1800000000000002 113.509 -165.302 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 6.0 t 59.47 -154.54 0.37 Allowed 'General case' 0 C--O 1.254 1.315 0 C-N-CA 126.022 1.729 . . . . 6.5199999999999996 111.477 -159.398 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 72.4 mttt 85.07 174.79 0.06 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 129.975 3.31 . . . . 10.65 113.738 156.16 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -76.71 19.33 0.28 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.68 0.792 . . . . 2.8799999999999999 112.721 158.0 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 69.7 p -121.06 132.83 55.12 Favored 'General case' 0 C--O 1.251 1.168 0 CA-C-O 122.978 1.371 . . . . 1.3100000000000001 113.588 -177.096 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -111.42 111.15 21.98 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 112.537 -2.12 . . . . 2.1600000000000001 110.913 177.13 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -88.29 170.02 11.34 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 121.517 0.675 . . . . 2.6699999999999999 111.789 166.364 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 -43.93 -29.59 0.59 Allowed 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 118.928 2.936 . . . . 3.2000000000000002 118.928 -162.803 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.92 -36.47 23.29 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.389 1.255 . . . . 5.2000000000000002 114.389 173.0 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -63.58 -49.58 72.81 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 106.845 -1.539 . . . . 2.1200000000000001 106.845 171.609 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 57.9 tp -56.13 -47.56 77.92 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.644 0.778 . . . . 2.5699999999999998 112.808 174.18 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -58.33 -44.4 88.65 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.394 0.997 . . . . 2.98 111.865 -176.245 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -79.79 -17.66 52.83 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.215 1.561 . . . . 4.1900000000000004 115.215 -179.65 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 2.3 tt -72.32 -54.99 7.9 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.983 1.265 . . . . 1.8799999999999999 110.695 165.795 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 33.4 mt -53.24 -44.57 53.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 CA-C-N 119.42 1.009 . . . . 1.03 110.688 -173.565 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -63.13 -13.93 42.58 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.044 1.127 . . . . 4.1399999999999997 114.044 -177.091 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -95.06 -18.67 20.81 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.471 1.908 . . . . 3.1499999999999999 112.607 176.159 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -96.02 -56.62 2.59 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.828 1.651 . . . . 5.8700000000000001 109.894 178.189 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -99.19 71.65 1.82 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.122 1.369 . . . . 2.7400000000000002 109.574 -179.237 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 14.2 p -73.33 -2.42 22.03 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.014 0.926 . . . . 4.6200000000000001 113.285 167.245 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.419 HD23 ' H ' ' B' ' 44' ' ' LEU . 2.2 pt? -138.39 162.57 34.08 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.854 2.461 . . . . 4.7800000000000002 110.371 -178.88 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.13 -129.83 10.03 Favored Glycine 0 N--CA 1.468 0.83 0 N-CA-C 108.884 -1.687 . . . . 5.3799999999999999 108.884 -165.43 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -148.62 64.73 1.06 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 122.761 1.267 . . . . 5.7000000000000002 111.805 168.139 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.15 66.78 3.01 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 123.871 1.795 . . . . 2.2200000000000002 112.019 176.303 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -63.31 143.92 57.39 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.106 -1.406 . . . . 4.25 109.614 165.199 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -57.78 -24.92 59.53 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.643 1.349 . . . . 4.4299999999999997 114.643 -174.342 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 8.6 t -78.45 -27.74 46.46 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 120.732 -1.23 . . . . 2.6899999999999999 113.71 172.332 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 3.6 m -65.87 -17.01 64.36 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.247 0.931 . . . . 2.6400000000000001 111.848 175.307 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 39.9 mm -64.53 -38.96 83.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 125.34 1.456 . . . . 1.6100000000000001 112.031 177.475 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.28 -30.07 65.83 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.509 1.123 . . . . 3.1600000000000001 112.311 -177.1 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -83.71 -40.67 18.58 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.776 0.83 . . . . 2.5899999999999999 112.27 172.793 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.35 -35.32 77.12 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.343 -0.848 . . . . 2.7200000000000002 110.819 173.483 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 2.5 ttt -52.79 -51.62 60.0 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 118.874 -0.584 . . . . 2.1200000000000001 110.93 167.574 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -71.81 -27.14 62.72 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.58 1.082 . . . . 5.79 113.008 -178.112 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 8.6 t -61.08 -31.82 71.49 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 113.868 1.062 . . . . 2.2000000000000002 113.868 168.64 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -114.6 -29.69 6.74 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 116.939 2.2 . . . . 2.6299999999999999 116.939 -176.119 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -76.29 85.14 3.08 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 124.725 1.21 . . . . 1.6399999999999999 107.809 168.419 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -47.43 -35.67 8.83 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.832 1.419 . . . . 4.7800000000000002 114.832 -164.943 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 44.1 p30 -96.58 -14.5 22.17 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.724 1.379 . . . . 2.6099999999999999 114.724 -179.917 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 70.9 m 53.98 62.97 2.35 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.932 1.293 . . . . 3.4900000000000002 111.644 -167.158 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 14.2 p30 -87.92 -79.49 0.29 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.044 1.338 . . . . 2.9300000000000002 108.787 177.306 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -178.92 -27.54 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 129.812 3.245 . . . . 5.5899999999999999 112.66 168.57 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -113.64 142.41 46.04 Favored 'General case' 0 C--O 1.242 0.667 0 C-N-CA 126.475 1.91 . . . . 2.7200000000000002 108.942 -174.366 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 6.3 mt -119.99 109.59 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 123.586 0.754 . . . . 1.5700000000000001 111.18 -176.451 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -84.06 157.61 21.73 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.008 2.123 . . . . 3.8100000000000001 110.987 172.731 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.93 -33.96 39.73 Favored 'General case' 0 CA--C 1.551 1.01 0 O-C-N 120.578 -1.326 . . . . 2.3999999999999999 114.11 179.92 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -75.67 -19.28 59.26 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 119.982 -1.699 . . . . 5.29 112.874 176.669 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -78.64 -63.65 1.36 Allowed 'General case' 0 CA--C 1.551 0.981 0 O-C-N 121.004 -1.06 . . . . 2.1800000000000002 108.624 160.727 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -58.03 -22.49 50.15 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.381 2.672 . . . . 2.27 117.093 -172.387 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 2.3 p -58.54 -21.35 52.17 Favored 'General case' 0 N--CA 1.481 1.075 0 O-C-N 119.117 -2.24 . . . . 2.8999999999999999 112.718 170.48 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.4 p -71.2 -33.33 50.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 O-C-N 121.55 -0.718 . . . . 2.4500000000000002 112.432 171.93 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -62.97 -51.72 65.78 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.197 0.908 . . . . 1.98 110.833 174.611 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 92.2 mt -53.51 -37.65 62.97 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.069 0.948 . . . . 1.79 111.687 174.678 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 55.1 m -74.26 -39.33 63.08 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.42 1.088 . . . . 1.6299999999999999 113.205 179.315 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.1 mtm -64.05 -44.97 90.87 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.491 1.041 . . . . 2.1600000000000001 110.95 172.837 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 71.6 mt -63.31 -46.09 88.32 Favored 'General case' 0 CA--C 1.528 0.098 0 CA-C-O 118.495 -0.764 . . . . 2.0099999999999998 112.176 178.191 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.9 p -59.71 -34.61 73.12 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.793 1.179 . . . . 3.98 112.655 178.834 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 20.9 mtp -72.34 -30.73 65.01 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.519 1.303 . . . . 2.48 114.519 173.002 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.27 -33.26 74.93 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 120.62 1.555 . . . . 1.28 111.536 171.543 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -73.07 -26.54 61.3 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.723 1.008 . . . . 2.8500000000000001 113.723 173.773 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -55.44 -53.8 51.81 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.93 1.241 . . . . 3.0600000000000001 110.213 166.008 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.17 -31.94 72.69 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.367 1.067 . . . . 3.6200000000000001 113.082 -175.861 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.0 -40.89 99.15 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.814 1.246 . . . . 2.5299999999999998 112.186 170.837 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -74.45 -30.3 61.83 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.331 1.452 . . . . 3.2200000000000002 112.134 176.563 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 34.9 mt -66.84 -30.1 70.2 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 117.289 -1.339 . . . . 2.6299999999999999 113.589 179.915 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -83.21 -6.31 59.43 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 114.363 1.246 . . . . 4.1699999999999999 114.363 174.834 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -92.92 -53.39 4.17 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.663 0.785 . . . . 4.5499999999999998 110.897 169.141 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -75.84 12.84 0.96 Allowed 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.798 1.407 . . . . 4.0599999999999996 114.798 -168.296 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.937 0 C-N-CA 128.978 2.911 . . . . 5.1900000000000004 113.334 179.71 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.3 mp0 . . . . . 0 CA--C 1.54 0.577 0 CA-C-O 120.04 -0.028 . . . . 4.4800000000000004 110.953 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -140.72 155.83 69.21 Favored Pre-proline 0 N--CA 1.474 0.753 0 C-N-CA 124.648 1.179 . . . . 2.0 109.352 176.781 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.18 -20.78 27.93 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.434 2.089 . . . . 1.3899999999999999 112.963 -179.066 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 tt -82.68 -41.15 19.71 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.271 1.028 . . . . 2.6099999999999999 110.438 174.482 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.431 ' CD ' ' HZ2' ' A' ' 7' ' ' LYS . 4.0 tm-20 -64.97 -38.69 91.8 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.632 0.73 . . . . 3.73 109.944 175.315 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.483 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -70.57 -34.14 71.87 Favored 'General case' 0 C--O 1.232 0.159 0 O-C-N 120.546 -1.346 . . . . 4.9900000000000002 113.32 176.569 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.82 -47.61 82.13 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.567 0.747 . . . . 1.1000000000000001 111.934 169.23 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.3 mt -64.7 -36.02 82.93 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.463 1.029 . . . . 1.8 112.857 173.406 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 57.8 m -61.06 -42.33 98.3 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.995 0.918 . . . . 1.4099999999999999 111.437 172.537 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.5 m -57.93 -34.15 69.57 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.084 1.353 . . . . 1.5800000000000001 111.689 -178.958 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 10.2 mmt -53.65 -65.94 0.48 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.087 1.355 . . . . 3.1699999999999999 111.068 174.355 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.3 m -63.1 -28.39 44.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 CA-C-N 118.792 0.724 . . . . 2.1299999999999999 112.546 -176.162 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.0 m -70.01 -48.24 58.88 Favored 'General case' 0 CA--C 1.502 -0.877 0 C-N-CA 125.618 1.567 . . . . 1.48 112.691 -178.826 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.24 -35.48 48.24 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 117.772 -1.109 . . . . 2.9900000000000002 108.859 177.524 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.4 t80 -53.24 -45.13 68.62 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.994 0.918 . . . . 2.2000000000000002 111.897 -177.168 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.3 m80 -69.38 -11.97 61.27 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.671 1.36 . . . . 2.6400000000000001 114.671 -175.839 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -30.11 66.17 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 120.661 -1.274 . . . . 4.0800000000000001 111.11 170.562 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -102.98 -46.59 4.61 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.922 1.289 . . . . 2.0499999999999998 112.234 -176.888 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.7 p -65.41 -24.3 67.17 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 124.629 1.172 . . . . 2.3100000000000001 113.764 -178.597 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.09 7.42 60.07 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 127.357 2.408 . . . . 1.3100000000000001 115.6 177.607 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -87.26 -102.35 0.07 Allowed 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.053 1.426 . . . . 4.6600000000000001 109.903 170.792 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -66.78 161.99 22.46 Favored 'General case' 0 C--O 1.246 0.889 0 C-N-CA 124.772 1.229 . . . . 4.9800000000000004 113.421 -176.482 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.42 -134.55 51.75 Favored Glycine 0 C--N 1.341 0.816 0 C-N-CA 125.266 1.412 . . . . 1.8999999999999999 111.925 163.759 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.0 t -69.23 151.38 46.37 Favored 'General case' 0 C--O 1.251 1.159 0 CA-C-O 123.26 1.505 . . . . 3.0499999999999998 112.262 163.359 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -73.26 -22.2 60.45 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.989 0.916 . . . . 5.6399999999999997 112.958 171.174 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 28.8 tp -83.55 -11.18 57.71 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.307 1.043 . . . . 3.8399999999999999 112.65 175.748 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.0 p -115.59 154.33 29.61 Favored 'General case' 0 C--O 1.246 0.873 0 C-N-CA 125.981 1.712 . . . . 1.22 112.118 -177.367 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.4 ' HA ' ' OE1' ' A' ' 33' ' ' GLU 0.316 0.3 OUTLIER -121.6 108.18 13.27 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.862 1.06 . . . . 1.8600000000000001 113.862 166.582 . . . . . . . . 4 4 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.0 t -71.77 174.16 7.23 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 124.661 1.184 . . . . 2.48 113.993 174.336 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.446 HH21 ' CG ' ' A' ' 53' ' ' ASP . 19.1 ttt-85 -66.33 8.95 0.18 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 115.75 1.759 . . . . 4.4299999999999997 115.75 -170.181 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.06 -37.92 2.89 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 119.979 -1.7 . . . . 5.2000000000000002 112.381 166.279 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.4 ' OE1' ' HA ' ' A' ' 29' ' ' LEU . 35.7 mt-10 -52.67 -54.55 31.95 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.434 1.016 . . . . 1.54 111.007 165.834 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 22.0 tp -74.66 -32.55 62.28 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.54 0.736 . . . . 2.5499999999999998 112.476 -176.423 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -51.92 -47.85 64.46 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.631 0.651 . . . . 3.5 111.119 171.519 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.513 ' HG3' ' HE2' ' A' ' 40' ' ' LYS . 13.1 tp10 -91.64 4.06 53.58 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.08 1.141 . . . . 4.8099999999999996 114.08 -175.222 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 tt -78.49 -61.93 1.85 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.452 1.101 . . . . 1.8600000000000001 108.849 154.661 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.8 mt -51.32 -44.61 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 125.095 1.358 . . . . 0.89000000000000001 110.65 -178.214 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.02 -20.01 64.91 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.838 1.051 . . . . 3.9700000000000002 113.838 -177.007 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.513 ' HE2' ' HG3' ' A' ' 36' ' ' GLU . 43.2 mttm -102.36 -38.71 7.49 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 124.883 1.273 . . . . 2.75 112.336 179.508 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -58.9 -77.56 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 128.958 2.903 . . . . 4.7300000000000004 109.464 171.29 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.5 mt -81.04 48.2 1.09 Allowed 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.569 -1.332 . . . . 2.6000000000000001 112.798 -179.265 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.37 14.04 0.08 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 125.19 1.396 . . . . 3.21 114.485 176.794 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.429 HD23 ' H ' ' A' ' 44' ' ' LEU . 1.7 pt? -122.69 -3.15 8.77 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.181 2.192 . . . . 3.8300000000000001 114.436 -178.045 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -114.75 -178.99 18.85 Favored Glycine 0 N--CA 1.473 1.154 0 C-N-CA 124.867 1.223 . . . . 3.6000000000000001 114.208 -177.694 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -71.67 34.12 0.06 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 127.906 2.482 . . . . 6.3600000000000003 113.897 -176.359 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -81.46 53.98 2.22 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.668 2.387 . . . . 1.8600000000000001 115.821 -153.478 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.6 tttt -81.85 166.64 19.78 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 128.282 2.633 . . . . 6.0599999999999996 111.259 -179.899 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -45.79 -53.39 9.65 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.31 1.044 . . . . 5.71 113.332 -174.111 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.7 m -70.88 -31.15 67.73 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 113.923 1.082 . . . . 2.3399999999999999 113.923 178.819 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.2 m -65.16 -20.46 66.46 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.908 0.883 . . . . 2.3799999999999999 112.225 171.531 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 59.1 mt -93.8 -30.67 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 126.288 1.835 . . . . 1.22 111.314 174.043 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.446 ' CG ' HH21 ' A' ' 31' ' ' ARG . 5.6 t0 -70.45 -43.54 69.66 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.505 1.122 . . . . 3.1099999999999999 112.316 -178.233 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -69.11 -31.92 70.96 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.141 -0.974 . . . . 3.4500000000000002 111.502 174.431 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.71 -54.66 42.58 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.395 1.078 . . . . 2.7599999999999998 109.482 172.03 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.5 mmm -52.33 -41.14 62.75 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 127.257 2.223 . . . . 2.6699999999999999 112.038 174.403 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -26.94 66.82 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.561 1.545 . . . . 4.3899999999999997 113.043 177.639 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.6 t -92.69 -20.53 20.72 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.346 -1.471 . . . . 2.6600000000000001 113.272 171.97 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.3 -42.37 93.14 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 127.759 2.424 . . . . 2.9700000000000002 111.682 172.159 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -87.2 154.86 20.39 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 115.148 1.536 . . . . 1.96 115.148 -177.051 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -125.76 10.99 7.79 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 126.074 1.75 . . . . 3.0800000000000001 113.805 177.408 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -137.37 -34.94 0.69 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 116.064 1.876 . . . . 2.02 116.064 -162.563 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 75.07 26.95 1.18 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.701 1.601 . . . . 3.0899999999999999 111.551 -161.825 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 39.1 p-10 -93.73 -16.88 23.78 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.482 1.513 . . . . 2.3300000000000001 112.64 -169.84 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 68.78 -0.09 2.49 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.659 2.383 . . . . 4.2699999999999996 115.59 -178.333 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -101.25 140.85 34.98 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 122.244 1.021 . . . . 2.75 110.035 160.546 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 48.6 mm -100.25 113.5 36.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 106.622 -1.622 . . . . 1.1699999999999999 106.622 164.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.66 161.05 28.85 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.903 1.281 . . . . 2.5699999999999998 111.465 172.701 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -58.38 -26.69 63.49 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 115.008 1.485 . . . . 2.3599999999999999 115.008 -176.272 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.2 mtmm -79.82 -32.54 40.68 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.755 -1.215 . . . . 4.1200000000000001 112.397 173.222 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -60.67 -46.97 88.32 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 109.319 -0.623 . . . . 1.8999999999999999 109.319 168.94 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -58.28 -32.41 68.39 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.189 1.796 . . . . 2.3999999999999999 113.856 173.281 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.3 m -61.21 -29.84 70.06 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 119.603 -1.936 . . . . 2.5499999999999998 113.178 168.127 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 43.1 t -73.85 -36.07 44.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 O-C-N 121.127 -0.983 . . . . 2.9300000000000002 110.881 175.926 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -61.94 -51.44 68.09 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 118.911 0.778 . . . . 1.9399999999999999 112.853 170.842 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.4 mt -59.3 -33.29 70.92 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.467 0.707 . . . . 2.0099999999999998 111.578 174.95 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 92.7 m -60.52 -47.48 85.98 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 118.231 -0.89 . . . . 1.1100000000000001 111.346 168.919 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 16.1 mtm -58.08 -44.51 87.62 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 120.118 1.326 . . . . 1.79 112.022 177.441 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.0 mt -71.21 -43.63 66.98 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.546 0.612 . . . . 1.6399999999999999 112.632 -179.189 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 9.9 t -66.09 -26.37 67.44 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.294 -0.878 . . . . 1.51 112.852 175.462 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 76.7 mtp -72.45 -40.11 67.28 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.306 -0.871 . . . . 1.74 112.472 166.03 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.17 -38.5 89.27 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.571 1.078 . . . . 1.3500000000000001 112.757 -178.963 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -65.11 -24.07 67.33 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.839 1.052 . . . . 2.2400000000000002 113.839 171.648 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -70.92 -44.11 66.86 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.3 0.954 . . . . 2.9300000000000002 112.864 179.009 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -60.22 -47.32 86.46 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.766 1.227 . . . . 3.1400000000000001 110.66 170.959 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -50.84 -40.84 56.92 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.907 1.283 . . . . 2.6299999999999999 112.672 176.919 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -70.61 -30.78 67.53 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.001 1.321 . . . . 2.0600000000000001 112.966 179.304 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 60.2 mt -78.55 -20.6 50.3 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.21 1.004 . . . . 1.6100000000000001 112.278 176.612 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -90.01 -6.67 55.34 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.553 1.316 . . . . 3.79 114.553 174.487 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 21.5 t70 . . . . . 0 N--CA 1.472 0.647 0 C-N-CA 126.359 1.863 . . . . 2.8100000000000001 112.946 178.63 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.473 0.691 0 CA-C-O 118.751 -0.642 . . . . 2.46 110.727 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -62.54 -18.84 65.63 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 122.961 2.441 . . . . 1.3 114.089 175.869 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.7 -54.65 6.36 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.93 1.241 . . . . 2.6000000000000001 111.169 179.49 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -62.88 -30.97 71.92 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.931 0.787 . . . . 4.7599999999999998 110.657 174.482 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -62.98 -45.78 90.81 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 119.927 -1.733 . . . . 7.8399999999999999 111.471 166.512 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.5 -50.62 73.1 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.426 1.09 . . . . 0.90000000000000002 111.1 177.566 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 70.5 mt -56.99 -47.04 81.74 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.493 1.117 . . . . 1.52 111.704 172.696 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 96.9 m -56.53 -44.38 80.76 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.488 0.715 . . . . 1.4199999999999999 111.362 175.222 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 91.8 m -63.69 -44.56 93.32 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.406 1.482 . . . . 1.4099999999999999 109.842 179.336 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 79.7 mtp -57.13 -51.36 69.62 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.561 0.744 . . . . 3.0699999999999998 110.617 174.376 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 53.2 t -63.39 -30.45 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 N-CA-C 113.367 0.877 . . . . 1.8400000000000001 113.367 176.422 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 82.4 m -62.79 -52.6 62.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.877 1.271 . . . . 0.89000000000000001 110.246 174.717 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -31.78 69.37 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 118.545 -0.741 . . . . 1.6499999999999999 111.311 169.636 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -69.06 -58.41 4.13 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 118.642 0.655 . . . . 2.1000000000000001 111.942 -175.398 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 6.5 m170 -73.53 -12.31 60.73 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 120.307 1.412 . . . . 2.3799999999999999 114.281 177.287 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -67.51 -66.92 0.5 Allowed 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.247 -0.908 . . . . 4.2800000000000002 111.626 157.702 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -70.93 -32.53 69.46 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.73 1.011 . . . . 2.1299999999999999 113.73 -172.517 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 8.2 p -65.1 -18.32 65.2 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 120.477 -1.389 . . . . 2.0699999999999998 112.225 169.301 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.64 9.25 77.45 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 126.048 1.785 . . . . 1.74 114.777 171.058 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -72.72 -24.22 60.96 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.597 1.698 . . . . 3.9199999999999999 112.304 174.262 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -161.4 152.67 18.67 Favored 'General case' 0 C--O 1.252 1.214 0 C-N-CA 125.415 1.486 . . . . 3.3399999999999999 111.91 179.494 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.84 -131.34 52.0 Favored Glycine 0 C--N 1.339 0.697 0 C-N-CA 126.013 1.768 . . . . 2.7400000000000002 111.061 168.018 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.5 m -57.65 125.49 23.16 Favored 'General case' 0 C--O 1.248 1.025 0 O-C-N 122.139 -0.624 . . . . 3.1800000000000002 110.246 166.34 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -74.83 66.86 1.56 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.997 2.119 . . . . 8.0899999999999999 109.667 158.226 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 63.8 tp -167.97 -53.88 0.02 OUTLIER 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 127.526 2.33 . . . . 2.7200000000000002 107.728 -176.54 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 60.7 p -94.84 158.1 15.64 Favored 'General case' 0 C--O 1.252 1.196 0 C-N-CA 125.752 1.621 . . . . 1.23 112.911 176.429 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -103.82 116.8 32.95 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 127.05 2.14 . . . . 2.6499999999999999 109.701 169.112 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 3.0 p -74.34 165.98 24.26 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.141 0.576 . . . . 2.3900000000000001 111.602 164.674 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 15.8 tpp180 -41.49 -33.01 0.38 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.517 1.927 . . . . 4.7000000000000002 113.778 167.98 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.61 -40.11 12.81 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 120.698 -1.251 . . . . 4.4900000000000002 113.753 -179.353 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -56.84 -44.08 81.75 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.45 0.643 . . . . 2.02 110.457 170.564 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 tp -66.75 -44.31 81.81 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.35 1.06 . . . . 2.0600000000000001 112.138 -179.498 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -57.38 -37.25 72.36 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.804 1.242 . . . . 2.9399999999999999 113.175 178.631 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -62.96 -65.76 0.64 Allowed 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 117.839 -1.077 . . . . 3.75 111.087 168.831 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 tp -48.06 -57.31 5.98 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 127.779 2.432 . . . . 2.2200000000000002 112.024 -175.107 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 34.9 mt -56.17 -56.87 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.065 0.848 . . . . 1.29 110.135 -177.395 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -24.02 66.13 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.632 0.773 . . . . 5.4299999999999997 112.446 -174.111 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.95 -31.84 12.89 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.092 1.757 . . . . 6.21 112.835 -173.586 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.6 mm-40 -97.04 -21.22 17.51 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 119.407 1.003 . . . . 5.25 112.712 176.924 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -113.31 118.27 34.15 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 119.712 1.142 . . . . 2.2000000000000002 108.488 171.755 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 15.7 p -139.55 10.73 2.49 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.756 1.222 . . . . 3.2400000000000002 113.623 -175.103 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -68.92 -42.9 76.18 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.615 1.566 . . . . 3.2000000000000002 111.088 -177.265 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -96.88 165.4 23.13 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 110.211 -1.156 . . . . 3.0800000000000001 110.211 156.475 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.91 96.88 0.45 Allowed 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.899 -1.149 . . . . 5.4800000000000004 107.899 165.891 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 8.0 tpt -72.27 75.93 0.99 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.396 1.879 . . . . 2.8500000000000001 112.263 -168.088 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.44 ' H ' ' HE2' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -83.49 163.73 20.29 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.731 1.613 . . . . 3.8100000000000001 114.45 -161.669 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -47.82 -59.95 2.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.775 1.63 . . . . 5.0 112.057 177.839 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 13.1 m -71.77 6.09 2.17 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 115.179 1.548 . . . . 2.6000000000000001 115.179 178.973 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 34.3 p -119.83 16.73 12.67 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.768 -1.208 . . . . 2.79 112.554 163.708 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 35.1 mt -110.42 -47.64 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.018 0.927 . . . . 1.55 111.976 171.691 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -71.89 -30.43 65.38 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.996 1.271 . . . . 3.0699999999999998 113.255 -173.386 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -65.52 -37.05 85.64 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.924 0.784 . . . . 2.4199999999999999 111.5 167.56 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 10.0 tt -60.93 -43.54 98.49 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 117.73 -1.129 . . . . 2.6200000000000001 110.097 176.092 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 6.3 ttt -59.34 -50.55 73.55 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 120.099 1.318 . . . . 1.8700000000000001 113.276 170.632 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.0 tmtt? -52.49 -33.32 44.25 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.71 1.204 . . . . 4.2699999999999996 112.195 173.272 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 63.3 m -86.58 -22.94 25.98 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.758 1.623 . . . . 2.5299999999999998 113.532 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 9.5 mt -70.16 -42.18 72.84 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 120.159 1.345 . . . . 1.9199999999999999 110.877 169.386 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.71 141.53 43.58 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.235 1.414 . . . . 2.6400000000000001 113.093 -179.929 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 33.9 mmtm -124.21 -1.06 8.23 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.69 1.196 . . . . 3.23 113.066 172.432 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 31.4 p-10 -113.47 -48.84 2.92 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.642 1.977 . . . . 2.4199999999999999 111.125 167.345 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 5.0 t 94.62 111.12 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 129.399 3.08 . . . . 2.3500000000000001 107.879 -167.29 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 p30 -155.69 -135.46 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 122.037 0.922 . . . . 3.0800000000000001 109.0 -173.475 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -140.58 5.63 2.02 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 114.544 1.313 . . . . 5.1299999999999999 114.544 175.856 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -132.32 136.89 47.19 Favored 'General case' 0 C--O 1.246 0.898 0 C-N-CA 127.393 2.277 . . . . 3.5099999999999998 111.998 -174.306 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 31.8 mm -108.71 122.27 63.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 126.08 1.752 . . . . 1.3 108.456 169.186 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -98.44 -174.48 2.83 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.594 1.957 . . . . 3.0699999999999998 110.994 169.239 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -25.11 65.31 Favored 'General case' 0 CA--C 1.551 0.985 0 O-C-N 120.456 -1.402 . . . . 2.8199999999999998 114.374 177.456 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -71.65 -46.68 58.26 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.436 -1.415 . . . . 5.9299999999999997 112.079 174.137 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -63.11 -48.73 77.31 Favored 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 118.829 0.741 . . . . 1.77 110.177 171.329 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -59.48 -23.43 62.74 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 120.029 -1.669 . . . . 1.96 114.33 -179.33 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 41.4 t -53.01 -35.18 59.12 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.612 -1.305 . . . . 2.3199999999999998 111.904 167.887 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 59.7 t -64.63 -40.54 89.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 CA-C-N 119.181 0.9 . . . . 1.6799999999999999 111.357 178.383 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -62.94 -50.98 68.67 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.881 0.873 . . . . 1.6399999999999999 111.26 176.867 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.9 -43.81 98.02 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.167 0.987 . . . . 1.55 110.961 178.546 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 95.0 m -60.93 -52.12 66.37 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.909 1.284 . . . . 0.93999999999999995 112.07 177.841 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 30.6 ttp -61.06 -41.16 96.09 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.097 0.959 . . . . 2.2599999999999998 111.93 -175.22 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 98.0 mt -72.45 -45.3 60.2 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 123.796 0.838 . . . . 1.75 112.219 175.784 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.4 t -67.19 -28.46 68.11 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.111 0.869 . . . . 1.54 112.998 -177.99 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -50.01 71.48 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.013 0.824 . . . . 3.6899999999999999 111.338 166.63 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.9 -30.56 70.24 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.742 0.701 . . . . 0.87 112.865 -178.71 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -74.64 -24.73 58.88 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.768 1.025 . . . . 2.2999999999999998 113.768 172.282 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -78.59 -42.26 29.54 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.069 0.948 . . . . 2.7000000000000002 111.537 172.725 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -60.8 -35.89 77.62 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.664 0.786 . . . . 3.8100000000000001 110.703 171.589 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -57.24 -46.33 83.09 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.185 0.994 . . . . 2.79 112.203 171.527 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -65.5 -34.95 79.47 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.503 1.121 . . . . 2.3100000000000001 112.217 -179.057 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 98.0 mt -69.58 -30.98 68.87 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.776 0.83 . . . . 1.6699999999999999 112.816 175.749 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -89.31 -6.44 56.71 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 114.498 1.295 . . . . 4.5199999999999996 114.498 178.656 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -93.54 -50.01 5.62 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.395 1.478 . . . . 3.0800000000000001 112.142 170.852 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.73 44.26 0.72 Allowed 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 123.09 1.424 . . . . 2.79 112.963 -178.303 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm . . . . . 0 C--O 1.25 1.116 0 C-N-CA 129.7 3.2 . . . . 4.3600000000000003 115.234 171.399 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 . . . . . 0 CA--C 1.539 0.532 0 N-CA-C 107.844 -1.169 . . . . 4.1399999999999997 107.844 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.4 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 46.3 p -120.21 174.75 2.69 Favored Pre-proline 0 N--CA 1.469 0.522 0 C-N-CA 124.052 0.941 . . . . 1.72 113.372 -153.703 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.4 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 90.8 Cg_endo -75.11 -29.52 7.97 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 121.659 1.572 . . . . 1.8600000000000001 111.485 159.222 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.0 tp -77.17 -53.77 7.34 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.318 0.963 . . . . 3.1499999999999999 113.064 -170.816 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -71.03 -26.82 63.27 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.876 1.217 . . . . 5.6200000000000001 111.068 -177.874 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -60.58 -40.99 93.75 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.122 -0.986 . . . . 4.7300000000000004 111.67 164.38 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.97 -31.11 61.38 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.048 0.939 . . . . 0.97999999999999998 112.148 176.421 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.5 mt -66.36 -42.57 87.85 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.012 1.278 . . . . 1.51 111.587 168.018 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 91.5 m -60.4 -43.35 96.74 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 121.341 -0.849 . . . . 1.5900000000000001 110.692 172.872 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 51.2 m -60.91 -38.4 85.62 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.205 1.002 . . . . 1.7 111.158 172.065 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 43.1 ttm -62.85 -49.82 73.36 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.56 -1.21 . . . . 3.1099999999999999 111.952 175.764 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.3 m -66.36 -22.4 30.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 CA-C-N 120.804 1.638 . . . . 2.4300000000000002 113.317 174.938 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 60.2 m -67.75 -54.74 16.83 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 117.608 -1.187 . . . . 0.80000000000000004 109.72 173.069 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -52.99 -36.55 60.51 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-N 119.2 0.909 . . . . 2.4399999999999999 111.221 168.753 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -64.42 -44.79 90.12 Favored 'General case' 0 C--O 1.219 -0.503 0 O-C-N 123.849 0.718 . . . . 1.75 111.3 -175.173 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -75.22 -37.28 61.17 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.999 1.272 . . . . 1.9399999999999999 112.895 173.375 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -15.99 17.72 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.121 1.768 . . . . 5.9100000000000001 113.683 175.607 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.483 ' CD2' HD13 ' A' ' 37' ' ' LEU . 90.4 m-85 -121.66 -20.18 6.58 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 116.718 2.118 . . . . 2.25 116.718 162.966 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.7 t -71.44 -23.66 61.88 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 122.462 2.392 . . . . 1.8100000000000001 112.478 172.743 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.8 0.77 89.4 Favored Glycine 0 CA--C 1.535 1.31 0 CA-C-O 118.192 -1.338 . . . . 1.8999999999999999 114.062 166.103 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.4 tpt85 -62.84 -22.86 66.98 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 119.898 1.849 . . . . 5.8099999999999996 112.76 177.525 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -164.03 148.61 10.19 Favored 'General case' 0 C--O 1.252 1.218 0 C-N-CA 127.483 2.313 . . . . 5.0099999999999998 110.447 168.182 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 43.35 -126.55 5.33 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 126.573 2.035 . . . . 2.9100000000000001 114.772 163.185 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.5 m -44.68 137.65 3.79 Favored 'General case' 0 C--O 1.245 0.853 0 C-N-CA 126.686 1.994 . . . . 2.8300000000000001 114.149 178.557 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -110.5 -11.59 14.46 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 127.018 2.127 . . . . 4.2800000000000002 115.586 -163.011 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 28.2 tp -95.89 0.02 51.5 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.095 0.958 . . . . 3.75 111.066 170.259 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.3 p -142.68 156.38 45.03 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 126.14 1.776 . . . . 0.98999999999999999 113.99 -162.174 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.9 mt -111.34 104.58 13.05 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.703 1.201 . . . . 1.52 109.145 171.129 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.1 t -66.25 152.4 44.99 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.4 -0.813 . . . . 1.97 110.683 168.044 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.7 ttp180 -42.51 -29.86 0.31 Allowed 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.926 2.09 . . . . 5.54 115.693 -175.377 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -83.38 -33.17 25.85 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 116.592 2.071 . . . . 7.4400000000000004 116.592 171.479 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -60.81 -43.31 98.37 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.011 0.925 . . . . 1.98 109.948 165.874 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.9 tp -66.94 -45.14 78.72 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.669 0.788 . . . . 2.1800000000000002 112.656 -174.703 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -50.3 -47.29 55.66 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.383 0.992 . . . . 3.4900000000000002 111.44 174.757 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -70.89 -46.0 63.36 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 118.441 -0.79 . . . . 3.0499999999999998 111.615 -174.017 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.483 HD13 ' CD2' ' A' ' 19' ' ' TYR . 29.4 tp -55.47 -52.84 62.3 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.859 1.264 . . . . 2.3199999999999998 112.352 179.824 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 51.3 mt -54.05 -57.57 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 107.866 -1.161 . . . . 1.04 107.866 -178.866 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.16 -16.7 60.5 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.883 1.068 . . . . 4.0099999999999998 113.883 -171.27 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.2 mmtp -81.99 -47.93 12.07 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.984 1.314 . . . . 3.3199999999999998 112.208 177.553 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.511 ' HA ' HG21 ' B' ' 3' ' ' THR . 11.0 mm-40 -101.98 15.23 29.69 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.604 1.162 . . . . 6.04 111.696 -172.23 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.412 HD12 HD22 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -164.83 122.11 1.59 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.217 2.207 . . . . 2.6800000000000002 111.643 173.698 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 48.8 t -71.39 -53.69 13.25 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 114.045 1.128 . . . . 4.7300000000000004 114.045 -179.188 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.412 HD22 HD12 ' A' ' 42' ' ' LEU . 3.9 mm? 61.99 -56.52 0.13 Allowed 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 128.778 2.831 . . . . 5.7199999999999998 113.973 -170.993 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 161.42 26.45 0.02 OUTLIER Glycine 0 CA--C 1.536 1.369 1 C-N-CA 130.818 4.056 . . . . 2.77 110.427 -174.355 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 65.09 132.79 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 128.706 2.802 . . . . 9.4299999999999997 111.458 -157.328 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 41.8 mmm -88.24 129.29 35.4 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.892 0.853 . . . . 2.52 110.335 174.797 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -112.85 159.19 19.28 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.241 1.017 . . . . 4.0899999999999999 110.463 178.417 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -45.2 -46.29 12.17 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 114.673 1.36 . . . . 5.1900000000000004 114.673 -169.928 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -61.46 -7.29 2.96 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 115.588 1.699 . . . . 4.2699999999999996 115.588 179.884 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.3 m -115.44 -12.11 11.75 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.584 1.084 . . . . 2.1200000000000001 113.139 171.935 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 74.7 mt -84.39 -44.72 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 O-C-N 120.692 -1.255 . . . . 2.5600000000000001 112.287 -171.347 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -74.94 -12.68 60.41 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.237 0.458 . . . . 4.2599999999999998 112.237 176.742 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.446 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 1.0 OUTLIER -91.0 -28.75 17.79 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.43 1.092 . . . . 2.6200000000000001 113.383 169.375 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.0 -47.27 81.24 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.573 -0.704 . . . . 2.2200000000000002 109.654 156.925 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 6.4 tpt -56.35 -49.05 75.49 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.659 0.784 . . . . 1.8100000000000001 110.712 176.224 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.446 ' HE2' ' HA ' ' A' ' 54' ' ' ASP . 14.8 mtmm -60.05 -39.12 84.86 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.587 1.085 . . . . 4.3200000000000003 112.916 174.37 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 73.0 m -67.32 -25.04 65.82 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.091 0.774 . . . . 1.8600000000000001 113.091 175.575 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.566 HD12 ' HA ' ' A' ' 72' ' ' TYR . 2.4 mm? -86.67 -40.85 14.71 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.055 1.342 . . . . 2.6400000000000001 113.631 172.069 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -88.73 64.3 7.25 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 114.606 1.336 . . . . 1.9099999999999999 114.606 -156.378 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -47.6 -44.85 26.91 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.568 1.547 . . . . 3.1400000000000001 114.28 -176.258 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . 0.281 0.4 OUTLIER -84.03 2.93 36.8 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 114.008 1.114 . . . . 2.7400000000000002 114.008 -175.159 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 69.2 m 60.14 79.68 0.23 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 127.659 2.384 . . . . 4.21 113.253 168.998 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -158.3 -114.8 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.652 -0.655 . . . . 2.7799999999999998 110.153 -155.105 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -155.4 -10.58 0.12 Allowed 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 116.424 2.009 . . . . 4.8200000000000003 116.424 176.816 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -127.35 146.14 50.56 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.227 1.811 . . . . 2.4300000000000002 109.412 -173.467 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.415 HD12 ' HB3' ' A' ' 59' ' ' LEU . 9.4 mm -106.54 98.44 6.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 125.801 1.641 . . . . 1.22 110.205 176.136 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -67.76 158.08 33.23 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.557 1.143 . . . . 3.2799999999999998 111.973 168.543 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -52.64 -31.38 36.52 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.216 1.561 . . . . 2.6400000000000001 115.216 -176.533 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.469 ' HE3' ' H ' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -76.2 -35.4 59.11 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 120.669 -1.269 . . . . 4.0499999999999998 112.581 175.309 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -62.55 -47.86 82.03 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.118 0.567 . . . . 1.72 109.532 166.433 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.566 ' HA ' HD12 ' A' ' 59' ' ' LEU . 73.8 t80 -60.8 -39.67 89.77 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 127.451 2.3 . . . . 2.3700000000000001 115.219 -170.758 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 38.9 m -53.62 -25.56 18.17 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.629 1.171 . . . . 1.98 114.117 -171.29 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.7 m -69.59 -25.6 29.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 O-C-N 121.017 -1.052 . . . . 2.6000000000000001 113.548 178.351 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.53 ' HB2' HD11 ' A' ' 59' ' ' LEU . 20.4 t80 -62.88 -56.97 12.61 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.519 1.054 . . . . 2.0699999999999998 110.866 -177.82 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.6 mt -65.41 -29.06 69.71 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 118.583 -0.723 . . . . 2.4100000000000001 112.009 176.115 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 66.6 m -60.72 -52.22 66.05 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.792 0.837 . . . . 1.0900000000000001 110.94 170.85 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 77.5 mtm -60.12 -41.69 93.16 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.557 0.743 . . . . 1.6299999999999999 111.65 177.088 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 77.2 mt -67.48 -41.59 84.35 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 118.582 -0.723 . . . . 1.26 112.589 179.4 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 3.7 t -69.66 -28.13 65.62 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.735 1.152 . . . . 2.1499999999999999 113.053 175.329 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 27.2 mtp -65.52 -42.53 91.9 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.295 -0.878 . . . . 2.3300000000000001 112.515 165.896 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.04 -33.94 76.88 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 120.009 1.277 . . . . 0.81999999999999995 113.031 175.962 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -64.58 -24.16 67.5 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.221 -0.925 . . . . 2.5699999999999998 112.8 171.459 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.407 ' ND2' ' HD1' ' B' ' 17' ' ' HIS . 2.0 t-20 -75.51 -35.76 60.7 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.279 -0.888 . . . . 2.7400000000000002 113.0 178.379 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -62.37 -44.66 95.95 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.604 1.162 . . . . 3.9900000000000002 110.839 171.558 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.64 -50.75 62.52 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.048 1.339 . . . . 2.5 111.728 171.673 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -62.78 -33.57 75.46 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.161 0.984 . . . . 2.2799999999999998 111.935 178.711 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 42.6 mt -69.63 -18.61 63.61 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 117.507 -1.235 . . . . 1.5 113.308 178.297 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -91.24 -17.2 26.4 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 114.917 1.451 . . . . 2.7400000000000002 114.917 171.622 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.2 t70 . . . . . 0 N--CA 1.478 0.941 0 C-N-CA 124.663 1.185 . . . . 3.6400000000000001 112.835 -176.13 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' B' B ' 3' ' ' THR . . . . . 0.511 HG21 ' HA ' ' A' ' 41' ' ' GLU . 58.7 p . . . . . 0 N--CA 1.471 0.612 0 N-CA-C 112.24 0.459 . . . . 1.8200000000000001 112.24 . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -62.56 -16.33 51.69 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 122.323 2.015 . . . . 1.52 113.039 165.69 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -80.72 -32.04 35.89 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 117.516 -1.231 . . . . 2.3100000000000001 111.911 173.274 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -50.41 -46.07 56.07 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.194 0.906 . . . . 6.1200000000000001 109.118 159.675 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 7' ' ' LYS . . . . . 0.484 ' HA ' ' CE ' ' B' ' 7' ' ' LYS . 0.2 OUTLIER -77.67 -25.34 49.48 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 114.707 1.373 . . . . 4.0800000000000001 114.707 -177.544 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.38 -46.28 56.02 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.859 0.754 . . . . 1.01 110.959 171.157 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 79.7 mt -68.86 -37.62 79.22 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.248 1.019 . . . . 1.8 111.834 175.568 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 97.2 m -54.22 -56.54 17.27 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 117.831 -1.08 . . . . 2.6800000000000002 108.657 167.098 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 43.9 m -53.18 -49.73 66.06 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.319 0.963 . . . . 1.72 110.527 -179.13 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 37.2 ttm -62.42 -46.17 89.78 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.666 0.786 . . . . 3.0 112.556 -178.146 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 1.8 p -70.25 -26.46 29.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.871 1.214 . . . . 2.6899999999999999 112.691 175.685 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 65.6 m -70.82 -46.03 63.49 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.373 1.469 . . . . 1.1399999999999999 111.736 -177.898 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -64.79 -43.16 94.12 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.86 0.864 . . . . 1.6000000000000001 109.459 169.189 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 29.7 t80 -66.55 -49.75 65.43 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 120.081 -0.648 . . . . 2.0299999999999998 111.417 -168.671 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . 0.407 ' HD1' ' ND2' ' A' ' 84' ' ' ASN . 0.1 OUTLIER -67.94 -3.6 10.4 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 120.689 -1.257 . . . . 2.2799999999999998 114.337 178.086 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.63 -57.9 2.08 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.026 -1.046 . . . . 4.6200000000000001 110.806 171.291 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -61.97 -34.1 75.52 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.303 -0.873 . . . . 1.8 112.717 177.056 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 67.5 m -70.02 -11.99 61.28 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.58 -1.325 . . . . 2.0099999999999998 114.121 171.645 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -94.11 -4.04 63.25 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 125.187 1.375 . . . . 1.3300000000000001 114.451 166.349 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 36.5 tpt85 -64.5 -23.48 67.29 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.138 1.469 . . . . 4.0599999999999996 112.502 176.941 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -151.59 175.52 12.25 Favored 'General case' 0 C--O 1.246 0.879 0 C-N-CA 127.225 2.21 . . . . 4.5700000000000003 108.658 172.08 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -41.31 153.8 0.1 OUTLIER Glycine 0 N--CA 1.474 1.176 0 C-N-CA 126.688 2.089 . . . . 3.46 115.122 -174.022 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 16.3 m 63.26 122.78 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.205 1.402 . . . . 3.5499999999999998 112.613 -179.358 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 23.2 mtpt -81.25 -25.39 36.65 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 114.819 1.414 . . . . 7.54 114.819 -175.063 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.437 ' H ' HD23 ' B' ' 27' ' ' LEU . 1.6 pt? -94.02 6.47 48.42 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.195 0.998 . . . . 3.5099999999999998 113.513 -173.882 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 19.0 p -144.63 154.39 42.76 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 127.159 2.184 . . . . 1.96 111.849 -166.929 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 77.1 mt -107.0 108.54 20.1 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.224 1.41 . . . . 1.79 109.722 167.686 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.42 160.9 4.86 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 120.156 -1.59 . . . . 1.8300000000000001 111.228 161.484 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -43.98 -35.21 1.96 Allowed 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.441 1.097 . . . . 3.8100000000000001 113.921 176.488 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.97 -40.5 39.09 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.245 1.018 . . . . 5.5 113.331 178.623 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -59.17 -42.48 90.91 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.084 0.954 . . . . 2.2400000000000002 109.76 173.282 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tp -66.33 -47.02 74.84 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.265 -0.874 . . . . 2.0099999999999998 111.839 176.032 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -54.73 -54.21 44.88 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 120.354 1.434 . . . . 3.0800000000000001 112.045 176.994 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -41.81 -62.61 0.87 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.262 1.425 . . . . 3.48 112.601 170.66 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 tp -48.93 -62.96 1.24 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.114 1.766 . . . . 2.1000000000000001 110.433 -177.871 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 22.3 mt -62.01 -38.01 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 109.546 -0.539 . . . . 1.8300000000000001 109.546 -171.942 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 51.2 mttm -58.12 -33.24 68.92 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.907 0.706 . . . . 4.9500000000000002 112.907 179.955 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -82.97 -47.69 11.48 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 122.979 0.512 . . . . 4.9299999999999997 111.927 177.835 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -75.63 -55.71 5.4 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 124.335 1.022 . . . . 5.5300000000000002 111.014 -172.598 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -83.01 49.13 1.47 Allowed 'General case' 0 CA--C 1.546 0.814 0 O-C-N 119.679 -1.888 . . . . 2.7000000000000002 110.928 -177.899 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 15.4 t -75.92 16.62 0.39 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.617 1.967 . . . . 4.5999999999999996 114.573 -176.521 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.48 18.05 0.18 Allowed 'General case' 0 N--CA 1.478 0.955 0 O-C-N 120.084 -1.635 . . . . 3.71 115.093 -177.029 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.95 -40.93 1.45 Allowed Glycine 0 CA--C 1.534 1.245 0 C-N-CA 126.172 1.844 . . . . 4.1699999999999999 114.72 -179.526 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -64.27 -22.61 67.01 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.177 1.391 . . . . 5.2699999999999996 113.985 -175.82 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 7.6 tpt -74.85 76.83 2.12 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.759 1.624 . . . . 2.1600000000000001 112.509 -175.866 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 20.2 mttm -62.74 120.73 11.81 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 120.786 -1.196 . . . . 3.9900000000000002 111.029 -170.548 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.67 -34.9 69.87 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.923 1.453 . . . . 3.7999999999999998 114.923 -156.934 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 3.0 m -87.93 -14.68 38.65 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.299 -0.876 . . . . 4.8799999999999999 112.388 -178.442 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 17.9 t -70.48 -10.26 58.71 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.479 -1.388 . . . . 2.5800000000000001 111.979 166.426 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 5.4 mm -65.35 -35.34 75.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 124.191 0.996 . . . . 1.3500000000000001 111.532 172.138 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.78 -39.4 69.97 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.148 0.885 . . . . 3.5 111.821 -176.633 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.29 -30.9 66.82 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.543 0.737 . . . . 4.2999999999999998 112.985 170.895 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 7.8 tt -65.13 -45.83 83.47 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.617 -0.706 . . . . 2.3300000000000001 110.664 166.917 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -56.56 -48.77 76.62 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.576 1.55 . . . . 2.0099999999999998 111.257 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 35.8 mtpt -54.75 -32.79 60.35 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.549 1.54 . . . . 4.4199999999999999 113.782 171.592 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 50.7 m -82.51 -30.21 29.97 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.291 1.037 . . . . 2.52 113.065 178.618 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 19.1 mt -73.66 -36.07 65.31 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.893 0.877 . . . . 2.02 111.988 173.856 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -74.82 74.88 2.12 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 123.178 1.466 . . . . 1.8799999999999999 110.24 -177.892 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.2 tmtm? -61.33 -16.22 43.74 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 114.137 -1.392 . . . . 4.9199999999999999 113.863 -158.424 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 48.1 p-10 -105.89 -14.44 15.21 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 115.777 1.769 . . . . 3.4199999999999999 115.777 172.594 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 40.1 t 56.54 90.88 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.308 1.443 . . . . 4.3600000000000003 113.064 -162.341 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 11.3 p30 -123.91 -79.93 0.62 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.153 1.381 . . . . 3.21 109.864 176.48 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -168.74 -34.77 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 129.77 3.228 . . . . 8.2100000000000009 112.024 177.428 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -129.12 147.22 50.95 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 126.178 1.791 . . . . 2.5699999999999998 110.443 -167.349 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . 0.43 HG22 ' HB2' ' B' ' 72' ' ' TYR . 75.2 mt -97.06 102.36 13.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 121.941 0.877 . . . . 1.3500000000000001 109.105 178.576 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -66.68 152.95 44.39 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.163 1.785 . . . . 3.1400000000000001 108.961 171.752 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -47.65 -41.85 23.14 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.062 1.345 . . . . 2.3799999999999999 113.57 -178.11 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.55 -8.37 59.12 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 115.612 1.708 . . . . 3.4700000000000002 115.612 177.031 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -83.28 -52.29 6.69 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 107.505 -1.295 . . . . 2.1099999999999999 107.505 160.528 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 72' ' ' TYR . . . . . 0.43 ' HB2' HG22 ' B' ' 67' ' ' ILE . 40.5 t80 -52.98 -34.0 53.94 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.584 1.954 . . . . 2.73 114.867 -174.765 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 79.6 p -63.07 -17.64 62.5 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 117.401 -1.285 . . . . 1.95 113.992 174.695 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 92.6 t -56.71 -38.91 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-N 120.837 1.653 . . . . 1.6100000000000001 111.213 168.361 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -60.41 -54.23 48.06 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 118.634 0.652 . . . . 2.04 111.394 172.517 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 69.4 mt -62.8 -37.68 87.69 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 123.784 0.834 . . . . 1.6499999999999999 110.768 -174.63 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 19.1 m -69.37 -43.35 73.75 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.634 1.574 . . . . 1.7 112.532 175.446 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 5.8 mmm -56.47 -46.11 80.57 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 120.191 1.359 . . . . 2.73 111.801 173.101 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 97.3 mt -67.25 -50.72 59.5 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.43 0.692 . . . . 1.6699999999999999 111.365 175.949 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 2.0 t -66.45 -25.58 66.8 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.101 -0.999 . . . . 2.0099999999999998 113.131 -177.151 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 62.7 mtm -73.04 -37.34 66.92 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.156 -0.965 . . . . 3.1099999999999999 112.683 168.36 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.97 -33.87 76.3 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.164 0.893 . . . . 1.0600000000000001 112.049 170.929 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -70.68 -32.85 70.25 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 113.378 0.881 . . . . 2.0600000000000001 113.378 168.381 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -69.74 -42.99 73.21 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.28 0.945 . . . . 3.1899999999999999 112.087 179.845 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -58.04 -46.46 85.3 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.729 1.212 . . . . 3.0299999999999998 112.075 170.818 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.26 -50.67 64.34 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.879 1.272 . . . . 3.8399999999999999 111.424 175.615 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -66.67 -27.71 67.88 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.566 1.546 . . . . 2.4199999999999999 111.336 -177.695 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 34.1 mt -81.16 -9.53 59.78 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 125.414 1.485 . . . . 3.1800000000000002 114.488 177.757 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -87.76 -18.0 30.39 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 120.047 1.294 . . . . 5.5599999999999996 114.168 164.155 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -80.92 -52.92 6.92 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.108 0.963 . . . . 5.0499999999999998 110.821 164.406 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -98.46 28.13 4.34 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.297 1.839 . . . . 5.7999999999999998 113.11 -171.906 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.071 0 C-N-CA 128.272 2.629 . . . . 9.2899999999999991 114.445 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.1 mtt . . . . . 0 N--CA 1.476 0.871 0 N-CA-C 107.361 -1.348 . . . . 7.79 107.361 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -154.5 132.99 12.0 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 106.39 -1.707 . . . . 3.9700000000000002 106.39 -165.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.7 p -71.05 168.07 24.04 Favored Pre-proline 0 N--CA 1.478 0.94 0 C-N-CA 123.379 0.671 . . . . 1.76 112.805 -171.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -61.28 -20.82 69.73 Favored 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 122.484 2.123 . . . . 1.78 113.211 165.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.01 -41.59 42.11 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.637 1.175 . . . . 2.4100000000000001 111.327 173.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -61.08 -36.05 78.59 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.642 -1.286 . . . . 3.8599999999999999 110.741 169.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.9 mttp -69.97 -32.61 70.91 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.723 -1.236 . . . . 3.54 112.749 172.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.05 -53.07 55.71 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.261 1.025 . . . . 0.89000000000000001 111.091 170.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.4 mt -55.31 -43.18 74.64 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.35 1.46 . . . . 1.4399999999999999 111.729 173.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 95.7 m -59.14 -40.95 87.08 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 117.611 -1.185 . . . . 1.6100000000000001 111.678 173.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 29.0 m -66.13 -39.45 89.89 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.397 1.079 . . . . 1.25 110.756 176.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 61.1 mtp -64.19 -40.42 96.06 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.89 1.276 . . . . 3.1299999999999999 111.691 174.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.35 -33.19 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 123.493 0.717 . . . . 1.8999999999999999 112.291 167.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 94.0 m -71.15 -58.21 3.77 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 117.677 -1.154 . . . . 1.02 110.464 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.3 p -65.09 -31.49 72.73 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 118.164 -0.922 . . . . 2.0600000000000001 110.271 178.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -67.32 -64.56 0.83 Allowed 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 119.288 -0.965 . . . . 1.9399999999999999 110.508 176.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.47 -39.62 84.3 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 120.12 1.327 . . . . 2.2799999999999998 112.462 -176.243 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -60.1 -51.45 69.55 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.766 -1.209 . . . . 3.8799999999999999 112.345 176.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -78.24 -24.34 47.01 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.002 -1.061 . . . . 2.0499999999999998 112.185 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.6 t -68.67 -19.04 64.38 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 126.466 1.906 . . . . 1.8999999999999999 112.715 173.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.84 2.47 87.18 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 126.057 1.789 . . . . 1.3 115.393 167.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.34 -26.01 61.76 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 120.415 2.108 . . . . 4.25 113.192 176.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -167.21 177.94 5.89 Favored 'General case' 0 C--O 1.245 0.848 0 C-N-CA 125.776 1.63 . . . . 4.1299999999999999 111.129 -172.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.77 -141.5 44.73 Favored Glycine 0 N--CA 1.468 0.831 0 C-N-CA 124.216 0.912 . . . . 1.8799999999999999 111.951 170.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.1 t -73.97 157.33 36.38 Favored 'General case' 0 CA--C 1.551 1.013 0 O-C-N 121.558 -0.966 . . . . 3.21 111.979 159.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -71.48 -12.81 61.58 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 127.009 2.124 . . . . 4.9299999999999997 112.952 173.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.8 mt -101.57 -11.5 19.2 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.126 1.37 . . . . 3.5899999999999999 112.96 176.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.9 p -111.04 144.22 40.5 Favored 'General case' 0 C--O 1.248 1.002 0 C-N-CA 125.089 1.355 . . . . 0.97999999999999998 112.86 176.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.8 mt -95.08 104.94 16.82 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.324 1.05 . . . . 1.6399999999999999 109.396 161.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.6 p -57.33 162.09 2.97 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 120.684 -1.26 . . . . 2.48 111.223 168.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -50.55 -25.42 4.07 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 120.133 -1.604 . . . . 3.1499999999999999 114.267 174.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.87 -45.42 18.68 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.105 0.962 . . . . 4.5800000000000001 113.212 171.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -62.48 -41.64 98.93 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.888 0.875 . . . . 1.4299999999999999 110.947 175.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.2 tp -66.14 -46.65 76.74 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.176 0.591 . . . . 1.8799999999999999 110.09 176.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 15.4 ttmt -61.81 -46.14 90.79 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.054 0.843 . . . . 3.6200000000000001 111.803 178.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -45.05 -59.87 2.38 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 117.406 -1.283 . . . . 3.6299999999999999 111.84 165.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.0 -54.14 49.54 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.974 1.261 . . . . 1.73 112.407 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.7 mt -56.25 -42.66 74.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 119.592 1.087 . . . . 1.04 109.509 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 26.1 mmmt -64.87 -14.41 59.48 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 113.524 0.935 . . . . 3.6099999999999999 113.524 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 32.2 mmtm -102.22 -38.28 7.74 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.988 1.267 . . . . 3.6699999999999999 113.726 169.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -82.99 -31.62 27.41 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.534 1.534 . . . . 3.6800000000000002 112.472 -166.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -117.34 94.71 4.66 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.574 1.149 . . . . 2.6499999999999999 109.19 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.4 t -79.11 -6.25 56.02 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 115.048 1.499 . . . . 3.3700000000000001 115.048 -166.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.31 33.77 0.08 Allowed 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 117.65 2.463 . . . . 3.8199999999999998 117.65 -161.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.78 -46.88 2.69 Favored Glycine 0 N--CA 1.477 1.383 0 C-N-CA 125.469 1.509 . . . . 3.04 115.407 166.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.427 ' CD ' ' HZ3' ' A' ' 48' ' ' LYS . 38.0 mm-40 -86.07 7.23 25.5 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.357 1.243 . . . . 5.2400000000000002 114.357 -176.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.7 66.2 0.73 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 124.677 2.179 . . . . 2.8700000000000001 111.001 163.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.427 ' HZ3' ' CD ' ' A' ' 46' ' ' GLU . 60.7 mttp -101.4 165.55 11.2 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 128.363 2.665 . . . . 4.3499999999999996 110.839 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -62.8 -45.47 92.48 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 115.193 1.553 . . . . 3.7400000000000002 115.193 -160.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.3 t -73.83 -28.67 61.73 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 117.91 -1.043 . . . . 2.8700000000000001 113.3 172.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.77 -38.69 79.04 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.548 1.522 . . . . 2.2999999999999998 110.61 170.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 65.3 mt -81.85 -39.22 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 124.875 1.27 . . . . 1.3400000000000001 112.73 -176.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -76.71 -26.87 55.17 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 118.99 0.814 . . . . 3.3500000000000001 112.787 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -78.6 -38.69 39.39 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.116 0.871 . . . . 2.25 112.208 168.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 39.3 tp -55.03 -54.06 47.91 Favored 'General case' 0 C--N 1.344 0.362 0 O-C-N 121.462 -0.774 . . . . 1.72 109.964 168.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 8.9 tpt -48.61 -49.45 36.96 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.706 2.002 . . . . 1.8300000000000001 111.913 176.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.58 -25.6 60.24 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.037 1.335 . . . . 3.77 113.66 176.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.7 t -96.3 -25.87 15.6 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.941 1.297 . . . . 1.9099999999999999 113.788 177.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.1 mt -73.37 -41.93 62.8 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.154 0.981 . . . . 2.0299999999999998 111.565 173.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -69.32 149.74 48.11 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.495 0.718 . . . . 1.6899999999999999 112.053 176.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.19 -10.14 19.86 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 120.954 -1.091 . . . . 3.1499999999999999 113.791 -176.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -148.52 -10.84 0.35 Allowed 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.962 1.467 . . . . 2.6099999999999999 114.962 -165.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.0 t 79.66 18.95 0.7 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.625 2.37 . . . . 3.1800000000000002 113.315 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.3 p30 -65.05 -24.3 67.43 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.331 1.452 . . . . 2.2400000000000002 110.928 -178.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 63.84 22.23 12.95 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 130.701 3.6 . . . . 4.3899999999999997 114.211 -172.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -115.78 121.35 42.18 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 128.907 2.883 . . . . 2.6099999999999999 107.304 164.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 14.1 mm -93.03 105.02 16.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 124.998 1.319 . . . . 1.03 109.037 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.23 158.13 36.41 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.894 2.078 . . . . 2.52 111.379 167.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -54.82 -34.0 62.27 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.982 -1.074 . . . . 1.8999999999999999 113.704 -175.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm -78.88 -27.31 43.99 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 120.781 -1.199 . . . . 2.96 112.347 177.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -64.82 -53.02 53.42 Favored 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 108.307 -0.997 . . . . 1.77 108.307 163.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -55.57 -31.38 62.14 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 119.866 -1.771 . . . . 2.0600000000000001 114.349 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.53 -24.04 63.34 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 119.543 -1.973 . . . . 1.6299999999999999 114.28 172.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 49.0 t -63.81 -41.33 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 CA-C-N 119.067 0.849 . . . . 1.8600000000000001 110.153 172.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -61.26 -51.83 67.29 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.036 0.934 . . . . 1.9199999999999999 111.116 176.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.8 mt -59.3 -38.11 79.42 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.894 1.278 . . . . 2.3199999999999998 112.204 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 83.2 m -59.87 -55.79 29.75 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.803 0.841 . . . . 0.95999999999999996 110.545 175.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 75.0 mtm -61.44 -40.27 93.85 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 111.951 0.352 . . . . 1.3700000000000001 111.951 -176.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 89.0 mt -69.15 -37.0 78.02 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.281 0.845 . . . . 1.6100000000000001 113.281 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 5.7 t -73.94 -31.53 63.09 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.134 0.879 . . . . 1.78 112.979 176.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 49.1 mtp -67.65 -42.76 81.72 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.319 0.509 . . . . 1.8300000000000001 111.652 167.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.07 -41.1 91.18 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.071 -1.018 . . . . 1.03 112.621 -175.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -68.4 -26.94 65.8 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 113.12 0.785 . . . . 2.3700000000000001 113.12 174.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -67.88 -43.5 79.23 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 120.231 1.378 . . . . 1.6899999999999999 112.734 169.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -71.26 -28.8 64.41 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.731 0.813 . . . . 4.1100000000000003 110.973 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.46 -51.01 70.48 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.855 1.262 . . . . 1.8600000000000001 111.652 164.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 35.3 t80 -60.14 -33.43 72.15 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.104 1.362 . . . . 2.3500000000000001 112.316 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 41.1 mt -68.02 -20.28 64.98 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.859 1.264 . . . . 1.54 113.87 173.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.507 ' CD ' ' HZ2' ' A' ' 92' ' ' LYS . 25.1 mm-40 -101.11 -9.95 20.9 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.632 1.173 . . . . 2.6400000000000001 114.09 176.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -109.75 -47.41 3.36 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.163 1.385 . . . . 2.7200000000000002 113.079 -173.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -82.6 10.05 8.19 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.912 0.885 . . . . 3.02 113.217 -179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.507 ' HZ2' ' CD ' ' A' ' 89' ' ' GLU . 15.0 pttm . . . . . 0 C--O 1.249 1.072 0 CA-C-O 115.482 -2.199 . . . . 3.4500000000000002 116.274 -174.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.822 0 N-CA-C 107.624 -1.25 . . . . 6.1900000000000004 107.624 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -144.44 140.36 28.92 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 125.84 1.656 . . . . 4.7699999999999996 106.818 -169.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 59.1 p -74.6 166.69 42.98 Favored Pre-proline 0 N--CA 1.473 0.71 0 C-N-CA 124.971 1.308 . . . . 1.97 113.519 -167.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.69 -21.51 69.72 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.579 2.186 . . . . 1.45 112.967 167.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.57 -44.11 36.03 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 119.397 0.999 . . . . 2.5299999999999998 110.842 173.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -58.93 -35.07 72.47 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.398 -0.814 . . . . 3.6299999999999999 111.026 170.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -74.94 -27.95 60.4 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 119.869 -1.769 . . . . 3.9199999999999999 113.72 173.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.8 -50.66 61.93 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.373 1.069 . . . . 0.91000000000000003 110.8 169.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 48.0 mt -56.83 -39.73 74.75 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.282 1.433 . . . . 1.53 111.898 169.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 88.0 m -62.39 -43.27 99.22 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 117.918 -1.039 . . . . 1.6599999999999999 111.033 173.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 62.0 m -57.74 -47.85 81.29 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.583 1.083 . . . . 1.3200000000000001 109.896 173.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 61.9 mtp -59.2 -43.41 92.22 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.086 1.354 . . . . 2.9199999999999999 112.826 175.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 32.2 t -64.76 -32.59 58.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 O-C-N 121.009 -1.057 . . . . 1.8200000000000001 112.045 173.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 89.3 m -74.49 -45.23 47.37 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.336 1.455 . . . . 0.87 112.16 -178.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 22.4 p -70.64 -37.86 73.8 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.293 0.637 . . . . 1.53 109.536 173.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -62.66 -66.59 0.52 Allowed 'General case' 0 C--O 1.219 -0.53 0 CA-C-O 117.383 -1.294 . . . . 1.95 109.864 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -59.06 -29.5 67.36 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 121.544 1.975 . . . . 2.4500000000000002 112.653 -173.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -62.17 -56.52 17.9 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.976 -1.078 . . . . 3.6099999999999999 113.455 173.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -81.24 -34.15 32.32 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.422 -0.799 . . . . 2.3500000000000001 112.979 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.5 t -64.76 -20.61 66.45 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 127.535 2.334 . . . . 2.1699999999999999 112.032 174.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.32 -5.44 79.56 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 127.307 2.384 . . . . 1.8600000000000001 116.133 170.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.52 -4.53 50.89 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-N 119.709 1.754 . . . . 3.2599999999999998 114.596 -163.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -165.35 161.6 19.11 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.393 1.477 . . . . 3.6699999999999999 111.843 174.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.13 -131.42 52.04 Favored Glycine 0 N--CA 1.472 1.082 0 O-C-N 120.985 -1.072 . . . . 2.2400000000000002 111.027 173.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 18.9 m -80.88 159.02 25.13 Favored 'General case' 0 CA--C 1.546 0.793 0 O-C-N 121.699 -0.883 . . . . 3.77 111.184 166.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -93.35 -3.3 53.64 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 116.557 2.058 . . . . 6.21 116.557 -167.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 22.9 tp -112.28 16.21 20.1 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.503 1.521 . . . . 3.29 110.625 178.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 23.3 p -148.78 133.1 17.48 Favored 'General case' 0 C--O 1.242 0.702 0 C-N-CA 127.029 2.132 . . . . 1.21 109.545 -161.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 5.7 mt -98.57 96.23 7.82 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.058 1.343 . . . . 1.8899999999999999 112.539 179.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 14.9 t -43.25 152.92 0.11 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.867 2.067 . . . . 2.1400000000000001 112.764 160.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.7 ttp85 -43.13 -27.96 0.25 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.779 1.632 . . . . 3.2999999999999998 113.323 171.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.6 -45.21 11.26 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.577 1.325 . . . . 4.4100000000000001 114.577 172.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -58.73 -38.22 77.87 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.686 1.194 . . . . 1.8999999999999999 111.47 174.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 29.4 tp -72.15 -44.57 62.89 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.862 1.265 . . . . 1.8899999999999999 110.603 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.3 ttmm -67.58 -36.28 80.6 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 120.707 -1.246 . . . . 3.0800000000000001 112.396 -179.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -52.2 -68.01 0.2 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.578 1.551 . . . . 3.4100000000000001 111.619 157.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 tt -52.23 -49.41 64.03 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.67 1.188 . . . . 1.9099999999999999 112.875 -174.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 48.4 mt -58.62 -51.33 73.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 108.461 -0.94 . . . . 1.1399999999999999 108.461 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -72.14 -9.11 57.98 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 112.841 0.682 . . . . 3.7599999999999998 112.841 -175.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -91.28 -37.22 13.42 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.707 1.603 . . . . 3.5099999999999998 113.664 168.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -88.89 -27.24 21.13 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.219 1.408 . . . . 3.9399999999999999 113.885 -175.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -117.46 108.26 15.32 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.588 1.155 . . . . 2.2000000000000002 110.631 -174.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 8.0 t -79.23 3.92 16.49 Favored 'General case' 0 CA--C 1.555 1.15 0 N-CA-C 115.064 1.505 . . . . 3.5499999999999998 115.064 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -61.88 -42.83 99.53 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.83 2.052 . . . . 2.71 115.439 -161.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.23 -23.79 34.13 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 124.672 1.13 . . . . 3.1499999999999999 114.49 -178.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -86.97 9.44 19.45 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 118.743 1.272 . . . . 5.1299999999999999 113.711 167.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.76 57.91 2.66 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 123.896 1.807 . . . . 2.8300000000000001 111.096 165.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -89.56 161.47 16.17 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.733 2.413 . . . . 3.8500000000000001 112.334 -177.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -53.2 -53.17 54.61 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 115.902 1.816 . . . . 3.27 115.902 -166.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 5.2 m -73.01 -28.26 62.26 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 119.767 1.167 . . . . 2.6800000000000002 114.002 178.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 1.2 t -61.72 -42.05 98.44 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.312 0.645 . . . . 2.54 109.779 169.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 47.7 mt -73.82 -35.06 42.06 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.191 0 C-N-CA 124.353 1.061 . . . . 1.45 112.61 176.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.66 -35.67 72.99 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.197 0.908 . . . . 2.8100000000000001 111.408 178.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -69.47 -46.47 66.58 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 119.199 0.909 . . . . 2.5099999999999998 111.425 167.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 51.7 tp -55.88 -49.36 73.58 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.151 0.98 . . . . 2.04 110.628 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.22 -57.8 9.24 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.662 1.185 . . . . 2.1299999999999999 110.12 172.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -25.76 44.87 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.836 1.254 . . . . 3.4500000000000002 113.83 176.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 13.8 m -88.67 -27.42 21.28 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.639 1.976 . . . . 2.75 113.028 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 66.6 mt -78.72 -39.25 36.9 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 125.705 1.602 . . . . 2.02 111.096 174.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -76.27 73.1 3.07 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.872 2.069 . . . . 1.6899999999999999 112.808 -171.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.36 -30.71 0.88 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 125.927 1.691 . . . . 3.2400000000000002 114.614 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -112.95 -4.28 13.94 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.779 2.431 . . . . 1.9099999999999999 114.083 -168.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 8.5 t 65.31 14.94 9.75 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 115.322 1.601 . . . . 2.4500000000000002 115.322 173.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -79.74 -15.83 56.76 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.335 1.454 . . . . 2.3900000000000001 111.651 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 68.0 14.44 9.35 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 128.841 2.857 . . . . 5.0 114.371 174.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -101.21 153.36 19.68 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-O 124.169 1.938 . . . . 2.7599999999999998 110.61 141.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 29.9 mm -99.62 101.41 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 127.477 2.311 . . . . 1.23 108.296 171.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.82 162.52 3.14 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.404 1.482 . . . . 2.5099999999999998 112.143 162.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.61 -36.76 67.3 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.05 -1.031 . . . . 2.21 113.083 -177.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -80.2 -17.66 51.73 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 120.939 -1.101 . . . . 3.6099999999999999 112.26 178.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -73.92 -44.94 53.46 Favored 'General case' 0 CA--C 1.552 1.046 0 O-C-N 121.156 -0.965 . . . . 1.8 109.233 163.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -62.88 -30.98 71.93 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.871 1.669 . . . . 2.0699999999999998 112.969 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 85.9 p -63.68 -24.39 67.76 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 119.973 -1.705 . . . . 1.96 113.433 172.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 24.4 t -67.26 -36.13 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 CA-C-N 119.561 1.073 . . . . 1.55 110.984 174.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -63.22 -53.13 57.97 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.836 0.854 . . . . 1.72 110.916 173.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 83.7 mt -57.74 -36.54 72.22 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.217 1.007 . . . . 1.5700000000000001 111.945 177.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 93.1 m -62.4 -54.06 45.83 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.894 1.278 . . . . 0.81000000000000005 111.538 175.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.2 mtm -58.41 -39.42 79.68 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 118.164 0.438 . . . . 1.45 111.662 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 94.3 mt -69.92 -45.25 67.95 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.669 -0.682 . . . . 1.6799999999999999 112.297 177.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 87.1 m -64.24 -32.46 74.06 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.672 1.124 . . . . 1.8700000000000001 113.205 176.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 52.6 mtp -71.24 -38.86 71.94 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.977 0.808 . . . . 2.1200000000000001 112.522 168.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.9 -36.78 75.68 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.084 1.311 . . . . 0.95999999999999996 112.955 -177.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -75.35 -26.15 58.34 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.787 -0.571 . . . . 2.6099999999999999 111.824 176.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -66.08 -42.99 88.63 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.793 0.837 . . . . 1.9199999999999999 112.267 166.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -71.17 -26.99 63.21 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.142 0.577 . . . . 3.7200000000000002 111.408 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -54.76 35.57 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.511 1.524 . . . . 2.21 112.266 162.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -59.48 -27.73 66.39 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.592 1.957 . . . . 2.1099999999999999 112.556 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 16.8 mt -72.38 -11.48 60.71 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 126.163 1.785 . . . . 1.8300000000000001 114.446 176.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -96.38 -3.93 42.8 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 113.625 0.972 . . . . 3.8999999999999999 113.625 170.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -117.43 -65.1 1.22 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.391 1.476 . . . . 3.1899999999999999 110.919 -178.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -87.37 40.47 0.93 Allowed 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 126.932 2.093 . . . . 4.7300000000000004 112.45 173.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp . . . . . 0 C--O 1.251 1.141 0 C-N-CA 129.558 3.143 . . . . 8.0199999999999996 116.493 -169.069 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.6 mtt . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 108.351 -0.981 . . . . 5.7599999999999998 108.351 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -96.58 -26.49 15.22 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 124.223 0.952 . . . . 5.0499999999999998 112.372 -149.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.475 ' HB ' ' H ' ' A' ' 5' ' ' LEU . 40.7 p -158.7 161.59 28.09 Favored Pre-proline 0 CA--C 1.534 0.338 0 C-N-CA 127.527 2.331 . . . . 2.3799999999999999 109.968 -176.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -70.74 -8.71 24.23 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.708 2.272 . . . . 1.8600000000000001 112.188 157.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.475 ' H ' ' HB ' ' A' ' 3' ' ' THR . 0.3 OUTLIER -73.32 -47.4 42.94 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.751 2.02 . . . . 2.6099999999999999 110.247 179.963 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.32 -40.61 71.37 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.066 0.848 . . . . 3.3399999999999999 111.199 167.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.9 mtpt -67.87 -28.15 67.29 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 119.829 -1.794 . . . . 5.6699999999999999 114.113 173.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.83 -50.6 19.67 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.471 1.108 . . . . 1.03 110.653 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.0 mt -56.04 -50.6 70.48 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.862 1.265 . . . . 1.78 110.497 175.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 32.5 p -65.89 -39.65 90.85 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 116.845 -1.55 . . . . 2.2400000000000002 112.398 178.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 50.0 m -57.55 -45.75 84.75 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 120.603 1.547 . . . . 1.5 109.949 172.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 12.8 ttp -66.85 -45.11 79.21 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.444 1.098 . . . . 2.9500000000000002 112.126 -175.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -60.13 -41.62 87.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 124.799 1.24 . . . . 2.2599999999999998 112.023 171.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 90.4 m -61.43 -52.05 66.17 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.218 1.007 . . . . 1.03 111.333 177.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.46 -36.93 67.1 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 119.148 -0.453 . . . . 2.1200000000000001 111.302 170.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -64.02 -37.51 87.7 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 120.81 -0.356 . . . . 2.0499999999999998 111.708 -177.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.3 m-70 -62.29 -50.26 72.37 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.098 0.863 . . . . 4.5300000000000002 111.718 170.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.424 ' HE2' ' CE1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -60.75 -38.65 85.93 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.423 0.689 . . . . 6.75 112.842 -176.719 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.424 ' CE1' ' HE2' ' A' ' 18' ' ' LYS . 49.2 m-85 -76.58 -43.87 36.94 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.79 0.836 . . . . 3.21 111.303 172.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.0 t -64.43 -38.73 92.06 Favored 'General case' 0 C--O 1.241 0.635 0 O-C-N 119.936 -1.727 . . . . 2.2000000000000002 113.244 -176.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.36 3.59 86.49 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 126.178 1.847 . . . . 1.6899999999999999 115.325 -175.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.09 -43.23 61.03 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.464 1.505 . . . . 5.2599999999999998 113.958 175.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 178.29 -138.3 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 129.28 3.032 . . . . 3.77 107.116 -173.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -11.6 99.06 0.01 OUTLIER Glycine 0 N--CA 1.475 1.263 0 C-N-CA 127.939 2.685 . . . . 3.7599999999999998 114.284 -174.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.2 t 57.4 163.4 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 116.357 1.984 . . . . 2.7200000000000002 116.357 175.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -137.68 134.71 35.72 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.429 1.891 . . . . 4.9900000000000002 110.532 -171.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 92.9 mt 92.34 -9.08 0.2 Allowed 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 130.135 3.374 . . . . 3.5800000000000001 111.042 -158.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.1 p -132.49 152.16 51.64 Favored 'General case' 0 C--O 1.249 1.035 0 C-N-CA 127.68 2.392 . . . . 1.6699999999999999 114.021 -176.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 10.8 mt -104.62 103.63 13.32 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.163 1.385 . . . . 1.9399999999999999 109.638 172.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.4 t -72.88 150.92 42.22 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 120.395 -1.441 . . . . 2.27 111.017 168.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -40.61 -45.31 2.3 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 116.444 2.016 . . . . 3.2799999999999998 116.444 -165.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.45 -31.45 69.77 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.178 -1.576 . . . . 4.2000000000000002 114.022 177.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -68.52 -47.07 67.9 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.441 1.897 . . . . 2.0299999999999998 109.812 173.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.1 tp -59.8 -37.85 80.28 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.148 0.579 . . . . 1.98 111.117 175.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.1 ttmt -68.33 -42.63 79.03 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 121.654 -0.654 . . . . 3.2599999999999998 111.845 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -51.24 -44.0 61.61 Favored 'General case' 0 CA--C 1.55 0.956 0 CA-C-N 118.405 0.548 . . . . 5.4100000000000001 112.244 164.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.2 tt -63.23 -64.1 1.0 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.013 0.925 . . . . 2.1200000000000001 111.324 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.3 mt -56.94 -50.08 77.01 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 N-CA-C 108.851 -0.796 . . . . 0.77000000000000002 108.851 -175.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.3 tttt -66.22 -13.17 59.89 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 119.708 1.14 . . . . 4.0 113.941 -176.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -95.88 -32.89 12.43 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 117.914 -1.041 . . . . 3.0699999999999998 113.809 168.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -80.82 -46.82 14.75 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.963 1.705 . . . . 4.2999999999999998 111.554 -178.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 26.6 mt -147.44 80.8 1.51 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.157 1.783 . . . . 3.0299999999999998 110.409 -177.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 43.9 t -91.84 -51.01 5.43 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 120.398 -1.439 . . . . 5.54 111.969 169.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.6 mp 52.53 -143.6 0.69 Allowed 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.94 1.296 . . . . 4.5999999999999996 108.17 -165.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -95.64 10.8 68.72 Favored Glycine 0 CA--C 1.533 1.199 0 O-C-N 121.263 -0.898 . . . . 3.8999999999999999 112.312 157.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -107.32 -55.52 2.33 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 118.166 0.983 . . . . 5.5800000000000001 112.812 -157.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 42.7 tpp -76.59 88.01 3.29 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.337 1.455 . . . . 2.73 110.733 -171.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.8 mttp -87.11 166.97 14.6 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.569 1.548 . . . . 3.96 112.737 -175.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -47.61 -53.17 15.49 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 115.593 1.701 . . . . 4.3700000000000001 115.593 -169.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.3 m -73.98 -26.58 60.54 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.139 0.792 . . . . 3.52 113.139 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.8 m -71.27 -29.79 65.5 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 118.819 0.736 . . . . 2.54 110.829 174.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.4 mt -68.55 -47.78 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.214 1.005 . . . . 1.51 110.676 169.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -71.03 -30.92 67.26 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 112.787 0.662 . . . . 4.0499999999999998 112.787 -176.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -73.9 -37.75 64.57 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.355 -0.841 . . . . 3.1200000000000001 112.229 170.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 64.8 tp -60.84 -40.32 92.37 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-O 117.738 -1.125 . . . . 2.02 111.109 169.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -57.31 -51.51 69.08 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 120.278 1.399 . . . . 1.8100000000000001 110.213 176.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 tttm -50.66 -30.39 13.44 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.228 1.411 . . . . 3.3100000000000001 113.673 168.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.35 -32.36 22.49 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.515 1.126 . . . . 2.0699999999999998 112.205 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.7 mt -67.27 -41.54 85.35 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.091 0.956 . . . . 2.3399999999999999 110.622 173.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -94.47 80.02 3.88 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.93 2.092 . . . . 1.6399999999999999 113.297 -167.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -58.77 -21.6 56.16 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 115.044 1.498 . . . . 3.6699999999999999 115.044 -166.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -106.69 -5.73 18.38 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.201 1.4 . . . . 2.3100000000000001 114.374 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.5 t 58.61 31.16 20.79 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.915 1.286 . . . . 2.6499999999999999 114.215 -175.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.6 p30 -69.68 -14.64 62.91 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.578 1.151 . . . . 2.6000000000000001 111.791 175.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 68.02 8.5 6.54 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 129.861 3.264 . . . . 4.5300000000000002 114.39 -178.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -112.56 120.13 40.52 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 127.092 2.157 . . . . 3.1299999999999999 107.554 172.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 15.4 mm -90.23 101.28 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 123.466 0.707 . . . . 1.1000000000000001 109.256 174.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -48.35 155.42 0.51 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.24 1.016 . . . . 3.5899999999999999 111.955 161.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.459 ' CZ ' ' HB3' ' B' ' 80' ' ' CYS . 0.1 OUTLIER -51.43 -41.85 61.11 Favored 'General case' 0 CA--C 1.548 0.865 0 O-C-N 120.634 -1.291 . . . . 3.1499999999999999 110.982 158.122 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.8 pttm -66.86 -21.08 66.02 Favored 'General case' 0 CA--C 1.552 1.023 0 O-C-N 120.035 -1.666 . . . . 3.8300000000000001 114.781 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -85.39 -48.78 8.69 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.147 1.379 . . . . 2.2799999999999998 110.834 170.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -55.89 -33.8 64.96 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 126.029 1.732 . . . . 2.0299999999999998 112.43 174.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.3 t -58.94 -29.1 66.87 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.542 -1.349 . . . . 2.27 113.333 170.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 19.2 t -69.34 -36.86 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 O-C-N 120.563 -1.335 . . . . 2.1000000000000001 110.407 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.405 ' CZ ' HD11 ' A' ' 79' ' ' LEU . 52.5 t80 -63.32 -51.72 64.87 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.525 1.13 . . . . 2.5299999999999998 111.722 169.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 65.9 mt -58.01 -33.77 69.31 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 118.512 0.596 . . . . 1.7 112.388 176.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 50.0 m -62.41 -54.73 35.95 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.642 1.177 . . . . 0.78000000000000003 110.344 171.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 45.6 mtp -53.27 -45.99 69.08 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.401 1.08 . . . . 1.6499999999999999 112.028 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.405 HD11 ' CZ ' ' A' ' 75' ' ' PHE . 88.8 mt -66.83 -48.83 67.68 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 123.898 0.879 . . . . 1.29 112.211 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 9.0 t -66.76 -34.4 77.74 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.695 -0.628 . . . . 1.6499999999999999 112.406 -178.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 89.9 mtp -64.61 -39.1 93.11 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.289 0.636 . . . . 1.55 112.258 168.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.32 -34.68 78.52 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.669 1.122 . . . . 0.70999999999999996 112.743 177.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -63.42 -23.18 67.29 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 113.357 0.873 . . . . 2.54 113.357 170.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.65 -40.45 88.69 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 119.923 1.238 . . . . 2.25 112.472 170.081 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -71.58 -39.24 70.71 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.681 0.792 . . . . 3.1400000000000001 110.825 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.2 -43.35 67.12 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.25 1.42 . . . . 1.98 112.287 170.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -67.76 -27.46 66.79 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.234 1.414 . . . . 2.5800000000000001 112.971 177.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.3 mt -74.31 -15.49 60.96 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 113.454 0.909 . . . . 2.0800000000000001 113.454 172.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.517 ' CD ' ' HZ2' ' A' ' 92' ' ' LYS . 13.0 mm-40 -95.07 -4.84 45.64 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.873 1.269 . . . . 4.5300000000000002 114.394 173.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -97.95 -51.18 4.14 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.131 1.372 . . . . 3.77 111.805 175.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -77.58 9.6 3.24 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.036 1.334 . . . . 2.7400000000000002 114.597 -174.155 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.517 ' HZ2' ' CD ' ' A' ' 89' ' ' GLU . 15.2 pttm . . . . . 0 C--O 1.25 1.122 0 CA-C-O 115.443 -2.218 . . . . 4.5 116.54 -174.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 108.369 -0.974 . . . . 5.5099999999999998 108.369 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.74 154.83 37.92 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 126.748 2.019 . . . . 6.04 110.521 172.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 74.2 p -67.53 164.2 40.72 Favored Pre-proline 0 N--CA 1.466 0.37 0 C-N-CA 126.602 1.961 . . . . 2.02 111.601 177.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.46 -21.95 69.9 Favored 'Trans proline' 0 CA--C 1.537 0.65 0 C-N-CA 121.987 1.791 . . . . 1.3999999999999999 113.235 170.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -83.89 -42.35 16.46 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.757 1.162 . . . . 3.3599999999999999 112.417 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -59.81 -43.18 94.63 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 118.918 0.781 . . . . 4.1799999999999997 110.214 168.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -62.76 -39.29 93.71 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 120.855 -1.153 . . . . 4.0999999999999996 112.471 171.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.97 -52.68 62.06 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.44 1.018 . . . . 0.93000000000000005 111.23 176.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 37.6 mt -57.38 -39.04 75.22 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.785 1.234 . . . . 1.55 112.231 176.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 94.8 m -61.75 -51.98 66.1 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.451 0.7 . . . . 1.6299999999999999 110.793 171.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 86.5 m -55.54 -36.22 66.53 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.396 1.478 . . . . 1.48 112.28 -179.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 75.1 mmm -55.63 -51.98 65.37 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 122.926 0.49 . . . . 3.2799999999999998 111.943 170.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.17 -26.07 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.158 0.89 . . . . 2.52 112.842 -178.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 25.4 m -56.67 -56.49 20.75 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.078 1.351 . . . . 0.77000000000000002 110.844 169.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.98 -35.94 77.29 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 118.08 -0.962 . . . . 2.7200000000000002 109.482 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -59.73 -49.25 78.45 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 118.448 -0.787 . . . . 2.2000000000000002 111.972 177.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 15.8 m80 -56.82 -48.69 77.44 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 120.012 1.278 . . . . 2.0600000000000001 111.544 173.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -26.62 65.93 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 124.144 0.978 . . . . 5.8099999999999996 113.082 178.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -87.96 -30.24 20.18 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.6 -1.313 . . . . 3.2599999999999998 113.281 168.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 42.2 p -87.24 -36.99 17.63 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 120.914 1.688 . . . . 1.77 114.678 -162.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.45 3.15 85.85 Favored Glycine 0 CA--C 1.533 1.166 0 O-C-N 119.714 -1.866 . . . . 1.55 112.922 169.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -43.23 91.68 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 119.042 1.421 . . . . 4.7000000000000002 111.81 -172.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -138.27 157.78 45.59 Favored 'General case' 0 C--O 1.249 1.073 0 C-N-CA 127.237 2.215 . . . . 4.5599999999999996 111.153 173.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.88 7.1 10.92 Favored Glycine 0 CA--C 1.534 1.233 0 CA-C-N 114.703 -1.135 . . . . 2.2999999999999998 113.25 -167.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 53.9 m 48.1 -145.51 0.32 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.044 1.737 . . . . 6.96 111.464 -161.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 32.3 mtpt 71.53 -163.94 0.13 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 127.324 2.25 . . . . 11.51 111.938 169.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 5.4 mp -106.68 14.07 27.34 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.655 1.582 . . . . 4.5599999999999996 111.63 168.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 74.7 p -108.72 149.44 29.0 Favored 'General case' 0 C--O 1.248 1.023 0 C-N-CA 126.223 1.809 . . . . 1.28 113.402 -174.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -115.13 90.62 3.38 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.712 2.405 . . . . 1.98 109.45 -157.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.2 m -81.53 160.58 23.86 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.324 1.45 . . . . 2.0800000000000001 113.304 -173.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -40.44 -41.26 1.37 Allowed 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 116.41 2.004 . . . . 3.5600000000000001 116.41 -175.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? -78.63 -43.04 27.22 Favored 'General case' 0 CA--C 1.546 0.827 0 O-C-N 119.971 -1.706 . . . . 6.4199999999999999 112.034 175.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -53.7 -44.16 69.56 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.364 0.983 . . . . 1.72 109.6 172.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.43 -49.33 77.27 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.889 2.076 . . . . 2.2200000000000002 112.029 176.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -52.39 -47.1 66.42 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 121.093 -1.005 . . . . 2.8999999999999999 111.795 169.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -68.67 -24.21 64.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.108 1.763 . . . . 3.4199999999999999 114.381 177.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.5 tt -71.58 -59.32 2.82 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.001 1.32 . . . . 2.1000000000000001 108.912 172.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 78.8 mt -53.76 -58.71 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.386 0.674 . . . . 1.24 110.419 -176.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -9.15 8.56 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 114.07 1.137 . . . . 5.2199999999999998 114.07 -172.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . 0.434 ' HA ' ' HE2' ' B' ' 40' ' ' LYS . 0.0 OUTLIER -114.29 -40.79 3.59 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 125.942 1.697 . . . . 6.25 110.836 -177.496 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . 0.448 ' HA ' HG21 ' A' ' 3' ' ' THR . 80.9 mt-10 -68.04 -49.9 58.58 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.187 1.358 . . . . 3.9199999999999999 110.839 176.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -115.21 178.24 4.36 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.979 2.512 . . . . 2.8300000000000001 111.93 -171.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.1 m -138.55 -43.35 0.49 Allowed 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 114.774 1.398 . . . . 4.3700000000000001 114.774 165.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 7.4 mp 50.92 -112.73 0.65 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.626 1.571 . . . . 5.9000000000000004 111.759 -176.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -157.99 -58.12 0.01 OUTLIER Glycine 0 N--CA 1.471 1.023 0 CA-C-N 119.067 0.848 . . . . 4.1100000000000003 113.934 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.71 -23.43 66.11 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 117.45 0.625 . . . . 6.7300000000000004 112.018 174.279 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 2.0 ttm -58.5 104.88 0.24 Allowed 'General case' 0 C--N 1.338 0.105 0 C-N-CA 124.988 1.315 . . . . 2.6600000000000001 113.538 -157.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -163.62 176.7 9.4 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 128.122 2.569 . . . . 4.54 109.532 -171.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 33.7 tp10 -39.35 -58.9 1.14 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.912 1.685 . . . . 4.8399999999999999 113.639 -171.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 3.7 m -74.18 -4.88 38.55 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 116.439 2.014 . . . . 2.6299999999999999 116.439 -176.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 97.6 p -102.21 -28.72 12.13 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 120.979 1.718 . . . . 2.2200000000000002 112.5 161.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 54.0 mt -69.5 -39.77 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.645 1.578 . . . . 1.8300000000000001 112.826 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -72.33 -37.4 68.9 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.637 0.653 . . . . 2.9300000000000002 112.546 -177.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -67.92 -45.39 74.5 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.42 -0.8 . . . . 2.96 111.315 169.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.426 HD23 ' C ' ' B' ' 55' ' ' LEU . 4.7 tt -51.86 -51.37 57.17 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 117.588 -1.196 . . . . 2.1400000000000001 110.211 176.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.6 ppp? -64.72 -44.83 88.95 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.128 0.876 . . . . 2.02 112.021 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.54 -32.29 68.75 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.607 1.163 . . . . 3.8199999999999998 111.832 174.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 58.9 m -80.49 -16.92 53.14 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.969 1.307 . . . . 2.2999999999999998 113.663 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 17.7 mt -73.78 -40.32 63.53 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 119.124 0.874 . . . . 2.1299999999999999 110.442 165.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -76.32 149.27 37.07 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.696 1.199 . . . . 2.1499999999999999 114.2 -176.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.77 -2.73 9.28 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.756 1.222 . . . . 2.9500000000000002 112.997 171.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -103.86 -27.47 12.18 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.547 1.314 . . . . 2.0099999999999998 114.547 -168.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 16.4 t 69.5 30.62 4.0 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.246 1.819 . . . . 3.1699999999999999 111.9 -158.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 42.5 p30 -91.21 -24.92 19.75 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.376 1.071 . . . . 2.4100000000000001 112.629 -172.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 63.38 16.8 9.81 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 129.24 3.016 . . . . 5.9900000000000002 113.697 -171.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -116.8 122.23 43.84 Favored 'General case' 0 C--O 1.24 0.565 0 C-N-CA 129.173 2.989 . . . . 2.6800000000000002 108.826 176.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 25.1 mm -101.37 87.87 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 125.779 1.632 . . . . 1.3200000000000001 109.169 -177.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -62.55 165.98 5.74 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.986 0.914 . . . . 4.1500000000000004 111.442 171.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.71 -34.15 37.54 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 120.563 -1.336 . . . . 2.1200000000000001 113.262 -177.443 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -73.66 -17.5 61.14 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.486 1.514 . . . . 4.9900000000000002 114.825 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -93.03 -44.17 8.54 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.38 1.872 . . . . 1.8600000000000001 108.896 169.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -54.07 -36.97 63.7 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.409 1.484 . . . . 2.1000000000000001 113.152 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 90.8 p -68.7 -19.95 64.39 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 119.993 -1.692 . . . . 1.6399999999999999 114.243 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 46.9 t -61.61 -41.78 91.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 120.658 1.572 . . . . 1.47 109.724 172.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -61.4 -52.41 64.69 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.567 1.147 . . . . 1.71 110.397 175.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 76.7 mt -58.22 -33.3 69.17 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.379 0.672 . . . . 1.3 112.066 177.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 28.0 m -67.33 -51.91 46.69 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.401 1.08 . . . . 0.82999999999999996 110.974 175.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 70.7 mtp -55.13 -44.37 74.99 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.539 1.136 . . . . 1.96 111.312 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.91 -51.19 65.64 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.617 1.167 . . . . 2.9300000000000002 111.639 178.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . 0.459 ' HB3' ' CZ ' ' A' ' 69' ' ' PHE . 86.2 m -70.48 -33.58 71.41 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 114.065 1.135 . . . . 1.78 114.065 -175.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 94.0 mtp -68.06 -41.34 82.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 118.934 0.788 . . . . 2.0 111.256 171.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.98 -35.82 77.17 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 118.659 -0.686 . . . . 0.88 112.78 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -76.84 -29.79 56.04 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.729 1.149 . . . . 3.02 112.366 177.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -56.37 -47.67 78.4 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.213 0.915 . . . . 1.77 111.551 165.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -69.75 -35.38 74.92 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.183 0.993 . . . . 3.6200000000000001 112.01 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -60.67 -48.78 80.26 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.438 1.495 . . . . 2.9300000000000002 111.722 173.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -63.86 -34.95 79.09 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.049 0.94 . . . . 4.0700000000000003 111.214 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 83.4 mt -70.77 -11.72 61.12 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.658 0.985 . . . . 2.2599999999999998 113.658 175.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -99.06 -6.12 29.05 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.601 1.561 . . . . 3.6699999999999999 113.747 169.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -110.65 -42.74 3.98 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.061 1.745 . . . . 3.6800000000000002 112.552 -171.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -81.96 24.26 0.64 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.125 1.37 . . . . 3.8799999999999999 113.027 173.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 77.1 tttt . . . . . 0 C--O 1.254 1.306 0 C-N-CA 129.584 3.154 . . . . 5.25 115.78 -163.73 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.501 -0.922 0 N-CA-C 108.267 -1.012 . . . . 5.5 108.267 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -136.32 140.51 43.39 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 126.289 2.243 . . . . 4.2000000000000002 105.835 -164.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.421 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 12.8 p -73.48 168.52 24.6 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 124.367 1.067 . . . . 2.3199999999999998 112.03 -175.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.421 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 37.5 Cg_endo -63.58 -29.23 70.11 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.756 1.637 . . . . 1.8300000000000001 112.946 176.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 42.7 tp -70.33 -39.66 74.6 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 118.555 0.616 . . . . 3.0800000000000001 111.111 174.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.424 ' HA ' ' HG ' ' A' ' 9' ' ' LEU . 50.0 mt-10 -65.43 -39.09 91.67 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.108 0.563 . . . . 3.8799999999999999 111.923 173.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.1 -43.25 95.71 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.211 -0.931 . . . . 3.6000000000000001 111.723 172.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.95 -51.95 67.5 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.403 1.081 . . . . 0.89000000000000001 112.738 175.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.424 ' HG ' ' HA ' ' A' ' 6' ' ' GLU . 4.5 pp -64.82 -28.47 69.59 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.387 0.994 . . . . 3.2999999999999998 113.195 175.153 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 90.7 m -58.73 -49.94 75.75 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 118.286 -0.864 . . . . 1.55 109.853 167.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.4 m -57.43 -37.27 72.51 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 119.537 1.062 . . . . 1.3500000000000001 111.717 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 80.6 mmm -59.78 -58.27 9.29 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.778 0.831 . . . . 3.1099999999999999 111.541 174.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.2 m -66.94 -29.18 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 O-C-N 121.242 -0.911 . . . . 2.1299999999999999 112.233 -176.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 52.4 m -61.55 -55.38 31.54 Favored 'General case' 0 CA--C 1.506 -0.742 0 C-N-CA 125.591 1.556 . . . . 1.0800000000000001 111.313 176.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -75.87 -35.34 59.91 Favored 'General case' 0 CA--C 1.522 -0.116 0 O-C-N 125.28 1.613 . . . . 2.9300000000000002 109.417 -176.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -57.24 -44.04 83.48 Favored 'General case' 0 C--O 1.226 -0.177 0 CA-C-O 118.504 -0.76 . . . . 2.3100000000000001 111.156 177.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -70.26 -35.71 73.95 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.127 1.33 . . . . 2.27 112.594 175.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -70.65 -12.22 61.42 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.712 1.004 . . . . 6.2599999999999998 113.712 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -107.58 -47.99 3.51 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.903 2.081 . . . . 1.98 112.94 171.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.5 t -62.0 -29.74 70.47 Favored 'General case' 0 C--O 1.249 1.04 0 C-N-CA 126.554 1.941 . . . . 2.04 113.553 176.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.56 -4.84 87.86 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 127.763 2.601 . . . . 1.3899999999999999 114.009 173.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -78.53 60.22 2.61 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.812 1.806 . . . . 6.6299999999999999 110.365 171.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 51.86 -151.07 0.28 Allowed 'General case' 0 C--O 1.252 1.196 0 C-N-CA 126.154 1.782 . . . . 8.3699999999999992 112.803 -175.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.91 -151.59 8.53 Favored Glycine 0 CA--C 1.529 0.966 0 N-CA-C 109.659 -1.376 . . . . 2.0299999999999998 109.659 -145.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.5 m -69.3 161.19 29.8 Favored 'General case' 0 C--O 1.25 1.125 0 CA-C-O 123.338 1.542 . . . . 3.6299999999999999 111.032 155.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.1 mtmt -139.01 108.55 6.18 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.201 1.4 . . . . 7.8499999999999996 108.228 -160.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 43.4 mt 114.6 -17.74 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.482 1 C-N-CA 132.592 4.357 . . . . 3.23 110.459 -154.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.3 p -121.62 161.97 21.49 Favored 'General case' 0 C--O 1.246 0.91 0 C-N-CA 127.177 2.191 . . . . 1.1100000000000001 112.0 173.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 39.8 mt -104.95 117.45 34.04 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.73 1.212 . . . . 1.78 110.1 170.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 13.0 t -80.61 160.29 25.13 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 118.28 0.491 . . . . 2.2799999999999998 111.0 160.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.72 -46.77 2.7 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 127.149 2.18 . . . . 3.8799999999999999 114.045 -169.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -76.01 -27.36 57.35 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 120.706 -1.246 . . . . 6.4500000000000002 112.718 -175.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -65.37 -57.27 8.78 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.733 1.213 . . . . 1.49 108.573 173.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.3 tp -56.39 -45.02 80.78 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.136 0.975 . . . . 2.2599999999999998 112.152 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -31.76 71.69 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.5 -0.75 . . . . 4.6399999999999997 112.846 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -82.33 -28.95 31.32 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.943 0.897 . . . . 4.0599999999999996 112.837 174.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.3 tt -73.34 -52.05 15.25 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.552 1.141 . . . . 2.2999999999999998 110.947 178.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.5 mt -50.88 -60.27 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-N 119.853 1.206 . . . . 1.3200000000000001 111.114 -175.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.273 0.0 OUTLIER -78.1 9.33 3.8 Favored 'General case' 0 CA--C 1.56 1.328 0 N-CA-C 114.197 1.184 . . . . 4.9800000000000004 114.197 -175.778 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.0 mmtm -106.53 -31.04 8.69 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 127.441 2.296 . . . . 2.5800000000000001 112.556 166.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -71.18 -56.74 5.45 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 126.371 1.868 . . . . 4.6200000000000001 108.463 173.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -102.69 125.36 49.4 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 127.863 2.465 . . . . 2.6000000000000001 108.248 172.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 30.4 m -107.07 26.14 10.5 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.455 1.102 . . . . 3.9300000000000002 112.693 176.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -147.44 172.72 13.5 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.716 1.206 . . . . 4.1699999999999999 113.352 -175.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.78 -178.96 53.5 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 124.787 1.184 . . . . 4.2199999999999998 112.919 -175.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -82.83 51.87 2.01 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.92 1.288 . . . . 6.5199999999999996 110.025 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.2 tpt -83.85 56.65 3.76 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 123.249 1.5 . . . . 1.8700000000000001 112.876 -168.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -102.68 175.16 5.59 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.11 1.764 . . . . 4.4699999999999998 112.171 -173.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -58.26 -39.52 79.42 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.14 -0.975 . . . . 3.6200000000000001 113.412 -170.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -71.54 6.23 1.97 Allowed 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 114.571 1.323 . . . . 3.7400000000000002 114.571 175.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 29.7 t -121.75 -48.07 2.17 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.278 1.831 . . . . 2.8100000000000001 109.889 170.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 37.1 mt -54.1 -39.21 40.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.778 1.231 . . . . 1.3 113.304 174.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.69 -54.07 37.37 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.778 0.717 . . . . 4.0099999999999998 111.695 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.96 -30.21 65.05 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.149 0.426 . . . . 2.9300000000000002 112.149 -176.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.8 tt -57.89 -51.61 68.89 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 116.895 -1.526 . . . . 1.98 110.135 165.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.9 ttt -52.22 -48.94 64.85 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 120.98 1.718 . . . . 1.6799999999999999 112.176 174.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.0 mtpt -62.63 -27.23 69.07 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.515 0.726 . . . . 4.7699999999999996 112.676 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.5 m -89.0 -25.73 21.85 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.48 1.512 . . . . 2.48 113.91 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.415 HD22 ' HB2' ' A' ' 75' ' ' PHE . 14.5 mt -63.56 -42.02 98.39 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.685 1.13 . . . . 2.0600000000000001 110.676 171.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -87.13 142.34 27.99 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 124.588 1.155 . . . . 1.8 113.509 -169.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.98 9.6 42.07 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.55 1.54 . . . . 3.1099999999999999 112.779 178.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -143.48 -25.65 0.58 Allowed 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 115.969 1.841 . . . . 2.2400000000000002 115.969 -164.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.6 m 56.45 34.31 24.04 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.432 1.493 . . . . 2.3999999999999999 112.88 -161.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -79.43 1.17 26.45 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.116 1.767 . . . . 2.1699999999999999 111.558 178.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 58.53 -13.43 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 129.475 3.11 . . . . 4.2599999999999998 116.569 -163.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -101.45 123.65 45.86 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-O 124.071 1.891 . . . . 2.7200000000000002 112.239 -176.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.6 mm -92.49 93.81 4.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 113.747 -1.57 . . . . 1.25 109.013 171.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -53.15 147.22 10.16 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 127.283 2.233 . . . . 2.5 110.542 164.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -47.44 -37.19 11.11 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.58 1.152 . . . . 2.3999999999999999 113.079 178.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -69.56 -31.08 69.05 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.714 2.405 . . . . 2.9700000000000002 113.862 176.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -77.49 -47.66 19.06 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.595 1.158 . . . . 2.0899999999999999 109.06 170.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -55.05 -28.16 50.12 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.297 1.439 . . . . 1.8799999999999999 112.277 173.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 52.1 m -62.03 -26.93 68.53 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 119.882 -1.761 . . . . 2.2400000000000002 113.683 171.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 m -78.68 -28.94 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 CA-C-N 121.004 1.729 . . . . 2.7999999999999998 112.831 175.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.492 ' CE1' HD11 ' A' ' 79' ' ' LEU . 18.0 t80 -59.97 -55.14 37.76 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.357 1.063 . . . . 1.8200000000000001 110.678 169.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.1 mt -56.06 -38.84 71.16 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.754 0.822 . . . . 1.8999999999999999 112.438 175.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 75.8 m -60.74 -55.53 32.12 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.495 1.118 . . . . 0.81000000000000005 111.562 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 16.3 ptp -61.07 -38.08 84.95 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.986 0.812 . . . . 1.77 112.333 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.492 HD11 ' CE1' ' A' ' 75' ' ' PHE . 85.5 mt -64.74 -41.44 95.94 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.829 0.851 . . . . 1.73 113.047 175.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 40.4 t -71.7 -32.16 67.51 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.656 0.613 . . . . 1.3600000000000001 112.656 178.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 77.2 mtp -65.83 -43.27 89.07 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.284 0.475 . . . . 1.6299999999999999 112.284 167.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.22 -38.07 89.73 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.659 0.663 . . . . 1.0 111.95 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -61.35 -20.56 63.13 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.18 1.178 . . . . 2.4100000000000001 114.18 174.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.407 HD21 ' CE1' ' B' ' 17' ' ' HIS . 0.2 OUTLIER -71.25 -40.88 70.73 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 120.77 1.623 . . . . 2.9199999999999999 112.332 171.109 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -69.51 -45.12 69.64 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.872 1.269 . . . . 3.46 109.833 -177.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.68 -46.43 67.25 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.539 1.936 . . . . 3.1899999999999999 111.224 171.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -68.58 -27.28 65.92 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.252 1.021 . . . . 3.48 113.645 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 58.5 mt -72.0 -8.26 53.48 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 120.759 -1.213 . . . . 2.6699999999999999 113.51 175.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -98.56 0.23 44.54 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 114.73 1.382 . . . . 5.21 114.73 167.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -92.31 -59.61 2.04 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.148 1.379 . . . . 3.8599999999999999 111.466 165.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -86.25 1.73 49.79 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 117.221 2.304 . . . . 3.1600000000000001 117.221 -158.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.036 0 C-N-CA 128.453 2.701 . . . . 5.1200000000000001 117.308 -170.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 11.0 mtt . . . . . 0 CA--C 1.501 -0.914 0 N-CA-C 107.206 -1.405 . . . . 5.4100000000000001 107.206 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -138.21 152.7 48.88 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 106.57 -1.641 . . . . 5.7800000000000002 106.57 -171.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.41 150.12 45.6 Favored Pre-proline 0 N--CA 1.479 0.991 0 CA-C-O 119.301 -0.381 . . . . 2.0 110.536 -178.668 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -63.17 -14.86 44.44 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.273 1.982 . . . . 1.9099999999999999 112.446 173.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.01 -48.1 15.03 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.316 1.447 . . . . 2.71 111.155 171.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -52.1 -42.21 63.06 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.494 1.043 . . . . 3.9199999999999999 110.753 167.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . 0.444 ' HA ' ' CE ' ' B' ' 7' ' ' LYS . 0.0 OUTLIER -71.77 -25.87 62.21 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 114.781 1.4 . . . . 5.1399999999999997 114.781 178.965 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.31 -51.57 59.75 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 117.685 -1.15 . . . . 1.1000000000000001 111.439 165.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.2 mp -59.41 -40.64 87.33 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 121.05 1.75 . . . . 2.6699999999999999 111.898 173.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 40.3 m -53.78 -51.63 62.81 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.455 1.102 . . . . 1.54 110.001 173.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 90.8 m -53.48 -37.43 62.69 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.516 1.126 . . . . 1.4199999999999999 112.638 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 11.5 mtp -61.49 -47.04 87.44 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.105 0.562 . . . . 3.8599999999999999 111.671 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 4.0 p -76.02 -32.4 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-O 118.438 -0.791 . . . . 2.23 113.008 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 89.1 m -54.86 -56.72 16.43 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.171 1.35 . . . . 1.1599999999999999 110.547 175.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.43 -37.21 77.3 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.543 -0.753 . . . . 2.6800000000000002 109.705 -175.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -60.68 -52.93 63.05 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.626 0.77 . . . . 2.3500000000000001 112.673 175.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . 0.407 ' CE1' HD21 ' A' ' 84' ' ' ASN . 9.3 t60 -66.23 -38.0 86.86 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.75 0.82 . . . . 2.25 111.312 -178.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.563 ' HZ3' ' HB3' ' B' ' 18' ' ' LYS . 3.7 ttpm? -56.19 -58.94 5.8 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.86 1.264 . . . . 5.2300000000000004 112.069 170.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -67.36 -25.91 66.21 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 121.259 -0.901 . . . . 1.8400000000000001 112.699 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 61.1 m -63.33 -10.08 14.78 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.839 1.051 . . . . 1.6299999999999999 113.839 171.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -88.11 -7.4 73.68 Favored Glycine 0 CA--C 1.536 1.399 0 CA-C-O 118.347 -1.252 . . . . 1.4299999999999999 115.216 170.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 7.0 mmt180 -70.26 -3.59 17.86 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 120.406 2.103 . . . . 3.75 114.489 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -175.0 174.0 2.56 Favored 'General case' 0 C--O 1.247 0.94 0 C-N-CA 129.328 3.051 . . . . 3.6400000000000001 108.39 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -40.28 153.69 0.06 OUTLIER Glycine 0 N--CA 1.468 0.822 0 C-N-CA 126.469 1.985 . . . . 3.02 114.459 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 35.6 m 63.76 124.53 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.245 1.418 . . . . 3.5600000000000001 111.753 -176.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 24.1 tttt -102.08 -4.19 26.34 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 114.05 1.13 . . . . 7.4800000000000004 114.05 -178.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.506 ' H ' HD23 ' B' ' 27' ' ' LEU . 1.9 pt? -103.49 0.12 30.62 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.105 1.762 . . . . 3.6200000000000001 112.94 169.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 9.6 p -132.16 153.84 50.13 Favored 'General case' 0 C--O 1.249 1.052 0 C-N-CA 125.609 1.563 . . . . 1.3700000000000001 109.155 173.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.406 HD12 ' HB ' ' B' ' 67' ' ' ILE . 0.2 OUTLIER -110.42 124.56 51.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.375 -1.284 . . . . 1.76 109.537 158.527 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 9.7 p -59.25 165.63 2.57 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.015 0.526 . . . . 2.1600000000000001 111.225 167.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 23.4 ttt180 -52.5 -29.74 26.63 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 120.562 -1.336 . . . . 5.5899999999999999 114.117 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 tmtt? -79.34 -36.36 39.56 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.716 -1.24 . . . . 5.3200000000000003 112.863 177.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -63.85 -53.79 45.14 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.589 0.709 . . . . 1.9099999999999999 109.512 169.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 20.2 tp -51.74 -41.21 61.39 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 128.058 2.543 . . . . 2.2000000000000002 112.427 176.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 15.8 mttt -56.37 -46.85 79.84 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 121.079 -1.013 . . . . 3.25 112.476 -178.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -60.91 -53.22 59.91 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 117.761 -1.114 . . . . 3.8300000000000001 111.718 173.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -51.98 -53.47 41.1 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.429 1.013 . . . . 2.5 111.48 177.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 96.4 mt -60.35 -55.49 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-N 119.575 1.08 . . . . 1.22 109.12 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 25.6 ttpt -69.15 -15.19 63.35 Favored 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 113.281 0.845 . . . . 4.4500000000000002 113.281 -169.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 18.3 mmtp -85.77 -63.11 1.38 Allowed 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 127.49 2.316 . . . . 4.0700000000000003 112.402 170.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -75.41 -9.03 58.21 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.856 0.862 . . . . 4.8700000000000001 112.584 -171.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 89.6 mt -125.83 42.3 3.33 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.416 1.486 . . . . 3.2400000000000002 110.727 165.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 19.5 p -68.13 11.59 0.15 Allowed 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 115.444 1.646 . . . . 3.04 115.444 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -103.49 -6.3 21.94 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.005 1.722 . . . . 3.0299999999999998 113.843 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -131.87 -171.43 12.82 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 124.395 0.998 . . . . 3.0499999999999998 115.07 -170.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -74.65 53.78 0.58 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.213 1.805 . . . . 5.29 112.583 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.91 19.16 9.32 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.327 1.851 . . . . 3.3999999999999999 113.219 -179.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.0 ptmt -52.44 152.42 3.53 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.898 1.679 . . . . 3.9700000000000002 112.886 165.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -39.29 -54.77 1.8 Allowed 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 116.41 2.004 . . . . 3.79 116.41 -163.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 8.7 m -67.53 -23.19 65.42 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 114.458 1.281 . . . . 3.3700000000000001 114.458 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 8.2 t -65.79 -26.16 67.57 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 120.757 -1.214 . . . . 2.4500000000000002 111.125 169.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 74.7 mt -88.21 -8.75 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.988 1.315 . . . . 1.97 111.449 175.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -72.94 -44.93 60.59 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.051 -1.031 . . . . 3.4300000000000002 109.03 160.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.575 ' HA ' ' HE3' ' B' ' 57' ' ' LYS . 9.9 t0 -71.17 -47.34 58.21 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.508 0.594 . . . . 3.3700000000000001 112.355 176.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -59.17 -39.74 83.45 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 118.169 -0.919 . . . . 2.8399999999999999 111.05 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 27.6 tpp -53.79 -65.11 0.62 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.866 0.866 . . . . 2.48 109.26 169.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . 0.575 ' HE3' ' HA ' ' B' ' 54' ' ' ASP . 12.1 ttpp -48.16 -34.78 10.47 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.845 1.658 . . . . 4.5800000000000001 114.034 177.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 52.4 m -87.14 -30.57 20.96 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.312 1.045 . . . . 2.77 113.595 -174.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.1 pp -90.99 -36.27 14.18 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.211 -0.931 . . . . 2.6000000000000001 112.087 174.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.426 ' O ' ' HE3' ' B' ' 61' ' ' LYS . 30.5 t70 -76.06 153.66 36.22 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.412 1.485 . . . . 2.7400000000000002 112.404 171.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . 0.426 ' HE3' ' O ' ' B' ' 60' ' ' ASP . 6.4 mmtp -130.36 15.35 5.56 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.401 1.26 . . . . 3.5299999999999998 114.401 -171.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -161.4 -3.42 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 117.028 2.233 . . . . 2.5499999999999998 117.028 -165.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 74.0 m 60.65 41.81 14.7 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.077 2.151 . . . . 2.6200000000000001 112.877 179.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 59.0 p30 -95.39 -17.98 21.11 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.495 1.518 . . . . 2.5699999999999998 112.76 -174.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 62.76 -12.31 0.08 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 129.85 3.26 . . . . 5.5700000000000003 115.806 -172.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -79.46 131.35 36.04 Favored 'General case' 0 C--O 1.249 1.07 0 CA-C-N 120.906 1.685 . . . . 3.8500000000000001 111.224 161.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.406 ' HB ' HD12 ' B' ' 29' ' ' LEU . 33.6 mm -107.09 94.18 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 115.131 -0.94 . . . . 1.24 109.579 174.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -60.11 154.9 18.33 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.355 1.862 . . . . 2.96 112.262 168.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -46.55 -38.0 8.81 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.99 1.716 . . . . 2.6400000000000001 113.418 178.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -78.81 -38.22 38.79 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 120.648 -1.282 . . . . 3.2599999999999998 112.568 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -56.18 -52.56 63.93 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 119.237 0.926 . . . . 2.3399999999999999 108.749 168.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -52.09 -41.86 62.76 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.932 1.293 . . . . 2.5 113.454 174.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.7 -24.61 65.41 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.681 -1.262 . . . . 2.6000000000000001 113.514 176.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 79.7 t -73.67 -35.52 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 119.148 0.885 . . . . 1.76 110.666 172.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -59.98 -51.2 70.68 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.728 0.695 . . . . 1.8200000000000001 111.191 167.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 93.4 mt -58.87 -36.18 74.2 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 118.865 -0.588 . . . . 1.3600000000000001 112.329 176.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 95.1 m -59.88 -47.4 85.91 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.313 1.045 . . . . 0.75 111.109 173.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 57.4 mtm -58.17 -42.74 86.68 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.467 1.03 . . . . 1.5700000000000001 112.437 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 70.6 mt -65.6 -48.41 72.4 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.191 0.596 . . . . 1.6299999999999999 112.182 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 69.0 m -59.55 -43.14 93.63 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.284 0.634 . . . . 1.9299999999999999 111.839 176.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 23.8 mtp -64.97 -34.94 79.62 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.253 0.933 . . . . 2.0899999999999999 112.577 175.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.9 -45.51 77.74 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.808 0.731 . . . . 0.70999999999999996 112.154 176.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -67.65 -25.26 65.63 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.305 0.854 . . . . 2.4500000000000002 113.305 175.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -66.0 -47.25 75.12 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 119.066 0.848 . . . . 2.3799999999999999 111.058 176.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -67.2 -37.77 84.22 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.591 1.156 . . . . 2.71 112.23 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.16 -48.98 77.38 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.811 1.244 . . . . 2.1000000000000001 111.036 174.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -57.01 -33.03 66.75 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.07 0.948 . . . . 2.4199999999999999 113.008 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.86 -42.61 97.52 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.394 0.997 . . . . 3.5699999999999998 112.08 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -72.76 -32.25 65.51 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 114.777 1.399 . . . . 3.71 114.777 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 -75.22 -29.43 60.27 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.347 1.859 . . . . 4.3399999999999999 114.062 -177.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -105.83 10.1 32.67 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.362 1.065 . . . . 3.54 112.926 -172.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 3.3 ttpm? . . . . . 0 C--O 1.249 1.079 0 C-N-CA 129.584 3.154 . . . . 5.2000000000000002 116.69 -177.227 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.585 ' HA ' ' OE1' ' A' ' 6' ' ' GLU 0.262 24.4 mtt . . . . . 0 N--CA 1.473 0.708 0 CA-C-O 118.567 -0.73 . . . . 9.5800000000000001 111.23 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -155.81 -110.08 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 126.281 1.833 . . . . 6.2199999999999998 107.497 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 35.3 p -70.94 166.88 33.37 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 126.441 1.896 . . . . 1.5800000000000001 111.835 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -59.61 -25.02 77.58 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 121.961 1.774 . . . . 1.3700000000000001 113.567 169.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tt -85.42 -38.07 19.09 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.521 1.055 . . . . 2.3999999999999999 112.272 178.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.585 ' OE1' ' HA ' ' A' ' 1' ' ' MET . 11.2 tm-20 -54.34 -46.48 72.93 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.619 1.1 . . . . 4.7400000000000002 109.639 161.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.3 mtpt -64.91 -23.19 67.15 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 121.477 -0.765 . . . . 5.0999999999999996 111.991 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.06 -46.55 56.46 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.575 1.15 . . . . 0.91000000000000003 110.997 173.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -70.0 -39.61 75.78 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.793 1.237 . . . . 2.8900000000000001 112.942 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.3 m -58.88 -43.5 90.92 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.431 1.492 . . . . 1.95 110.793 168.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 53.5 m -60.32 -47.57 85.45 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.614 1.097 . . . . 1.3899999999999999 109.531 169.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.1 ttm -57.6 -49.61 75.85 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 117.316 -1.325 . . . . 2.9500000000000002 111.915 -175.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.9 p -69.68 -25.41 28.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 CA-C-N 119.992 1.269 . . . . 2.2799999999999998 112.978 174.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.8 m -66.58 -53.35 35.49 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 117.537 -1.221 . . . . 0.88 110.104 174.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -53.48 -42.78 67.61 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.822 0.737 . . . . 2.4900000000000002 109.113 167.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -63.31 -44.03 96.13 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 119.588 -0.845 . . . . 2.5 111.326 -170.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.3 m80 -73.19 -34.8 66.18 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 115.03 1.493 . . . . 1.98 115.03 171.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -67.86 -24.74 65.28 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.632 1.106 . . . . 4.9500000000000002 113.301 175.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -102.95 -42.66 5.75 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.769 1.628 . . . . 2.2999999999999998 113.048 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.0 m -67.58 -15.28 63.57 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 120.173 1.351 . . . . 2.7000000000000002 113.122 172.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.93 14.94 60.54 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 125.69 1.614 . . . . 1.8899999999999999 114.68 168.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.5 mmp_? -94.28 -3.16 51.08 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 119.627 1.714 . . . . 5.71 113.465 176.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 177.23 176.1 0.38 Allowed 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 129.39 3.076 . . . . 4.5599999999999996 110.558 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.65 -147.55 36.31 Favored Glycine 0 N--CA 1.47 0.944 0 C-N-CA 126.0 1.762 . . . . 2.0600000000000001 113.595 167.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.9 t -66.68 155.95 36.59 Favored 'General case' 0 C--O 1.25 1.085 0 O-C-N 120.718 -1.46 . . . . 3.6099999999999999 110.751 163.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.7 pttp -65.8 -24.11 66.84 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.745 1.218 . . . . 6.7000000000000002 112.165 169.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.3 tp -70.61 -52.54 20.74 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.192 1.397 . . . . 3.7200000000000002 109.339 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 65.4 p -96.12 155.97 16.53 Favored 'General case' 0 C--O 1.253 1.269 0 C-N-CA 124.719 1.208 . . . . 0.96999999999999997 112.948 -165.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -89.91 116.25 27.84 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 112.122 -2.308 . . . . 2.73 108.827 153.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.4 p -75.47 170.44 16.11 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.163 0.585 . . . . 2.1800000000000002 110.751 158.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.37 -45.31 3.03 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 125.51 1.524 . . . . 3.7599999999999998 113.195 178.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? -70.07 -45.01 67.94 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 119.943 -1.723 . . . . 6.2300000000000004 113.102 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -61.07 -41.46 96.65 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.951 0.9 . . . . 1.5900000000000001 110.693 -176.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.52 -40.86 98.16 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.303 1.841 . . . . 2.4500000000000002 112.077 -179.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.6 ttmt -64.74 -43.08 94.5 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.028 -1.045 . . . . 3.6099999999999999 112.277 171.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -64.24 -36.25 83.46 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.848 0.859 . . . . 4.1600000000000001 111.738 176.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.1 tp -65.88 -69.59 0.29 Allowed 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 128.058 2.543 . . . . 2.5699999999999998 111.608 177.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.3 mt -56.81 -51.35 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 CA-C-N 119.641 1.109 . . . . 1.03 110.32 -174.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -72.55 -4.35 30.09 Favored 'General case' 0 CA--C 1.555 1.156 0 O-C-N 121.279 -0.888 . . . . 4.0300000000000002 112.11 -173.458 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -96.56 -45.31 6.78 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-O 117.155 -1.402 . . . . 3.9300000000000002 112.715 159.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -51.81 -44.61 63.57 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 119.897 1.226 . . . . 4.2800000000000002 111.76 175.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.2 mt -139.19 66.5 1.41 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.632 2.773 . . . . 2.5499999999999998 108.798 -169.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.6 t -70.91 21.52 0.04 OUTLIER 'General case' 0 CA--C 1.559 1.304 0 O-C-N 120.534 -1.354 . . . . 4.29 114.556 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -83.51 162.2 20.99 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 120.186 -1.571 . . . . 4.0700000000000003 113.169 -174.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.38 -0.68 24.31 Favored Glycine 0 N--CA 1.477 1.381 0 N-CA-C 116.451 1.34 . . . . 3.3599999999999999 116.451 -171.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -75.4 -32.09 60.63 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 118.599 1.199 . . . . 7.1699999999999999 110.971 166.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.53 151.41 27.76 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.597 1.159 . . . . 3.0800000000000001 111.083 174.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.88 176.83 0.52 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 130.413 3.485 . . . . 4.5300000000000002 108.639 178.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -55.58 -51.4 67.26 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 120.942 1.701 . . . . 6.2199999999999998 110.344 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.0 m -67.34 60.26 0.06 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.799 2.04 . . . . 3.73 113.302 168.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.6 t 172.63 -54.53 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 129.311 3.045 . . . . 2.3399999999999999 108.877 -176.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 13.9 mm -61.72 -39.57 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.376 1.47 . . . . 1.54 111.802 174.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -69.9 -26.63 64.26 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.276 0.843 . . . . 3.3300000000000001 113.276 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -85.63 -32.25 22.13 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.286 0.948 . . . . 2.1800000000000002 112.266 173.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.54 -43.67 76.04 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.4 0.68 . . . . 2.9100000000000001 109.941 163.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.7 tpt -54.33 -29.71 48.88 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 119.526 1.057 . . . . 1.52 113.374 173.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.0 mttm -83.49 -31.71 26.35 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.617 1.167 . . . . 5.29 112.703 174.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 46.3 t -81.69 -32.94 31.49 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 126.217 1.807 . . . . 2.4199999999999999 113.699 -177.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -68.59 -39.04 81.1 Favored 'General case' 0 C--N 1.334 -0.065 0 C-N-CA 126.223 1.809 . . . . 2.2200000000000002 111.178 173.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -84.67 144.41 28.58 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.24 1.416 . . . . 2.2400000000000002 111.225 -176.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.7 ttmt -116.25 -27.75 6.75 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.256 1.206 . . . . 4.3499999999999996 114.256 -163.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -96.84 -67.42 0.85 Allowed 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.224 1.81 . . . . 3.0499999999999998 113.243 165.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 53.1 m 137.56 38.78 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.489 1 C-N-CA 133.071 4.548 . . . . 2.6699999999999999 110.71 -172.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.9 p30 -91.36 -15.8 28.44 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.205 -1.56 . . . . 2.3199999999999998 112.784 -177.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.4 5.49 1.18 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 128.324 2.65 . . . . 5.4800000000000004 115.287 -168.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -102.12 129.39 48.46 Favored 'General case' 0 C--O 1.24 0.599 0 C-N-CA 125.188 1.395 . . . . 3.6800000000000002 110.929 164.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 10.7 mm -99.69 105.91 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 124.467 1.107 . . . . 1.1000000000000001 110.908 175.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -79.94 154.1 28.51 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.721 2.409 . . . . 3.2000000000000002 109.366 166.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.02 -39.18 62.98 Favored 'General case' 0 CA--C 1.547 0.833 0 O-C-N 120.172 -1.58 . . . . 2.5899999999999999 113.867 -178.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.3 pttm -71.51 -12.96 61.65 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.393 1.257 . . . . 3.1099999999999999 114.393 175.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 73.2 mt-10 -79.67 -63.37 1.43 Allowed 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 108.299 -1.0 . . . . 1.72 108.299 158.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -49.97 -33.44 17.79 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 126.915 2.086 . . . . 2.3799999999999999 115.618 -171.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.2 t -58.14 -22.56 51.66 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.721 -1.237 . . . . 3.0 112.597 176.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 5.5 p -58.23 -46.22 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 CA-C-N 119.108 0.867 . . . . 2.2599999999999998 111.137 173.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -70.27 -48.23 57.71 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 125.783 1.633 . . . . 2.71 111.93 178.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.5 mt -53.85 -37.61 63.82 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 122.924 0.49 . . . . 1.8100000000000001 111.384 175.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 42.8 m -68.21 -51.31 46.99 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.733 1.213 . . . . 1.3 111.751 173.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 40.1 mtm -54.88 -42.58 72.26 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.803 1.183 . . . . 1.8 112.668 177.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.97 -47.53 82.77 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.403 0.681 . . . . 1.25 111.653 174.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 88.4 m -62.72 -35.7 80.59 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.511 0.93 . . . . 1.3999999999999999 113.511 175.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 58.9 mtp -62.25 -43.65 98.33 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 118.797 0.726 . . . . 2.4300000000000002 111.267 174.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.29 -41.26 85.72 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 122.844 0.458 . . . . 0.89000000000000001 111.522 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -72.3 -29.23 63.66 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.634 -0.666 . . . . 2.8599999999999999 111.868 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -65.15 -44.22 89.28 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.292 0.951 . . . . 1.8999999999999999 111.753 171.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -61.01 -45.31 95.31 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.258 1.023 . . . . 2.6800000000000002 111.515 174.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -53.29 -48.24 68.52 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.56 1.544 . . . . 2.4399999999999999 111.991 176.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -61.8 -34.47 75.97 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.78 1.232 . . . . 2.4399999999999999 112.275 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 79.9 mt -72.33 -16.86 61.88 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.62 0.97 . . . . 1.6000000000000001 113.62 178.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -95.16 -11.66 27.77 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.336 1.236 . . . . 3.1099999999999999 114.336 172.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -109.59 -39.07 5.26 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.818 1.647 . . . . 2.8399999999999999 113.034 -168.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -88.32 24.16 1.98 Allowed 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 124.76 1.224 . . . . 3.1099999999999999 112.586 174.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 79.7 tttt . . . . . 0 C--O 1.249 1.074 0 C-N-CA 130.252 3.421 . . . . 3.7999999999999998 116.131 -164.083 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.475 0.823 0 N-CA-C 107.948 -1.13 . . . . 5.7300000000000004 107.948 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 19.6 mp0 -115.65 -108.96 0.36 Allowed 'General case' 0 CA--C 1.537 0.473 0 O-C-N 125.319 1.637 . . . . 4.6299999999999999 107.715 -158.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.7 p -132.68 151.56 78.35 Favored Pre-proline 0 N--CA 1.47 0.545 0 C-N-CA 123.861 0.864 . . . . 1.8799999999999999 111.238 174.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -67.91 -16.69 45.98 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 122.211 1.941 . . . . 1.3899999999999999 111.742 173.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.26 -46.65 27.02 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-O 118.143 -0.932 . . . . 2.48 110.576 173.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -57.6 -48.13 80.26 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.708 1.14 . . . . 4.6600000000000001 109.612 172.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -62.5 -29.62 70.68 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.351 -0.843 . . . . 4.21 112.978 178.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.04 -43.31 79.02 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.491 1.117 . . . . 0.81999999999999995 111.822 171.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 32.8 mt -66.3 -40.83 90.26 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 119.346 0.975 . . . . 1.75 111.3 173.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 90.3 m -59.95 -42.51 94.21 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.993 1.317 . . . . 1.3100000000000001 111.686 172.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 92.2 m -59.47 -43.77 93.18 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.139 0.976 . . . . 1.3400000000000001 110.654 171.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -59.99 -51.82 68.04 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.605 0.762 . . . . 3.52 111.286 177.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 48.5 t -56.94 -31.6 36.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 125.078 1.351 . . . . 1.79 113.15 175.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 33.3 m -65.47 -55.26 18.92 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.406 1.082 . . . . 0.77000000000000002 110.491 175.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.8 -39.58 71.51 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.347 0.659 . . . . 1.6699999999999999 110.9 170.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -59.91 -53.84 53.11 Favored 'General case' 0 C--O 1.225 -0.196 0 O-C-N 123.778 0.674 . . . . 2.1200000000000001 109.285 -174.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 28.0 m80 -56.39 -49.25 75.01 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.598 -0.689 . . . . 2.4100000000000001 112.522 172.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.39 -26.44 67.84 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 114.13 1.159 . . . . 6.1399999999999997 114.13 -176.18 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -107.04 -32.42 7.86 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 120.438 -1.414 . . . . 2.2400000000000002 113.162 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 42.3 t -72.34 -38.22 68.67 Favored 'General case' 0 C--O 1.247 0.935 0 C-N-CA 125.191 1.396 . . . . 1.6699999999999999 113.167 176.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.69 2.86 81.63 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 125.58 1.562 . . . . 1.74 114.299 176.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -43.96 25.98 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.498 1.149 . . . . 3.1899999999999999 111.782 -171.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -159.97 -163.0 1.06 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.865 1.666 . . . . 3.9500000000000002 110.787 177.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 58.48 -135.94 51.48 Favored Glycine 0 N--CA 1.468 0.768 0 N-CA-C 109.301 -1.52 . . . . 2.3900000000000001 109.301 -171.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 5.3 t -82.84 162.08 21.74 Favored 'General case' 0 C--O 1.248 0.985 0 CA-C-O 124.4 2.048 . . . . 3.1600000000000001 112.105 152.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -91.65 143.31 26.69 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.543 1.537 . . . . 6.7000000000000002 108.674 171.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.3 tp 82.31 -15.04 0.72 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 128.174 2.59 . . . . 2.9500000000000002 112.868 -164.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 54.8 p -112.38 144.62 41.52 Favored 'General case' 0 C--O 1.246 0.874 0 C-N-CA 125.859 1.664 . . . . 1.0900000000000001 114.542 169.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 52.5 mt -94.11 101.41 13.43 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.069 2.148 . . . . 2.04 109.514 167.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.2 t -71.59 162.0 30.13 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 120.69 -1.257 . . . . 1.99 111.452 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 tmm_? -53.93 -14.28 0.97 Allowed 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 116.345 1.98 . . . . 5.0499999999999998 116.345 -174.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.01 -45.74 8.16 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.318 -1.488 . . . . 5.8700000000000001 113.302 164.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -52.36 -45.62 65.82 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.488 1.115 . . . . 1.6399999999999999 109.893 175.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -61.15 -56.62 18.74 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.5 1.52 . . . . 2.5299999999999998 111.924 -178.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -69.93 -27.45 64.78 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 119.933 -1.73 . . . . 3.5 112.935 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -70.78 -26.02 63.15 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.992 0.738 . . . . 3.3399999999999999 112.992 169.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 34.5 tp -72.66 -58.16 3.57 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-O 117.339 -1.315 . . . . 2.0299999999999998 110.813 172.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 38.2 mt -53.03 -49.24 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 CA-C-N 119.864 1.211 . . . . 1.1399999999999999 110.423 -178.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 22.6 mtpp -64.45 -12.15 40.64 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.262 1.208 . . . . 4.5099999999999998 114.262 -175.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -109.12 -27.15 9.76 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.524 1.53 . . . . 3.5899999999999999 113.256 172.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -72.22 -38.84 68.88 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 127.878 2.471 . . . . 4.96 113.22 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 43.1 mt -147.56 79.78 1.49 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.505 1.522 . . . . 3.6099999999999999 109.215 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 15.7 p -90.19 -16.48 29.38 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.397 1.258 . . . . 2.7799999999999998 114.397 -172.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -57.93 -2.24 0.15 Allowed 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 119.228 3.047 . . . . 3.71 119.228 -170.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 163.65 161.98 13.78 Favored Glycine 0 N--CA 1.472 1.056 0 CA-C-N 120.562 1.528 . . . . 3.9199999999999999 114.45 174.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 73.97 -45.69 0.6 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 127.504 2.321 . . . . 5.96 113.534 172.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 33.4 tpp -78.12 71.68 4.6 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 124.19 1.948 . . . . 2.1600000000000001 115.41 -148.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -84.84 168.77 14.79 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.555 2.342 . . . . 4.8799999999999999 111.879 170.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -52.96 -48.42 67.39 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.688 0.795 . . . . 3.54 112.085 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 53.3 p -68.14 -4.2 12.97 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.495 1.665 . . . . 4.3399999999999999 115.495 178.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 16.4 m -97.73 -26.71 14.64 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.641 1.11 . . . . 2.5699999999999998 112.229 165.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 81.2 mt -82.09 -49.0 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 125.27 1.428 . . . . 1.95 111.713 -177.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -75.82 -15.4 60.24 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.042 0.386 . . . . 4.04 112.042 -165.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -75.33 -41.95 55.55 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.436 0.695 . . . . 4.0300000000000002 112.021 160.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.34 -43.89 79.51 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.041 0.936 . . . . 3.1000000000000001 110.621 172.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 9.7 tpt -56.87 -47.87 79.43 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.951 2.1 . . . . 1.97 111.495 172.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.6 tmtt? -66.23 -24.91 66.69 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.409 1.084 . . . . 5.1799999999999997 113.487 173.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.7 t -84.06 -41.2 17.43 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 120.695 -1.253 . . . . 2.6000000000000001 112.086 -178.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 14.1 mt -57.01 -59.55 4.9 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 127.395 2.278 . . . . 2.71 111.155 164.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -85.64 56.29 3.89 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 123.139 1.447 . . . . 1.7 110.856 -171.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -58.05 -19.62 33.03 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.535 1.534 . . . . 6.5599999999999996 114.026 -169.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -95.55 -10.7 28.91 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 116.441 2.015 . . . . 1.75 116.441 174.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 23.0 t 62.2 32.69 17.17 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.2 1.4 . . . . 2.5499999999999998 114.4 -178.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 46.2 p30 -73.56 -18.5 61.07 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 121.106 -0.996 . . . . 2.2000000000000002 111.388 172.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 78.63 6.64 2.35 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 131.572 3.949 . . . . 4.3099999999999996 115.918 179.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -131.21 140.43 49.88 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.865 1.666 . . . . 2.3500000000000001 111.278 175.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 28.7 mt -110.15 118.96 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 O-C-N 121.152 -0.967 . . . . 1.23 111.988 -173.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -93.6 164.3 13.22 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 127.136 2.174 . . . . 3.1800000000000002 111.032 165.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -49.06 -32.52 9.72 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.016 1.726 . . . . 2.25 115.142 -176.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.92 -45.95 69.53 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.121 -0.987 . . . . 3.4399999999999999 111.164 179.34 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -58.25 -48.95 78.81 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.66 1.184 . . . . 1.76 109.326 171.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -56.54 -24.51 47.33 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 114.785 1.402 . . . . 2.1099999999999999 114.785 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 29.3 t -55.86 -27.83 53.53 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 120.422 -1.424 . . . . 2.6200000000000001 114.003 170.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 89.5 t -64.45 -50.53 75.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-N 119.244 0.929 . . . . 1.54 109.981 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -61.28 -45.58 93.9 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.107 0.963 . . . . 1.79 111.853 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 87.9 mt -56.26 -41.93 76.57 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 122.966 0.506 . . . . 2.0499999999999998 112.014 174.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 39.0 m -62.05 -46.72 87.89 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.91 0.884 . . . . 1.3700000000000001 111.34 174.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 88.5 mtp -61.17 -42.55 98.77 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.002 0.819 . . . . 2.3199999999999998 112.324 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 79.4 mt -61.36 -54.1 48.04 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.511 0.724 . . . . 1.8300000000000001 111.171 174.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 52.5 m -56.19 -40.95 74.76 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 114.048 1.129 . . . . 1.76 114.048 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 50.4 mtp -74.3 -31.06 62.34 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 118.666 -0.683 . . . . 2.5099999999999998 111.927 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.13 -36.46 72.1 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.73 0.696 . . . . 0.85999999999999999 111.411 172.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -65.23 -26.85 68.3 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 121.389 -0.82 . . . . 2.5299999999999998 112.784 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -61.53 -44.02 97.81 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 120.264 1.393 . . . . 2.5800000000000001 112.013 171.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -74.21 -35.16 63.9 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.92 0.888 . . . . 3.48 111.982 178.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -56.29 -45.9 79.99 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.829 1.251 . . . . 2.4100000000000001 111.094 170.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -63.38 -15.72 58.36 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.476 1.51 . . . . 2.1299999999999999 112.677 175.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 56.9 mt -98.92 -5.11 31.35 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.824 1.65 . . . . 2.6400000000000001 114.216 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -84.38 -32.72 24.04 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.655 1.182 . . . . 4.6200000000000001 112.809 161.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -75.35 -47.35 28.06 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.954 1.302 . . . . 3.0099999999999998 112.936 -174.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -83.44 28.65 0.54 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 125.255 1.422 . . . . 3.48 113.627 -176.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 44.1 mttp . . . . . 0 C--O 1.251 1.184 0 CA-C-O 115.01 -2.424 . . . . 5.5800000000000001 115.145 173.321 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mmt . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 108.821 -0.807 . . . . 5.8899999999999997 108.821 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -150.99 141.02 22.07 Favored 'General case' 0 C--O 1.241 0.606 0 C-N-CA 126.615 1.966 . . . . 4.96 106.658 -160.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 75.9 p -55.9 161.33 3.58 Favored Pre-proline 0 N--CA 1.475 0.807 0 C-N-CA 126.657 1.983 . . . . 1.8300000000000001 112.166 175.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.44 -14.84 47.0 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 122.07 1.847 . . . . 1.9199999999999999 113.258 173.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -80.32 -48.37 13.09 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.893 1.224 . . . . 3.2599999999999998 111.375 173.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -55.55 -37.17 67.63 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 121.854 0.835 . . . . 4.2800000000000002 110.432 168.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.84 -37.51 87.86 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.719 -1.238 . . . . 3.3399999999999999 113.149 170.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.6 -44.05 91.82 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.228 1.011 . . . . 1.6399999999999999 112.026 174.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.0 mt -63.83 -45.31 90.14 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.692 0.797 . . . . 2.1099999999999999 110.711 175.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 49.2 m -52.61 -53.47 46.31 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.22 1.408 . . . . 2.0299999999999998 111.514 170.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.3 t -69.99 -31.52 69.24 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 118.051 -0.976 . . . . 2.8900000000000001 112.123 -177.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 37.8 mtt -60.59 -44.77 95.88 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.193 0.997 . . . . 3.0899999999999999 112.092 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 33.6 m -75.27 -25.7 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 119.571 1.078 . . . . 2.6499999999999999 112.812 175.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.3 m -69.29 -50.2 48.94 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.385 1.474 . . . . 1.23 111.555 177.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.4 p -60.53 -41.94 95.45 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.155 -0.684 . . . . 2.4100000000000001 109.155 172.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -65.0 -49.46 70.14 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 118.563 -0.732 . . . . 2.9700000000000002 111.236 -173.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.6 m80 -59.61 -43.96 93.59 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 120.301 1.409 . . . . 2.5099999999999998 113.276 172.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -63.45 -44.49 94.37 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.228 1.011 . . . . 3.7999999999999998 112.712 -175.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -76.55 -43.59 38.45 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.978 0.911 . . . . 2.1400000000000001 112.343 172.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.7 t -62.94 -26.0 68.61 Favored 'General case' 0 C--O 1.242 0.669 0 N-CA-C 115.347 1.61 . . . . 2.2200000000000002 115.347 -163.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.37 2.85 75.6 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 125.053 1.311 . . . . 2.2599999999999998 114.913 173.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.61 63.95 7.82 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.18 1.49 . . . . 6.7199999999999998 108.167 169.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 78.71 -171.37 0.06 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.927 1.691 . . . . 4.1200000000000001 112.984 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.84 -149.66 29.32 Favored Glycine 0 C--N 1.341 0.833 0 N-CA-C 109.363 -1.495 . . . . 2.5899999999999999 109.363 -159.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 63.7 m -76.98 166.83 22.79 Favored 'General case' 0 C--O 1.248 1.005 0 O-C-N 121.286 -1.126 . . . . 2.6499999999999999 112.017 151.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.8 ptmt -85.94 4.87 35.69 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 126.364 1.866 . . . . 4.9100000000000001 113.923 169.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 40.8 tp -96.93 -5.14 38.67 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.463 1.905 . . . . 3.4900000000000002 110.73 167.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.2 p -146.45 149.73 34.25 Favored 'General case' 0 C--O 1.253 1.263 0 N-CA-C 114.799 1.407 . . . . 0.97999999999999998 114.799 -161.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.2 mt -107.99 102.35 11.53 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 113.512 -1.676 . . . . 1.5600000000000001 110.137 173.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.3 t -75.85 173.24 11.42 Favored 'General case' 0 CA--C 1.552 1.031 0 O-C-N 120.884 -1.135 . . . . 2.79 112.764 173.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -55.52 -9.82 0.55 Allowed 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 127.615 2.366 . . . . 3.3900000000000001 117.272 -171.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.471 ' HG2' ' H ' ' A' ' 33' ' ' GLU . 7.0 ptmt -93.39 -50.39 5.47 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.741 1.385 . . . . 4.0300000000000002 114.741 164.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.471 ' H ' ' HG2' ' A' ' 32' ' ' LYS . 22.2 mt-10 -54.2 -41.12 68.26 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.663 1.985 . . . . 2.4199999999999999 108.933 176.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.455 ' CD1' HD11 ' A' ' 38' ' ' ILE . 0.9 OUTLIER -67.79 -47.94 67.72 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 114.333 -1.303 . . . . 2.3500000000000001 110.78 -175.635 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.632 ' HG2' HG21 ' A' ' 52' ' ' ILE . 68.3 mttt -55.24 -49.53 71.77 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.165 -0.959 . . . . 4.4000000000000004 112.108 171.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -66.78 -10.29 45.92 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.263 1.425 . . . . 3.4199999999999999 114.437 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.7 tt -94.27 -54.27 3.62 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.887 1.221 . . . . 1.9199999999999999 111.402 165.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.545 HD13 HD23 ' A' ' 55' ' ' LEU . 36.6 mt -53.52 -50.83 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 CA-C-N 119.978 1.263 . . . . 0.96999999999999997 110.999 -175.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.5 mtpt -71.99 -2.57 18.67 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.599 0.963 . . . . 3.9399999999999999 113.599 -177.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -101.97 -15.74 16.71 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.45 1.9 . . . . 3.1200000000000001 113.63 167.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -94.45 -55.07 3.29 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.423 1.489 . . . . 4.4199999999999999 112.544 178.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -68.69 91.04 0.42 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.806 2.042 . . . . 2.1899999999999999 110.332 -177.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.4 t -62.58 -17.04 59.26 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.876 1.27 . . . . 5.7599999999999998 112.5 173.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 28.0 mt -59.13 -25.74 64.12 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 127.908 2.483 . . . . 3.8500000000000001 113.765 171.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.67 -34.72 0.85 Allowed Glycine 0 CA--C 1.538 1.479 0 C-N-CA 125.233 1.397 . . . . 3.3700000000000001 116.456 170.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -67.17 -4.62 10.77 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.19 1.796 . . . . 5.25 114.762 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.5 tpt -69.89 78.71 0.47 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 123.514 1.626 . . . . 2.4500000000000002 109.795 167.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.6 ttmp? -94.53 147.65 23.06 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 127.894 2.478 . . . . 4.8499999999999996 111.658 -160.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -47.64 -44.39 26.92 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.984 2.113 . . . . 4.6100000000000003 115.463 -160.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.4 m -71.91 -35.46 69.7 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.002 1.274 . . . . 2.4700000000000002 113.36 176.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.7 m -74.36 -9.38 58.54 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.871 1.269 . . . . 2.3100000000000001 112.608 173.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.632 HG21 ' HG2' ' A' ' 35' ' ' LYS . 7.2 mm -79.75 -29.51 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-O 118.447 -0.787 . . . . 2.3700000000000001 110.908 166.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.36 -33.73 75.83 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.848 1.204 . . . . 2.5099999999999998 110.726 173.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -70.54 -43.42 69.57 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.174 0.897 . . . . 3.3100000000000001 112.507 168.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.545 HD23 HD13 ' A' ' 38' ' ' ILE . 37.1 tp -62.67 -46.42 88.29 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.387 -0.816 . . . . 1.95 111.559 178.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.09 -53.92 36.63 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 124.199 1.0 . . . . 2.7000000000000002 110.768 166.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 tmpt? -56.59 -28.81 61.16 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 120.243 1.383 . . . . 4.6100000000000003 113.25 177.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.2 m -83.76 -37.29 22.82 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.119 1.767 . . . . 1.8300000000000001 112.642 -177.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 11.0 mp -65.0 -49.87 68.54 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.538 0.735 . . . . 2.6000000000000001 110.661 163.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -88.97 59.69 5.13 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 127.406 2.283 . . . . 1.5700000000000001 112.139 -170.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.9 mtmp? -40.57 -32.69 0.22 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 127.456 2.302 . . . . 3.6499999999999999 115.764 -177.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -98.94 -6.51 28.66 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 115.651 1.722 . . . . 2.3599999999999999 115.651 -178.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.8 t 57.87 31.54 20.67 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.852 1.661 . . . . 2.7599999999999998 114.331 -178.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -69.07 -16.82 63.78 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.969 0.907 . . . . 2.2000000000000002 111.397 173.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.58 15.37 2.13 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 130.214 3.405 . . . . 3.98 114.368 178.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -131.18 133.84 45.92 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 127.841 2.456 . . . . 2.52 110.48 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.2 mm -107.34 99.45 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.129 0.972 . . . . 1.73 111.097 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -68.32 157.11 36.35 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.531 1.933 . . . . 2.8599999999999999 110.343 170.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.5 -35.23 52.56 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 120.13 1.332 . . . . 2.0299999999999998 113.001 179.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -63.91 -30.2 71.3 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.238 -0.914 . . . . 3.4100000000000001 113.182 174.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -83.56 -45.83 13.1 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.862 1.265 . . . . 2.6000000000000001 110.434 175.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -49.7 -44.16 47.97 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 126.19 1.796 . . . . 3.3900000000000001 111.812 176.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.5 t -60.56 -22.75 64.02 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 120.594 -1.317 . . . . 2.3500000000000001 114.121 176.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.7 t -68.89 -32.91 56.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 O-C-N 120.015 -1.678 . . . . 2.4399999999999999 110.882 176.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -60.55 -57.15 13.95 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.993 0.917 . . . . 1.8600000000000001 110.961 171.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -53.59 -43.49 68.61 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.965 0.906 . . . . 2.3599999999999999 111.344 176.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 58.9 m -51.97 -54.97 23.43 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.615 1.166 . . . . 0.93000000000000005 111.291 173.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 78.8 mtm -63.44 -43.04 98.57 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 118.817 -0.611 . . . . 1.72 112.412 -177.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 63.1 mt -63.21 -39.37 94.45 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.492 0.587 . . . . 1.3300000000000001 112.182 176.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.45 ' HB3' ' CZ ' ' B' ' 69' ' ' PHE . 87.9 m -65.06 -38.1 89.71 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 118.674 -0.679 . . . . 1.49 112.514 172.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 15.1 mtp -64.75 -36.07 83.13 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.453 1.024 . . . . 2.29 113.165 171.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.66 -53.08 53.06 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.295 0.952 . . . . 0.90000000000000002 111.946 174.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -65.04 -25.97 68.06 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.573 0.953 . . . . 2.46 113.573 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -60.31 -43.07 96.68 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.52 1.128 . . . . 3.0099999999999998 113.074 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -75.23 -45.02 42.97 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.014 1.326 . . . . 2.8100000000000001 111.358 178.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -49.76 -48.68 50.17 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.346 1.859 . . . . 2.0099999999999998 110.939 175.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -56.11 -27.12 52.67 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.462 1.505 . . . . 2.1099999999999999 113.386 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 43.6 mt -80.12 -27.87 39.08 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.184 -0.947 . . . . 1.53 112.432 178.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.404 ' HA ' ' HD3' ' A' ' 92' ' ' LYS . 66.2 mm-40 -87.36 -20.04 27.29 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.747 1.219 . . . . 2.73 113.888 175.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -82.28 -31.8 29.9 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 128.401 2.68 . . . . 2.8199999999999998 113.669 -178.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -92.82 16.35 12.63 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 125.185 1.394 . . . . 2.98 113.298 -176.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.404 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 36.4 mtpt . . . . . 0 C--O 1.252 1.199 0 CA-C-O 115.323 -2.275 . . . . 4.3499999999999996 116.104 -175.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 19.5 mtt . . . . . 0 N--CA 1.473 0.693 0 N-CA-C 108.223 -1.028 . . . . 6.5899999999999999 108.223 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.418 ' CD ' ' H ' ' B' ' 2' ' ' GLU . 1.6 mp0 -87.01 169.53 12.34 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 129.027 2.931 . . . . 6.04 109.461 178.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 41.3 p -65.95 156.04 85.07 Favored Pre-proline 0 N--CA 1.471 0.607 0 C-N-CA 123.663 0.785 . . . . 2.52 110.41 170.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -63.96 -23.9 67.68 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.341 2.027 . . . . 1.72 112.218 173.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 73.7 mt -75.07 -43.21 54.54 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.187 0.995 . . . . 3.3100000000000001 111.895 174.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -66.99 -28.57 68.36 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.011 1.278 . . . . 3.8700000000000001 112.086 168.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -36.07 82.88 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.188 -1.57 . . . . 4.9900000000000002 112.551 167.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.0 -44.79 68.64 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.287 1.035 . . . . 0.93000000000000005 112.371 171.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 50.2 mt -60.82 -42.36 97.54 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.86 1.209 . . . . 1.72 111.838 175.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 20.8 p -68.81 -37.48 79.25 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 117.776 -1.107 . . . . 2.0299999999999998 111.904 173.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 85.3 m -59.09 -42.81 91.37 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.944 1.247 . . . . 1.24 111.45 169.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 8.4 mtt -58.24 -51.44 69.77 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.678 0.791 . . . . 3.4300000000000002 110.61 175.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.32 -36.58 64.52 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 113.883 1.068 . . . . 1.76 113.883 173.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 90.7 m -63.22 -52.66 61.31 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.443 1.497 . . . . 0.70999999999999996 110.928 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.16 -39.1 65.92 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 114.878 -1.056 . . . . 2.5899999999999999 108.525 -175.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -57.53 -45.65 84.79 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.039 0.535 . . . . 2.1899999999999999 111.019 176.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 6.7 m80 -68.7 -29.46 67.9 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.776 1.028 . . . . 2.4100000000000001 113.776 177.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 18.7 ttmm -68.04 -28.31 67.28 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.35 1.06 . . . . 3.6099999999999999 113.475 176.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -85.79 -45.83 11.24 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.927 0.891 . . . . 2.7000000000000002 112.08 166.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 38.3 t -60.69 -27.25 67.73 Favored 'General case' 0 C--O 1.249 1.054 0 N-CA-C 114.524 1.305 . . . . 1.6699999999999999 114.524 -175.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.96 -2.25 90.28 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 116.637 -2.201 . . . . 1.46 115.268 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.4 mtp85 -75.11 -110.71 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.559 1.544 . . . . 3.75 110.207 172.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -44.37 129.55 6.49 Favored 'General case' 0 C--O 1.248 1.0 0 CA-C-N 120.48 1.491 . . . . 4.1699999999999999 111.201 171.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.43 -35.41 91.67 Favored Glycine 0 N--CA 1.469 0.848 0 CA-C-N 114.533 -1.212 . . . . 2.4300000000000002 115.64 -132.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 2.0 t -62.25 138.27 58.39 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.089 1.756 . . . . 4.1600000000000001 111.754 172.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -130.95 155.87 46.06 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.836 1.654 . . . . 6.1500000000000004 111.861 -169.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.0 mp 76.16 3.44 3.67 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 128.877 2.871 . . . . 4.1699999999999999 111.921 -157.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 10.9 p -143.47 149.03 36.98 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 131.322 3.849 . . . . 1.98 112.082 -166.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 50.4 mt -118.65 121.21 39.62 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.182 1.793 . . . . 2.0800000000000001 111.799 -176.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 4.7 t -91.77 -178.72 5.12 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.089 1.356 . . . . 2.2599999999999998 113.926 166.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 29.8 ttp85 -60.5 -23.91 64.9 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.144 2.177 . . . . 5.4299999999999997 116.597 -161.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 mptt -110.47 -19.44 12.93 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 115.095 1.517 . . . . 8.1199999999999992 115.095 172.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -54.8 -59.59 4.52 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.093 0.957 . . . . 2.3100000000000001 109.32 160.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -61.86 -39.66 92.64 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 127.101 2.16 . . . . 2.3300000000000001 110.963 -177.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -39.67 82.04 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.177 -1.577 . . . . 5.7699999999999996 113.993 178.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 32.7 tp10 -90.31 -21.46 22.04 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 118.003 -0.999 . . . . 4.0 112.611 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . 0.42 HD23 ' C ' ' B' ' 37' ' ' LEU . 5.7 tt -54.46 -62.37 1.7 Allowed 'General case' 0 C--N 1.343 0.315 0 CA-C-O 118.086 -0.959 . . . . 2.4300000000000002 109.499 164.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 35.1 mt -47.61 -57.62 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 C-N-CA 123.892 0.877 . . . . 1.29 110.479 -175.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -72.96 -2.39 20.78 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 113.894 1.072 . . . . 4.9900000000000002 113.894 -168.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 24.9 mttp -117.7 -33.6 4.48 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 120.358 -1.464 . . . . 3.1299999999999999 114.331 170.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -60.32 -41.32 93.24 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.839 1.255 . . . . 5.25 110.151 170.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -102.0 117.23 34.38 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 106.281 -1.748 . . . . 2.4500000000000002 106.281 158.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 9.2 t -110.1 -9.71 14.7 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.3 1.04 . . . . 3.8399999999999999 112.811 -171.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -54.61 -2.76 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 117.915 2.561 . . . . 3.9199999999999999 117.915 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.37 17.32 59.04 Favored Glycine 0 N--CA 1.476 1.307 0 CA-C-N 120.116 1.325 . . . . 4.6699999999999999 115.208 174.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.7 -163.4 1.02 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.359 1.464 . . . . 6.46 111.652 177.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 78.18 178.04 0.14 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.515 2.726 . . . . 3.2599999999999998 114.713 176.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -165.58 139.95 4.74 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.182 1.793 . . . . 7.3300000000000001 108.517 -175.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -61.56 -31.88 71.93 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 121.057 1.753 . . . . 4.7400000000000002 111.643 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.3 m -70.44 24.81 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.263 1.825 . . . . 3.0899999999999999 115.285 165.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -139.77 15.54 2.5 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.411 1.485 . . . . 2.6099999999999999 111.939 154.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 71.7 mt -112.28 -46.59 5.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.612 1.165 . . . . 1.3999999999999999 111.204 -176.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.83 -30.03 71.02 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.055 0.843 . . . . 3.71 111.586 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -78.6 -46.38 19.45 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 128.696 2.798 . . . . 5.3499999999999996 113.967 171.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 48.9 tp -58.25 -35.98 72.54 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.18 0.446 . . . . 2.5600000000000001 111.157 173.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.4 mmm -49.29 -46.24 46.24 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.899 1.28 . . . . 2.3199999999999998 111.194 171.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.3 mptt -68.72 -39.78 80.26 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.745 -1.222 . . . . 7.2000000000000002 112.129 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.5 t -64.98 -29.57 70.5 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-O 122.229 1.014 . . . . 1.8999999999999999 113.303 -176.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.2 mp -76.66 -21.35 55.56 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.594 1.158 . . . . 2.9399999999999999 112.717 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -89.14 127.67 35.74 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.968 1.307 . . . . 2.3399999999999999 110.133 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.32 11.53 21.05 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 120.616 -1.302 . . . . 3.8199999999999998 112.753 -170.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 33.4 p30 -163.45 -27.01 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.69 1.737 . . . . 2.3799999999999999 115.69 -165.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 29.9 t 70.38 51.96 0.36 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.436 1.495 . . . . 2.7999999999999998 110.603 -170.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 11.7 p30 -82.86 -54.57 5.0 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.48 1.512 . . . . 3.8999999999999999 109.871 -174.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 171.74 -25.5 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 131.656 3.982 . . . . 8.4299999999999997 113.881 169.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -154.96 154.54 32.74 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 125.331 1.452 . . . . 2.27 110.49 -163.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 3.1 mm -92.99 105.37 16.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 126.072 1.749 . . . . 1.6599999999999999 109.037 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.1 165.32 20.54 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.41 -0.806 . . . . 3.1499999999999999 110.631 167.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . 0.45 ' CZ ' ' HB3' ' A' ' 80' ' ' CYS . 0.4 OUTLIER -54.1 -38.57 65.51 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 120.421 -1.424 . . . . 3.73 112.997 178.642 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -76.67 -21.7 55.06 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.75 -1.219 . . . . 4.3899999999999997 113.69 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -69.75 -61.45 1.78 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.182 0.993 . . . . 2.2999999999999998 109.507 160.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.04 -32.85 70.13 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 128.504 2.721 . . . . 2.3100000000000001 114.866 -172.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 60.2 p -61.85 -14.75 36.34 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 119.482 -2.011 . . . . 1.76 113.299 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 5.1 p -60.67 -29.37 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 O-C-N 121.06 -1.025 . . . . 2.5499999999999998 112.486 170.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.436 ' CZ ' HD11 ' B' ' 79' ' ' LEU . 67.7 t80 -75.77 -47.72 24.72 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.506 1.522 . . . . 2.25 111.33 175.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 93.8 mt -54.67 -35.7 63.82 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.225 0.61 . . . . 1.49 111.555 169.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 19.3 m -63.14 -53.81 47.5 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.199 0.999 . . . . 1.03 111.312 172.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 19.8 mtm -56.45 -49.7 73.85 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.93 0.892 . . . . 1.6599999999999999 112.191 177.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.436 HD11 ' CZ ' ' B' ' 75' ' ' PHE . 85.2 mt -60.94 -43.83 98.12 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.33 1.052 . . . . 1.5 111.589 178.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.6 t -72.59 -28.79 63.01 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 113.08 0.77 . . . . 2.1499999999999999 113.08 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 86.2 mtp -67.22 -42.74 83.57 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 118.996 0.816 . . . . 2.5499999999999998 111.074 170.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.06 -27.25 69.27 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 118.711 0.687 . . . . 1.1299999999999999 112.706 173.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -73.31 -28.62 62.18 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.311 1.226 . . . . 2.79 114.311 170.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -65.65 -44.79 85.28 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 120.275 1.398 . . . . 2.7599999999999998 109.804 170.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -67.67 -31.84 72.1 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.135 0.974 . . . . 2.9199999999999999 110.614 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.11 -50.88 70.14 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.763 1.225 . . . . 2.8700000000000001 111.852 167.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -59.61 -33.08 71.04 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.501 1.52 . . . . 2.0099999999999998 112.243 -177.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 94.2 mt -79.27 -18.62 52.39 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.836 1.254 . . . . 1.6799999999999999 113.782 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -95.13 -11.79 27.56 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 114.381 1.252 . . . . 3.54 114.381 176.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -94.23 -50.21 5.38 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.556 1.542 . . . . 3.1899999999999999 112.798 174.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -82.0 52.63 2.01 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.274 1.43 . . . . 2.6600000000000001 111.792 -174.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 57.2 mmtt . . . . . 0 C--O 1.248 1.021 0 C-N-CA 128.558 2.743 . . . . 4.9299999999999997 114.609 171.515 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 108.471 -0.937 . . . . 7.1399999999999997 108.471 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -144.8 144.84 31.36 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 126.807 2.043 . . . . 3.7400000000000002 106.126 -165.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.9 p -62.64 163.6 14.92 Favored Pre-proline 0 CA--C 1.54 0.561 0 C-N-CA 126.334 1.853 . . . . 1.4299999999999999 113.547 -167.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -67.86 -12.76 36.41 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 122.406 2.071 . . . . 1.29 113.342 169.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.08 -38.08 32.48 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.718 1.145 . . . . 2.3100000000000001 110.891 174.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -55.7 -53.97 49.98 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 108.473 -0.936 . . . . 4.7000000000000002 108.473 166.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.6 mttp -64.38 -25.08 67.87 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 112.316 0.488 . . . . 3.5099999999999998 112.316 -176.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.41 -47.02 58.65 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.203 0.91 . . . . 0.93000000000000005 111.722 171.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 43.5 mt -62.83 -44.53 95.9 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.02 0.928 . . . . 1.54 111.387 176.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 88.1 m -61.51 -46.4 90.14 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.459 1.903 . . . . 1.45 111.908 173.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.8 m -61.67 -45.48 93.83 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.215 0.916 . . . . 1.47 110.468 177.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -60.49 -52.61 64.46 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.618 0.645 . . . . 3.7599999999999998 110.937 -177.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.7 p -63.95 -23.63 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 O-C-N 120.96 -1.088 . . . . 2.2000000000000002 113.318 177.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.9 m -65.87 -58.3 5.91 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 117.721 -1.133 . . . . 1.03 109.826 172.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -40.3 66.57 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.822 0.849 . . . . 2.1299999999999999 110.291 175.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -57.31 -49.59 75.61 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 124.718 1.261 . . . . 2.1699999999999999 110.433 -174.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -61.97 -42.22 98.88 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.274 -0.892 . . . . 2.2200000000000002 112.633 175.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -69.5 -36.41 76.46 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.838 -1.164 . . . . 6.8899999999999997 112.764 -176.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -85.12 -20.08 30.85 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.414 1.486 . . . . 2.3700000000000001 114.567 172.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.7 p -55.84 -32.23 63.43 Favored 'General case' 0 N--CA 1.485 1.303 0 O-C-N 119.79 -1.819 . . . . 2.4399999999999999 113.509 171.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 109.72 -131.31 10.41 Favored Glycine 0 C--N 1.34 0.792 0 CA-C-N 114.255 -1.339 . . . . 2.6699999999999999 114.298 126.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -123.32 -14.64 7.39 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 127.112 2.165 . . . . 5.1200000000000001 111.85 -171.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -131.59 153.3 50.03 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 126.96 2.104 . . . . 4.2199999999999998 111.705 -170.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.64 -124.32 34.19 Favored Glycine 0 C--N 1.337 0.625 0 CA-C-N 113.302 -1.772 . . . . 2.1800000000000002 109.75 -169.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 42.2 t -98.08 168.99 9.93 Favored 'General case' 0 C--O 1.252 1.19 0 CA-C-O 122.651 1.215 . . . . 2.9700000000000002 111.434 160.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -107.95 22.37 16.06 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 129.594 3.157 . . . . 4.96 111.987 175.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.4 tp -96.0 -5.02 42.12 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.463 1.105 . . . . 3.4900000000000002 110.386 153.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.1 p -150.6 135.69 17.68 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 113.173 0.805 . . . . 1.0800000000000001 113.173 -151.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.5 mp -98.53 108.91 21.72 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.783 1.233 . . . . 2.21 112.297 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.1 p -64.26 158.15 24.03 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 124.562 1.145 . . . . 3.04 112.54 167.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.7 tpt180 -44.39 -43.52 7.7 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.479 0.918 . . . . 4.6900000000000004 113.479 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.77 -33.53 66.36 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.039 1.125 . . . . 4.0599999999999996 114.039 179.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -64.86 -51.46 61.91 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.518 1.527 . . . . 2.21 108.589 173.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.3 tp -58.34 -41.64 85.07 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.027 0.931 . . . . 2.3300000000000001 112.732 175.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tmpt? -53.79 -33.68 56.74 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.41 0.684 . . . . 6.9000000000000004 112.385 177.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -79.51 -48.76 13.33 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 118.538 -0.744 . . . . 3.9700000000000002 111.191 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.3 tp -49.15 -59.84 3.31 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.306 1.042 . . . . 1.95 111.263 177.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.5 mt -57.99 -35.0 50.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 123.242 0.617 . . . . 1.1799999999999999 110.556 -177.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -72.71 -2.88 21.99 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.563 1.32 . . . . 4.2199999999999998 114.563 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt -133.1 -28.34 1.54 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 127.124 2.17 . . . . 3.1400000000000001 112.476 -172.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -68.54 -123.29 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 107.701 -1.222 . . . . 4.1200000000000001 107.701 144.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -56.98 -53.12 61.69 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 115.869 1.803 . . . . 2.3999999999999999 115.869 -158.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 17.0 t 62.07 -4.06 0.22 Allowed 'General case' 0 CA--C 1.558 1.269 0 N-CA-C 116.59 2.07 . . . . 3.9199999999999999 116.59 172.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -42.82 -49.56 5.76 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 115.911 1.819 . . . . 4.9299999999999997 115.911 -151.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.81 -37.13 0.43 Allowed Glycine 0 N--CA 1.468 0.78 0 C-N-CA 124.781 1.181 . . . . 3.6899999999999999 112.98 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -61.87 -35.36 78.07 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.214 1.006 . . . . 7.3099999999999996 111.834 172.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -71.37 63.53 0.38 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 127.027 2.131 . . . . 2.3100000000000001 114.347 -178.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.6 mmmt -92.26 165.23 13.21 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 129.285 3.034 . . . . 7.7800000000000002 109.788 161.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.509 ' CD ' ' H ' ' A' ' 49' ' ' GLU . 3.0 mp0 -42.38 -51.41 4.91 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.106 1.762 . . . . 4.7599999999999998 114.654 -168.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.1 m -71.99 -28.21 63.26 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 114.964 1.468 . . . . 2.9300000000000002 114.964 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.4 t -76.22 -27.52 56.85 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 120.316 -1.49 . . . . 1.8899999999999999 111.004 170.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 74.8 mt -74.11 -22.94 18.39 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 O-C-N 121.327 -0.858 . . . . 1.74 111.039 169.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.27 -51.28 54.87 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.91 1.284 . . . . 3.73 110.488 168.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.472 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 3.4 t70 -69.15 -39.74 78.62 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.269 0.47 . . . . 2.3199999999999998 112.269 178.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 57.4 tp -63.78 -50.9 67.19 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 116.524 -1.703 . . . . 2.0499999999999998 110.757 173.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.1 ttt -53.81 -48.53 69.78 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-N 121.305 1.866 . . . . 1.5700000000000001 110.31 174.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.472 ' HE2' ' HA ' ' A' ' 54' ' ' ASP . 2.4 tmmm? -56.37 -29.47 61.47 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.191 0.996 . . . . 3.4100000000000001 113.502 174.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 24.4 t -77.24 -33.2 56.1 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 120.215 -1.553 . . . . 2.1200000000000001 112.912 174.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 18.9 mt -80.56 -47.57 14.0 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.793 0.724 . . . . 2.1299999999999999 111.821 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -79.14 79.07 5.58 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 127.964 2.505 . . . . 2.1800000000000002 111.918 -163.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -68.32 -18.35 64.48 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 116.516 2.043 . . . . 3.7999999999999998 116.516 -177.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.84 -26.99 49.77 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 120.641 1.564 . . . . 2.6699999999999999 111.669 161.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.3 m 58.77 76.21 0.36 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.79 2.036 . . . . 3.5 111.413 177.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -146.27 -109.0 0.1 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.305 -0.861 . . . . 3.2000000000000002 110.082 -151.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -139.49 -20.7 0.93 Allowed 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 115.522 1.675 . . . . 5.6100000000000003 115.522 168.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -130.82 153.08 49.46 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 122.95 1.357 . . . . 3.8500000000000001 113.651 174.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 27.3 mt -90.2 113.9 27.02 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 C-N-CA 126.863 2.065 . . . . 2.3500000000000001 110.55 173.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -64.77 156.99 28.77 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.579 1.151 . . . . 3.6299999999999999 110.662 163.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -57.15 -28.98 63.22 Favored 'General case' 0 CA--C 1.549 0.937 0 O-C-N 120.897 -1.127 . . . . 2.9100000000000001 110.859 165.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.81 -25.88 63.98 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 120.097 -1.627 . . . . 6.2599999999999998 113.746 174.2 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -80.97 -53.21 6.64 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.672 1.189 . . . . 2.4199999999999999 109.288 170.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -48.67 -23.93 1.19 Allowed 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 127.273 2.229 . . . . 2.46 114.573 176.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 47.0 m -52.9 -36.22 59.11 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.647 1.579 . . . . 2.27 112.537 171.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 p -79.65 -30.24 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 121.621 -0.674 . . . . 2.1899999999999999 111.696 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -60.23 -56.91 15.76 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.749 0.82 . . . . 1.79 110.611 173.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.1 mt -58.84 -34.62 71.76 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.678 0.791 . . . . 1.6100000000000001 112.625 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 84.1 m -62.71 -54.27 41.84 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.459 1.104 . . . . 0.87 111.173 173.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 46.6 mtp -54.58 -47.02 73.83 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.243 0.928 . . . . 1.78 111.364 177.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.74 -50.21 71.96 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.401 1.08 . . . . 1.46 112.392 178.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 93.1 m -63.82 -33.95 76.83 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.192 0.906 . . . . 1.72 113.429 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 92.5 mtp -64.16 -43.89 93.79 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.221 0.918 . . . . 1.8400000000000001 111.129 175.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.53 -39.73 92.13 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.07 0.548 . . . . 0.72999999999999998 112.272 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -62.44 -31.64 72.38 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.387 0.884 . . . . 2.2799999999999998 113.387 174.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 15.2 t30 -73.29 -37.18 66.31 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.631 1.105 . . . . 1.79 112.134 178.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.88 -37.99 89.48 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.195 0.998 . . . . 3.0600000000000001 112.123 167.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.05 -43.38 91.7 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.865 0.866 . . . . 1.95 111.267 174.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -63.35 -32.2 73.56 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.367 1.467 . . . . 2.3599999999999999 112.007 176.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 35.0 mt -74.94 -17.97 60.47 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.189 -0.944 . . . . 1.4199999999999999 113.025 175.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -94.61 4.24 54.09 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.969 1.707 . . . . 2.6299999999999999 113.779 169.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -94.03 -49.35 5.82 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.889 1.276 . . . . 4.04 110.975 164.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -76.13 20.25 0.21 Allowed 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 126.083 1.753 . . . . 3.0800000000000001 114.251 -178.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.025 0 N-CA-C 118.151 2.648 . . . . 4.5700000000000003 118.151 -163.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 24.0 ptt? . . . . . 0 N--CA 1.475 0.784 0 N-CA-C 108.785 -0.82 . . . . 8.1500000000000004 108.785 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 18.2 mp0 -110.34 -109.41 0.34 Allowed 'General case' 0 CA--C 1.539 0.522 0 O-C-N 125.342 1.651 . . . . 5.2400000000000002 108.689 -151.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 2.6 p -123.03 169.31 10.18 Favored Pre-proline 0 N--CA 1.476 0.871 0 C-N-CA 125.259 1.424 . . . . 2.5600000000000001 111.175 -174.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -73.93 -10.65 23.2 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.393 2.062 . . . . 1.8100000000000001 112.744 169.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -67.9 -54.58 17.69 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.693 1.197 . . . . 2.75 111.662 -177.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -57.37 -30.85 65.21 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 118.996 0.816 . . . . 4.0899999999999999 111.979 175.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -74.89 -33.92 62.12 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 120.522 -1.361 . . . . 5.4000000000000004 111.848 176.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.22 -46.19 65.01 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.472 1.509 . . . . 0.81999999999999995 111.304 173.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.3 mp -66.65 -36.73 83.26 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.14 0.882 . . . . 2.4399999999999999 111.381 176.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 54.5 m -56.21 -48.36 76.58 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 121.592 -0.692 . . . . 1.55 111.07 166.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 90.4 m -62.46 -35.46 79.38 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.629 1.172 . . . . 1.1699999999999999 111.766 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -54.84 -59.9 4.1 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 118.439 -0.791 . . . . 3.5600000000000001 110.607 166.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 17.8 m -67.83 -17.89 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 CA-C-N 120.332 1.424 . . . . 2.1800000000000002 113.588 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 62.3 m -71.83 -48.87 43.19 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.752 1.621 . . . . 0.78000000000000003 111.171 171.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 64.5 p -58.07 -33.35 68.95 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 118.202 -0.904 . . . . 2.1800000000000002 110.101 166.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -72.76 -49.54 30.23 Favored 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 119.713 1.142 . . . . 2.4900000000000002 111.834 -175.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -72.63 -17.45 61.67 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 120.171 -1.58 . . . . 2.4100000000000001 114.459 178.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -82.72 -66.46 0.89 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.392 0.677 . . . . 4.6100000000000003 111.77 166.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -69.69 -29.98 67.54 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.591 1.087 . . . . 1.97 113.633 -175.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 19.9 p -70.91 -19.31 62.61 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 122.445 2.384 . . . . 1.8 111.986 172.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -94.04 17.69 58.28 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 126.886 2.184 . . . . 2.2000000000000002 113.477 168.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 51.2 tpt85 -72.9 -28.89 62.74 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.207 1.004 . . . . 3.5499999999999998 111.193 169.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -157.63 153.81 27.38 Favored 'General case' 0 C--O 1.251 1.149 0 C-N-CA 125.866 1.667 . . . . 3.4900000000000002 111.952 170.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.66 -136.35 36.89 Favored Glycine 0 C--N 1.335 0.528 0 C-N-CA 125.559 1.552 . . . . 2.79 112.014 168.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 11.4 m -58.02 128.42 37.0 Favored 'General case' 0 C--O 1.246 0.915 0 O-C-N 122.292 -0.534 . . . . 3.0 111.181 174.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -76.46 111.79 12.3 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 126.134 1.773 . . . . 7.6799999999999997 107.315 148.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 35.4 tp 141.72 -41.69 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 130.038 3.335 . . . . 3.9700000000000002 106.925 -161.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 71.0 p -121.6 141.71 50.83 Favored 'General case' 0 C--O 1.255 1.36 0 CA-C-O 123.22 1.486 . . . . 1.53 112.903 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 22.0 mt -93.72 95.98 9.51 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 111.83 -2.441 . . . . 1.75 107.267 157.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 6.6 m -65.58 155.97 34.15 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 120.721 -1.237 . . . . 2.3399999999999999 110.441 169.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 25.2 ttt180 -41.54 -29.1 0.15 Allowed 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 117.43 2.381 . . . . 4.2400000000000002 117.43 -174.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -85.88 -38.04 18.49 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 115.229 1.566 . . . . 4.5800000000000001 115.229 172.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -56.78 -48.53 77.7 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.049 0.94 . . . . 1.77 108.918 167.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 14.4 tp -63.52 -43.9 95.83 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.055 0.942 . . . . 1.8999999999999999 111.899 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . 0.544 ' HE2' HG21 ' B' ' 52' ' ' ILE . 23.4 ttmt -56.5 -47.17 79.88 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 119.268 -0.396 . . . . 3.0800000000000001 111.738 179.084 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.438 ' HG2' ' CE ' ' B' ' 40' ' ' LYS . 33.8 tt0 -59.61 -44.2 93.49 Favored 'General case' 0 CA--C 1.553 1.08 0 N-CA-C 113.452 0.908 . . . . 3.3500000000000001 113.452 174.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 31.3 tp -61.18 -55.67 29.61 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.812 1.245 . . . . 1.9099999999999999 111.186 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 19.7 mt -59.07 -52.57 59.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 108.889 -0.782 . . . . 1.0600000000000001 108.889 -178.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.3 -27.15 67.07 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 113.937 1.088 . . . . 5.79 113.937 -173.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . 0.438 ' CE ' ' HG2' ' B' ' 36' ' ' GLU . 35.9 mtmt -85.49 -53.81 4.96 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 120.093 1.315 . . . . 3.9100000000000001 114.516 170.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -72.73 -31.21 64.8 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 118.245 0.475 . . . . 4.79 110.937 -171.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -110.27 72.56 0.8 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.078 1.351 . . . . 2.4300000000000002 108.911 161.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.7 t -71.39 61.81 0.34 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.971 1.308 . . . . 3.5899999999999999 112.306 174.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.25 166.84 11.21 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 127.337 2.255 . . . . 4.4400000000000004 112.402 -173.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -85.9 -72.64 1.29 Allowed Glycine 0 C--N 1.338 0.649 0 C-N-CA 125.291 1.424 . . . . 3.5800000000000001 109.676 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.519 ' H ' ' CD ' ' B' ' 46' ' ' GLU . 1.2 pm0 -40.27 -30.61 0.11 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 128.831 2.852 . . . . 6.0499999999999998 115.258 164.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -72.99 53.37 0.35 Allowed 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.792 -1.193 . . . . 2.3999999999999999 111.431 163.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.465 ' HA ' ' HE2' ' B' ' 48' ' ' LYS . 2.7 mmpt? -59.09 159.81 6.91 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 123.157 1.456 . . . . 5.3200000000000003 111.443 172.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -76.87 -8.52 57.5 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.381 -0.825 . . . . 6.1299999999999999 113.103 -156.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 12.3 t -102.6 -14.76 16.62 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.022 1.729 . . . . 3.1600000000000001 113.872 162.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 4.5 m -62.44 -28.48 69.84 Favored 'General case' 0 N--CA 1.482 1.157 0 CA-C-N 121.259 1.845 . . . . 2.6200000000000001 110.493 166.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . 0.544 HG21 ' HE2' ' B' ' 35' ' ' LYS . 14.0 mm -52.36 -37.24 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 126.461 1.904 . . . . 1.3100000000000001 113.253 165.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -82.92 -27.22 30.75 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.164 0.985 . . . . 3.7200000000000002 112.592 -173.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.76 -46.94 67.49 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 118.428 -0.796 . . . . 2.5 110.461 161.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -54.56 -49.04 71.3 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.407 1.083 . . . . 2.46 110.558 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.42 -48.89 79.2 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.982 0.913 . . . . 1.9099999999999999 111.765 174.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -18.58 62.13 Favored 'General case' 0 CA--C 1.555 1.144 0 N-CA-C 114.634 1.346 . . . . 3.4700000000000002 114.634 172.123 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 3.9 m -94.13 -29.79 14.97 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.41 1.884 . . . . 2.7999999999999998 112.483 -179.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 96.2 mt -74.91 -49.14 21.3 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.475 1.11 . . . . 2.1499999999999999 111.082 165.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -82.84 63.92 7.19 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 125.998 1.719 . . . . 2.3100000000000001 111.643 -172.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 27.7 mttm -56.09 -20.47 17.35 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.084 1.754 . . . . 4.04 112.194 175.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -72.42 -32.58 66.46 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.511 1.924 . . . . 2.1600000000000001 113.877 174.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 21.2 t 62.93 29.38 16.51 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.675 1.19 . . . . 3.04 113.227 -161.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 10.0 p30 -86.44 -14.53 43.0 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.4 1.48 . . . . 2.1699999999999999 112.462 -177.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 69.46 2.06 3.58 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 128.979 2.911 . . . . 5.0300000000000002 116.923 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -100.53 147.34 26.03 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 127.783 2.433 . . . . 2.8300000000000001 110.923 167.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 43.3 mm -106.4 103.52 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 108.128 -1.064 . . . . 1.1200000000000001 108.128 160.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.26 165.51 23.51 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.578 1.551 . . . . 2.5 110.738 165.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -52.59 -26.21 12.78 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 115.222 1.564 . . . . 2.2400000000000002 115.222 -175.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.3 -43.84 16.99 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 120.649 -1.282 . . . . 3.3700000000000001 111.647 177.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -55.92 -35.53 66.71 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.29 1.036 . . . . 2.3100000000000001 110.133 169.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -76.87 -38.55 53.45 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.365 1.866 . . . . 3.3199999999999998 113.498 176.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 51.9 p -73.05 -34.61 66.39 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 119.767 -1.833 . . . . 1.8600000000000001 111.72 176.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.8 p -69.28 -29.81 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.143 0.883 . . . . 2.46 112.352 172.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.568 ' CZ ' HD11 ' B' ' 79' ' ' LEU . 15.8 t80 -59.06 -57.79 11.5 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.179 -0.951 . . . . 1.7 111.382 166.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 96.6 mt -62.03 -29.47 70.3 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.462 0.705 . . . . 1.8899999999999999 112.321 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 45.5 m -63.37 -53.34 53.99 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.856 1.262 . . . . 1.46 111.622 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 74.1 mtm -59.41 -39.74 84.44 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 119.173 0.897 . . . . 2.0499999999999998 111.471 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.568 HD11 ' CZ ' ' B' ' 75' ' ' PHE . 95.8 mt -61.83 -56.43 19.54 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.12 0.568 . . . . 2.02 111.608 173.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 5.1 t -60.3 -32.45 71.22 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.218 0.917 . . . . 1.6599999999999999 112.592 -177.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 76.9 mtp -71.63 -33.15 68.7 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.841 1.052 . . . . 2.46 113.841 170.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.19 -35.51 81.03 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 120.535 1.516 . . . . 1.0900000000000001 112.391 172.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -64.25 -19.6 65.49 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.215 -0.928 . . . . 2.8100000000000001 112.947 171.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.72 -45.21 79.45 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.771 1.169 . . . . 1.8899999999999999 112.063 170.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.88 -46.3 78.87 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.565 1.146 . . . . 3.8500000000000001 110.244 177.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -53.08 -47.38 68.56 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.942 1.697 . . . . 2.73 112.19 175.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -61.15 -27.74 68.61 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.476 1.51 . . . . 2.3399999999999999 113.163 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 43.8 mt -79.38 -13.57 59.53 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.208 1.003 . . . . 1.98 112.949 178.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.419 ' OE2' ' HE2' ' B' ' 92' ' ' LYS . 44.7 mm-40 -108.21 8.53 27.95 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.161 1.785 . . . . 3.6499999999999999 113.081 168.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -107.03 -54.77 2.42 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.849 1.259 . . . . 3.6800000000000002 112.145 174.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.28 31.75 0.51 Allowed 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 124.904 1.282 . . . . 3.0600000000000001 112.678 176.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . 0.419 ' HE2' ' OE2' ' B' ' 89' ' ' GLU . 2.1 ptmm? . . . . . 0 C--O 1.257 1.469 0 N-CA-C 117.314 2.338 . . . . 4.5599999999999996 117.314 -157.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.5 mtt . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 121.244 0.545 . . . . 11.359999999999999 111.029 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -104.32 -51.14 3.17 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 124.715 1.206 . . . . 5.4900000000000002 113.267 -158.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 44.2 p -111.62 160.02 31.08 Favored Pre-proline 0 N--CA 1.468 0.474 0 CA-C-N 116.002 -0.545 . . . . 1.3799999999999999 111.845 -156.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -59.37 -21.22 59.94 Favored 'Trans proline' 0 CA--C 1.536 0.588 0 C-N-CA 121.771 1.648 . . . . 1.23 111.63 166.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.79 -49.9 14.78 Favored 'General case' 0 C--N 1.344 0.361 0 CA-C-O 118.333 -0.842 . . . . 2.4300000000000002 110.525 174.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -62.93 -33.02 74.47 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 120.792 1.633 . . . . 3.4700000000000002 111.875 176.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -67.92 -25.12 65.32 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.665 -1.272 . . . . 4.25 113.04 172.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.49 -44.53 34.99 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.827 0.851 . . . . 0.96999999999999997 111.936 172.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.7 mt -64.13 -40.53 96.37 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 121.107 -0.996 . . . . 1.48 111.962 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.6 p -61.97 -45.16 94.87 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 117.511 -1.233 . . . . 2.4700000000000002 111.162 171.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 54.3 m -53.91 -38.22 64.6 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 119.16 0.891 . . . . 1.29 111.54 173.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.1 tpp -56.3 -48.46 76.62 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 118.766 -0.635 . . . . 3.25 111.89 175.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.7 m -72.27 -29.53 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 119.462 1.028 . . . . 2.2200000000000002 112.67 175.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.8 m -57.43 -57.87 10.77 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.827 1.194 . . . . 0.93999999999999995 111.472 175.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.92 -24.51 58.52 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.62 0.768 . . . . 2.6600000000000001 110.311 -178.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -65.33 -59.23 4.26 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-O 117.982 -1.008 . . . . 2.0699999999999998 111.535 170.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 63.2 m-70 -58.78 -42.23 88.51 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 120.782 1.628 . . . . 3.1800000000000002 112.656 -175.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.5 tttt -39.55 -53.71 2.06 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.246 2.218 . . . . 5.7300000000000004 113.937 168.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -95.95 -29.47 14.14 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.31 1.226 . . . . 2.5099999999999998 114.31 -178.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.8 t -73.43 -34.12 65.28 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 127.073 2.149 . . . . 2.0 113.181 -177.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -73.57 -22.04 78.86 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 124.319 0.961 . . . . 2.04 112.338 170.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -86.21 68.74 10.36 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.188 1.395 . . . . 5.0199999999999996 110.206 -177.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.493 ' HG2' ' H ' ' A' ' 24' ' ' GLY . 8.8 tt0 102.78 -176.76 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 129.638 3.175 . . . . 3.9900000000000002 111.588 173.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.493 ' H ' ' HG2' ' A' ' 23' ' ' GLU . . . 57.93 -145.12 40.87 Favored Glycine 0 N--CA 1.47 0.926 0 C-N-CA 124.895 1.236 . . . . 2.0899999999999999 110.7 -170.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -79.51 169.49 17.96 Favored 'General case' 0 CA--C 1.553 1.066 0 O-C-N 121.504 -0.998 . . . . 2.4900000000000002 111.054 153.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.5 ptpp? -94.66 -5.65 45.11 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.66 1.584 . . . . 5.5499999999999998 115.161 -173.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 25.8 tp -100.96 4.54 42.6 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.609 1.564 . . . . 3.5800000000000001 111.012 169.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 55.0 p -142.6 144.94 33.06 Favored 'General case' 0 C--O 1.246 0.911 0 C-N-CA 125.991 1.717 . . . . 0.92000000000000004 112.397 -165.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 26.1 tp -113.72 88.12 2.77 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.787 1.635 . . . . 2.8199999999999998 108.891 -172.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -59.93 160.98 7.07 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.531 1.533 . . . . 2.0 114.922 -176.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.59 -20.32 1.16 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 128.374 2.669 . . . . 3.21 114.744 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.81 -26.09 13.89 Favored 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 119.98 1.264 . . . . 3.6899999999999999 113.629 167.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -66.16 -53.7 34.41 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.499 1.045 . . . . 1.6799999999999999 109.348 175.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 35.6 tp -50.82 -44.54 59.22 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.712 2.005 . . . . 2.0299999999999998 113.363 -176.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tmpt? -56.17 -34.99 66.72 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.137 1.375 . . . . 5.4000000000000004 113.012 -177.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -99.77 13.53 33.38 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.951 1.3 . . . . 4.3200000000000003 114.32 177.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.9 tp -96.69 -56.04 2.71 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.096 0.862 . . . . 2.6800000000000002 110.296 152.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 23.5 mt -60.46 -61.97 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 119.194 0.906 . . . . 0.93000000000000005 110.161 -168.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -68.31 -11.05 58.86 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.354 1.062 . . . . 4.54 111.982 -177.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.64 -42.12 29.58 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.741 1.616 . . . . 4.9900000000000002 111.303 173.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -103.28 -72.53 0.69 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.956 0.902 . . . . 6.9500000000000002 109.283 -178.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.1 mt -72.91 22.61 0.06 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 128.637 2.775 . . . . 3.6899999999999999 114.84 -171.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 26.6 p -51.8 -35.7 45.03 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.637 1.975 . . . . 3.5899999999999999 115.151 -175.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -62.03 -19.59 63.04 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.301 1.84 . . . . 4.29 114.941 -173.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -78.58 25.25 2.47 Favored Glycine 0 CA--C 1.532 1.12 0 CA-C-O 118.869 -0.962 . . . . 5.0199999999999996 113.308 172.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 56.93 20.33 5.24 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 126.54 1.936 . . . . 5.46 113.004 -170.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.4 ttm -82.21 37.88 0.52 Allowed 'General case' 0 N--CA 1.471 0.609 0 O-C-N 120.521 -1.362 . . . . 2.5099999999999998 113.151 -174.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.9 pttt -73.27 162.88 28.86 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.147 1.379 . . . . 4.8799999999999999 111.714 170.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -25.44 -60.8 0.07 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 128.677 2.791 . . . . 5.1500000000000004 116.39 -162.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.2 t -70.86 -10.11 58.95 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 115.029 1.492 . . . . 3.1699999999999999 115.029 -173.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.3 t -84.13 -13.83 51.91 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.593 1.157 . . . . 2.2000000000000002 112.594 168.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 12.3 mm -79.64 -32.59 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 O-C-N 120.212 -1.555 . . . . 1.5800000000000001 112.794 -173.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.18 -44.03 85.15 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.854 0.862 . . . . 3.0600000000000001 111.736 -175.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -72.12 -38.44 69.27 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 122.77 0.428 . . . . 2.3900000000000001 111.387 176.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.98 -49.18 78.68 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 118.679 -0.677 . . . . 2.52 110.134 174.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.42 -44.44 89.07 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.396 1.478 . . . . 1.8700000000000001 111.753 177.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -55.93 -30.82 62.25 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.033 0.933 . . . . 4.0800000000000001 112.751 172.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.65 -23.57 42.46 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.52 1.128 . . . . 1.6899999999999999 113.181 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.5 mt -89.19 -34.14 16.78 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 114.866 1.432 . . . . 1.9099999999999999 114.866 -173.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -82.07 154.65 25.49 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 120.787 1.631 . . . . 1.74 112.582 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -127.84 10.65 6.55 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.067 1.747 . . . . 3.5600000000000001 113.137 175.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -121.69 -33.28 3.63 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.699 1.2 . . . . 2.4300000000000002 114.151 -165.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.5 t 76.66 23.07 1.1 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.938 2.495 . . . . 3.96 112.602 -167.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.9 p30 -76.91 -24.57 52.48 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.833 1.653 . . . . 2.3799999999999999 111.59 177.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 67.39 19.82 10.04 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 128.652 2.781 . . . . 4.3099999999999996 113.784 -166.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . 0.432 25.9 pt-20 -132.61 132.36 42.41 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 126.207 2.908 . . . . 2.1099999999999999 115.978 167.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 20.1 mm -74.59 107.31 5.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-N 112.072 -2.331 . . . . 1.0900000000000001 106.868 177.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -62.15 152.57 32.68 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.478 -1.237 . . . . 4.5099999999999998 108.899 172.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -58.38 -25.88 62.56 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 120.652 -1.28 . . . . 2.1499999999999999 113.371 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -69.69 -34.65 74.22 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.1 0.96 . . . . 3.9700000000000002 113.403 171.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -79.22 -36.91 39.33 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.318 1.447 . . . . 1.8799999999999999 110.229 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -53.69 -35.71 61.4 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.012 1.325 . . . . 2.04 112.201 174.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.9 m -56.03 -30.09 61.36 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 120.799 -1.188 . . . . 2.0699999999999998 113.458 170.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.5 t -71.37 -35.92 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.924 0.889 . . . . 2.1600000000000001 110.565 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -59.95 -50.29 74.32 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.75 0.82 . . . . 1.75 111.925 176.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.03 -49.98 74.14 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.28 0.632 . . . . 2.7000000000000002 110.544 175.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.9 m -52.9 -52.65 56.88 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.302 1.441 . . . . 0.69999999999999996 112.091 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 40.4 mtp -55.41 -48.27 74.65 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.388 1.075 . . . . 1.9099999999999999 112.284 178.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.3 mt -66.6 -43.28 85.24 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.461 0.704 . . . . 1.47 111.721 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 68.6 m -60.73 -33.72 73.34 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 118.293 -0.86 . . . . 1.8100000000000001 113.013 173.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 89.9 mtp -68.11 -34.97 77.38 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.627 1.103 . . . . 1.9199999999999999 112.481 172.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.47 -43.85 84.34 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 119.645 1.111 . . . . 1.21 111.818 170.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -64.49 -24.03 67.48 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.555 0.946 . . . . 2.2999999999999998 113.555 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -67.41 -44.71 78.12 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.309 0.959 . . . . 2.7000000000000002 112.333 174.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -70.67 -46.01 63.99 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.584 1.554 . . . . 2.7799999999999998 111.393 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -51.55 -50.07 60.78 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.998 1.719 . . . . 2.1099999999999999 110.763 174.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -60.09 -29.02 68.31 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.197 1.399 . . . . 2.3700000000000001 112.906 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.8 mt -76.59 -15.47 59.84 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 118.207 -0.902 . . . . 1.52 113.12 178.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -104.31 -20.32 13.8 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 114.849 1.425 . . . . 3.0099999999999998 114.849 172.154 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -94.13 -44.81 7.83 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 126.973 2.109 . . . . 3.6200000000000001 113.45 -171.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -88.34 11.8 15.78 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 124.07 0.948 . . . . 3.5299999999999998 113.198 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . 0.25 4.0 ttpt . . . . . 0 C--O 1.25 1.112 0 C-N-CA 129.063 2.945 . . . . 3.6499999999999999 113.1 -169.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 35.1 ttp . . . . . 0 N--CA 1.482 1.138 0 N-CA-C 108.04 -1.096 . . . . 5.7300000000000004 108.04 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -34.52 135.47 0.17 Allowed 'General case' 0 N--CA 1.442 -0.845 0 O-C-N 125.774 1.921 . . . . 6.8499999999999996 110.68 146.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.9 p -56.36 158.82 7.18 Favored Pre-proline 0 C--N 1.317 -0.806 0 CA-C-N 112.597 -2.092 . . . . 1.9399999999999999 110.405 164.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -62.64 -20.85 72.05 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 121.784 1.656 . . . . 1.54 111.943 167.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -76.47 -50.89 12.9 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.262 0.937 . . . . 2.6499999999999999 111.143 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -52.89 -45.81 67.69 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 122.327 1.06 . . . . 4.5099999999999998 110.398 169.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 13.8 ttpt -63.0 -25.12 68.24 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.594 0.961 . . . . 5.1600000000000001 113.594 176.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.6 -49.8 43.9 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.938 1.245 . . . . 1.3 110.953 177.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 6.4 mp -61.65 -39.16 90.35 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.81 0.844 . . . . 2.6099999999999999 111.263 174.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 58.9 m -59.18 -50.76 72.79 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.412 1.485 . . . . 1.24 110.954 174.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 89.1 m -61.43 -36.31 80.01 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.218 1.407 . . . . 1.3400000000000001 110.706 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 1.6 ttp -56.24 -59.22 5.26 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.608 1.163 . . . . 3.77 111.82 167.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 78.2 t -60.89 -31.79 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 CA-C-N 120.828 1.649 . . . . 1.9399999999999999 112.684 178.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 87.4 m -72.0 -49.87 33.46 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.337 1.455 . . . . 0.83999999999999997 111.895 -176.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 7.4 p -62.8 -38.09 89.32 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 118.377 -0.82 . . . . 1.8799999999999999 109.302 169.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -58.3 -57.77 11.42 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 118.936 -0.554 . . . . 2.2000000000000002 110.74 -176.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -63.2 -36.67 84.42 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.582 1.083 . . . . 2.1600000000000001 112.599 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -76.77 -24.08 52.91 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.506 1.299 . . . . 5.0599999999999996 114.506 -176.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -91.34 -37.88 12.97 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 120.024 1.284 . . . . 2.0299999999999998 112.167 166.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 34.3 t -65.09 -28.64 69.59 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.416 -1.428 . . . . 1.8100000000000001 112.53 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.2 6.92 82.49 Favored Glycine 0 CA--C 1.534 1.252 0 C-N-CA 125.615 1.579 . . . . 1.3600000000000001 114.828 176.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 45.7 mmt-85 -57.57 -41.98 82.18 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 119.455 1.627 . . . . 5.1900000000000004 111.76 170.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -145.12 136.93 25.56 Favored 'General case' 0 C--O 1.256 1.418 0 C-N-CA 126.568 1.947 . . . . 4.2199999999999998 111.405 178.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.03 -118.45 6.56 Favored Glycine 0 C--N 1.34 0.802 0 C-N-CA 127.479 2.466 . . . . 2.6099999999999999 113.148 162.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.5 m -47.72 122.45 4.92 Favored 'General case' 0 C--O 1.246 0.878 0 C-N-CA 125.093 1.357 . . . . 3.48 112.057 170.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 15.1 pttm -106.64 4.14 27.61 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.023 1.729 . . . . 7.2699999999999996 114.811 -178.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.493 ' H ' HD23 ' B' ' 27' ' ' LEU . 1.6 pt? -102.19 -2.09 29.97 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.589 1.555 . . . . 3.9700000000000002 113.011 169.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . 0.438 HG22 ' HA ' ' B' ' 68' ' ' ASP . 7.7 p -137.89 147.02 44.06 Favored 'General case' 0 C--O 1.244 0.812 0 C-N-CA 128.677 2.791 . . . . 1.3600000000000001 111.539 -173.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -96.64 107.94 20.47 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.505 0.722 . . . . 2.4199999999999999 109.936 166.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.75 145.01 55.14 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.144 -0.687 . . . . 2.71 109.144 167.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 5.9 ttt-85 -41.69 -40.54 2.0 Allowed 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.654 1.581 . . . . 3.77 114.748 -173.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.427 ' HG2' ' H ' ' B' ' 33' ' ' GLU . 2.9 ptmt -61.07 -43.56 98.7 Favored 'General case' 0 CA--C 1.555 1.148 0 N-CA-C 115.247 1.573 . . . . 4.9699999999999998 115.247 173.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.427 ' H ' ' HG2' ' B' ' 32' ' ' LYS . 17.8 mt-10 -65.13 -49.6 69.3 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 127.58 2.352 . . . . 1.6299999999999999 107.697 176.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -55.04 -49.37 71.76 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.103 1.361 . . . . 2.3500000000000001 111.214 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -13.91 61.95 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 114.904 1.446 . . . . 4.7599999999999998 114.904 -175.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -84.21 -40.84 17.6 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 112.475 0.546 . . . . 3.1800000000000002 112.475 169.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 tt -50.9 -57.93 7.26 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.04 1.336 . . . . 1.8899999999999999 110.498 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 24.2 mt -59.1 -48.16 87.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 123.994 0.918 . . . . 1.1799999999999999 110.038 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.464 ' HZ3' ' CD ' ' B' ' 46' ' ' GLU . 16.4 tppt? -57.67 -21.51 40.56 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.966 1.306 . . . . 3.8300000000000001 112.986 -175.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 mttm -98.74 -42.62 7.13 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 114.32 1.23 . . . . 3.4199999999999999 114.32 165.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -50.83 -48.75 59.82 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 126.348 1.859 . . . . 5.0999999999999996 112.191 -177.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 73.1 mt -125.17 120.22 30.73 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.291 1.437 . . . . 2.54 109.213 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 44.2 t -84.21 -76.0 0.32 Allowed 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 107.733 -1.21 . . . . 4.4199999999999999 107.733 160.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 76.6 mt 52.68 -105.14 0.22 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.468 1.107 . . . . 3.3300000000000001 111.531 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -102.05 7.22 54.6 Favored Glycine 0 N--CA 1.484 1.851 0 C-N-CA 125.537 1.541 . . . . 3.1600000000000001 114.828 172.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.464 ' CD ' ' HZ3' ' B' ' 39' ' ' LYS . 0.7 OUTLIER 70.34 110.95 0.06 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 130.965 3.706 . . . . 8.4299999999999997 109.736 -170.942 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 84.6 mmm -58.73 -38.87 79.3 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.497 1.295 . . . . 2.8300000000000001 114.497 -174.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.412 ' HB2' ' HZ3' ' B' ' 48' ' ' LYS . 1.4 ttpm? 71.16 141.27 0.05 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.481 1.912 . . . . 3.8399999999999999 114.428 157.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -58.57 -31.47 68.03 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 119.922 -1.736 . . . . 3.73 112.043 -172.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 22.7 t -70.18 1.46 4.74 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 115.409 1.633 . . . . 3.3399999999999999 115.409 173.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 2.7 p -124.71 -41.62 2.12 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.259 0.936 . . . . 2.2599999999999998 111.959 157.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 84.6 mt -54.22 -41.91 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 124.434 1.094 . . . . 1.5 112.696 -176.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -63.53 -34.54 78.01 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 119.429 1.013 . . . . 3.2000000000000002 111.733 -173.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -93.82 -35.13 12.88 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.878 1.671 . . . . 4.6900000000000004 113.585 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 7.1 tt -53.37 -42.4 66.83 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.702 1.201 . . . . 2.6499999999999999 110.146 169.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.7 -48.42 72.48 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.639 1.576 . . . . 1.6399999999999999 111.44 171.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 13.4 mttm -59.73 -37.32 78.63 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 119.527 1.058 . . . . 7.0300000000000002 111.641 173.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 5.0 t -65.66 -22.62 66.66 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.018 0.927 . . . . 1.95 113.154 175.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 29.0 mt -77.64 -42.96 32.98 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.981 0.913 . . . . 2.0600000000000001 110.845 168.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -76.2 78.57 3.0 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.886 2.474 . . . . 1.8100000000000001 114.527 -162.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 65.6 mmtt -61.15 -13.1 15.21 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 115.505 1.669 . . . . 3.75 115.505 -170.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -120.05 2.62 10.96 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.862 1.43 . . . . 2.3399999999999999 114.862 176.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 23.0 t 62.96 18.94 11.28 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.702 1.371 . . . . 2.5699999999999998 114.702 172.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 47.5 p-10 -79.7 -11.29 59.86 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.924 1.689 . . . . 2.1400000000000001 112.337 -177.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 67.43 16.98 10.09 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 130.565 3.546 . . . . 4.8700000000000001 113.613 -175.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -111.51 141.5 45.0 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.653 1.981 . . . . 2.27 107.846 165.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 50.4 mm -108.33 102.59 14.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 O-C-N 120.152 -1.592 . . . . 1.25 107.791 172.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . 0.526 ' HB3' ' H ' ' B' ' 70' ' ' LYS . 88.9 m-20 -47.38 153.78 0.48 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.074 0.549 . . . . 3.3300000000000001 110.661 168.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -47.47 -25.8 1.19 Allowed 'General case' 0 CA--C 1.555 1.138 0 CA-C-O 121.839 0.828 . . . . 2.3100000000000001 112.75 158.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.526 ' H ' ' HB3' ' B' ' 68' ' ' ASP . 6.7 ttpm? -86.85 -25.31 24.58 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 129.108 2.963 . . . . 4.0300000000000002 114.952 176.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -80.81 -43.71 19.64 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 119.935 1.243 . . . . 1.8200000000000001 108.57 169.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -50.65 -31.32 15.87 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 129.812 3.245 . . . . 1.9299999999999999 115.659 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 30.9 t -53.23 -38.38 62.9 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.98 -1.075 . . . . 2.0299999999999998 112.124 171.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 57.4 t -67.24 -34.13 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 O-C-N 121.378 -0.826 . . . . 1.52 111.294 -177.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -59.76 -62.74 1.65 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 118.35 0.523 . . . . 1.8200000000000001 110.892 175.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 52.4 mt -62.31 -30.53 71.21 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.202 0.601 . . . . 1.8100000000000001 112.327 -176.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 91.1 m -58.32 -47.8 82.57 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.741 0.816 . . . . 0.81999999999999995 111.029 172.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 79.6 mtm -62.99 -38.21 90.26 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.017 0.826 . . . . 1.55 112.803 177.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 62.9 mt -61.28 -46.09 91.77 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.422 0.555 . . . . 1.55 110.503 173.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 97.1 m -60.84 -38.47 85.63 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.692 0.797 . . . . 1.8700000000000001 112.858 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 28.1 mmt -60.22 -41.41 93.02 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 118.854 0.752 . . . . 3.2799999999999998 111.941 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.91 -38.37 79.55 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.409 0.55 . . . . 0.87 112.054 177.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -71.84 -24.28 61.67 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.025 1.12 . . . . 3.1600000000000001 114.025 177.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -65.05 -46.13 82.51 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.509 0.724 . . . . 2.77 112.015 170.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.33 -44.49 91.38 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.58 1.552 . . . . 3.29 112.149 177.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -50.39 -48.96 55.71 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.025 1.73 . . . . 2.3500000000000001 111.734 177.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -64.83 -21.04 66.71 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.336 1.454 . . . . 2.5299999999999998 113.653 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 44.3 mt -84.24 -20.57 32.02 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.199 1.0 . . . . 1.6899999999999999 112.057 173.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -97.41 -10.15 26.02 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 115.074 1.509 . . . . 3.7599999999999998 115.074 174.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -88.36 -33.44 17.95 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.34 1.456 . . . . 2.8900000000000001 113.652 -177.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -80.05 -6.59 57.89 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 115.086 1.513 . . . . 5.25 115.086 -174.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 114.902 -2.475 . . . . 5.0499999999999998 117.469 -158.189 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 108.075 -1.083 . . . . 5.6500000000000004 108.075 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -109.32 143.15 39.22 Favored 'General case' 0 N--CA 1.432 -1.334 0 N-CA-C 106.982 -1.488 . . . . 4.0999999999999996 106.982 -159.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.543 HG21 ' O ' ' B' ' 40' ' ' LYS . 70.6 p -49.03 149.38 3.37 Favored Pre-proline 0 N--CA 1.47 0.537 0 C-N-CA 125.989 1.716 . . . . 1.4199999999999999 111.467 178.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -64.68 -23.13 63.73 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.25 1.966 . . . . 1.28 111.939 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.29 -44.25 46.69 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.858 1.263 . . . . 2.3799999999999999 111.865 174.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -53.24 -53.05 56.37 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.998 1.272 . . . . 4.7000000000000002 110.083 174.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 33.9 mtmt -61.98 -21.11 64.56 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 113.186 0.81 . . . . 4.3700000000000001 113.186 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.54 -45.24 31.51 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.82 0.848 . . . . 0.90000000000000002 111.369 170.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.6 mt -58.23 -47.28 84.02 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.474 1.033 . . . . 1.54 110.832 173.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -66.81 -37.49 84.62 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 116.348 -1.787 . . . . 2.2999999999999998 112.462 175.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 42.1 m -55.65 -42.97 75.79 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 121.415 1.916 . . . . 1.29 110.875 170.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 57.5 mtp -63.88 -47.03 82.27 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.996 1.319 . . . . 3.1499999999999999 112.033 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.517 HG21 ' HB3' ' B' ' 83' ' ' TYR . 58.3 t -65.69 -31.65 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 O-C-N 121.075 -1.016 . . . . 2.25 111.531 175.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 93.3 m -67.42 -56.58 9.07 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.565 1.146 . . . . 1.01 110.617 -179.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.0 p -57.97 -42.54 85.26 Favored 'General case' 0 CA--C 1.512 -0.512 0 O-C-N 123.737 0.648 . . . . 2.3399999999999999 109.461 178.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -67.74 -55.29 13.67 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.779 0.674 . . . . 2.54 111.412 -176.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -65.48 -29.7 70.39 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.382 -0.824 . . . . 2.27 112.353 -177.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp -70.76 -57.08 5.02 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.33 0.968 . . . . 5.6799999999999997 112.493 171.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 -67.71 -23.25 65.25 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.623 1.101 . . . . 2.1600000000000001 113.135 -178.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.3 t -62.99 -19.77 64.65 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.402 1.26 . . . . 2.0800000000000001 114.402 172.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.04 33.55 6.35 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 126.709 2.099 . . . . 1.3600000000000001 113.428 171.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -114.05 28.92 8.39 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.821 1.648 . . . . 6.1900000000000004 112.57 173.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.408 ' HG2' ' H ' ' A' ' 24' ' ' GLY . 4.1 tt0 126.8 -159.83 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.091 1 C-N-CA 132.666 4.387 . . . . 4.3399999999999999 110.26 171.968 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.408 ' H ' ' HG2' ' A' ' 23' ' ' GLU . . . 51.26 -141.24 21.84 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 124.876 1.227 . . . . 2.21 111.622 -170.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.8 t -86.86 179.7 6.68 Favored 'General case' 0 C--O 1.249 1.04 0 CA-C-O 122.203 1.001 . . . . 2.3500000000000001 111.786 158.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -104.44 140.88 37.31 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.434 2.294 . . . . 4.5899999999999999 108.705 166.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 9.7 tp 90.72 -18.26 0.17 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 131.063 3.745 . . . . 3.6699999999999999 110.98 -159.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.6 p -112.45 152.94 28.12 Favored 'General case' 0 C--O 1.246 0.898 0 C-N-CA 125.745 1.618 . . . . 1.3 114.957 177.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.9 mt -107.58 105.83 15.91 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.177 1.391 . . . . 1.45 111.687 163.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.9 t -62.0 160.98 11.42 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.78 1.232 . . . . 2.0899999999999999 111.227 163.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.4 ttm-85 -46.56 -21.88 0.23 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 126.465 1.906 . . . . 3.4700000000000002 114.906 -178.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.88 -38.65 10.18 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.126 1.37 . . . . 3.9900000000000002 112.854 -178.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -61.11 -46.46 90.51 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.693 1.197 . . . . 1.4399999999999999 109.559 172.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.7 tp -66.38 -49.43 66.9 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.53 0.732 . . . . 1.9399999999999999 111.398 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.1 ttmt -61.66 -37.17 83.06 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 113.15 0.796 . . . . 3.4900000000000002 113.15 -177.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -57.63 -58.53 7.94 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.764 0.825 . . . . 3.75 112.317 164.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.4 tp -53.29 -54.67 33.01 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.744 1.217 . . . . 2.1699999999999999 112.909 -174.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.3 mt -60.17 -33.65 54.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 118.332 0.515 . . . . 1.0700000000000001 110.896 -174.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.497 ' HZ2' ' CD ' ' A' ' 46' ' ' GLU . 23.9 mmmt -67.52 -12.27 59.94 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 121.096 -1.002 . . . . 3.3900000000000001 113.138 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 59.3 mmtt -92.66 -19.65 21.64 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.12 1.368 . . . . 2.6200000000000001 111.757 173.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -91.69 -93.12 0.14 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.632 1.973 . . . . 4.3600000000000003 106.589 178.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -75.52 24.99 0.11 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 128.901 2.88 . . . . 2.5299999999999998 114.544 -161.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 18.4 t -54.81 -25.68 29.83 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.64 -1.287 . . . . 3.0699999999999998 113.237 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.11 -21.43 66.35 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.83 1.652 . . . . 4.2400000000000002 115.332 178.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -108.51 -28.28 4.64 Favored Glycine 0 N--CA 1.476 1.305 0 C-N-CA 124.752 1.168 . . . . 3.79 112.236 163.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.497 ' CD ' ' HZ2' ' A' ' 39' ' ' LYS . 0.2 OUTLIER 83.72 139.59 0.06 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 129.411 3.085 . . . . 7.9299999999999997 111.644 170.001 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.6 mmt -109.07 105.51 15.03 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.51 1.524 . . . . 2.8500000000000001 111.151 -173.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -89.91 164.18 14.68 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.146 1.378 . . . . 4.9900000000000002 110.891 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.25 -50.06 51.22 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 120.997 -1.064 . . . . 5.9100000000000001 111.41 167.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.1 t -72.23 41.13 0.08 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.438 1.495 . . . . 3.6699999999999999 113.136 168.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.0 m -160.29 -41.42 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.884 1.674 . . . . 2.3199999999999998 112.66 177.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 33.8 mt -72.3 -38.73 62.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 119.367 0.985 . . . . 2.2999999999999998 112.086 -174.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -80.56 -23.1 40.18 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.757 0.823 . . . . 3.8100000000000001 112.016 -175.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -78.62 -38.99 38.51 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.283 0.633 . . . . 2.7000000000000002 111.673 165.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.79 -44.97 86.65 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.601 -0.714 . . . . 2.6800000000000002 109.509 169.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.2 ttt -58.94 -41.97 88.65 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.306 0.957 . . . . 1.53 112.039 173.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.98 -24.63 67.79 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 119.363 0.983 . . . . 4.2699999999999996 112.77 172.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 t -74.06 -33.18 63.61 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 120.48 -1.388 . . . . 2.3199999999999998 112.37 170.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.7 mp -80.75 -51.75 8.3 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 125.111 1.365 . . . . 2.73 112.816 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -72.69 135.55 45.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.753 0.787 . . . . 1.72 111.886 -178.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.51 -40.45 5.11 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.568 1.547 . . . . 3.5 111.939 178.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 43.4 p-10 -92.93 -11.16 34.06 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 116.389 1.996 . . . . 2.5499999999999998 116.389 -169.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.7 t 76.02 29.96 0.75 Allowed 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.881 1.672 . . . . 3.02 113.556 174.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.9 p-10 -90.31 -14.28 33.51 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 126.578 1.951 . . . . 2.3500000000000001 112.691 -176.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 76.27 13.08 2.61 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 128.71 2.804 . . . . 4.3099999999999996 115.674 -174.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -133.91 132.08 39.84 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.557 2.343 . . . . 2.8199999999999998 109.355 -176.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 18.1 mm -98.99 107.84 21.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 120.572 -1.33 . . . . 1.1599999999999999 109.979 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -63.59 161.53 14.55 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.97 0.805 . . . . 3.8100000000000001 112.782 170.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -48.78 -37.39 18.98 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 122.519 1.152 . . . . 2.48 112.21 169.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.17 -22.84 48.06 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 116.181 1.919 . . . . 6.71 116.181 174.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -78.91 -51.12 10.11 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.398 1.454 . . . . 1.8799999999999999 109.07 170.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -50.25 -22.58 1.81 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 128.055 2.542 . . . . 1.8799999999999999 113.418 175.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.3 m -53.59 -32.51 51.34 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.58 -1.325 . . . . 2.6200000000000001 113.309 170.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 p -75.46 -25.79 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 122.967 0.507 . . . . 2.1400000000000001 111.856 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -63.36 -60.65 3.1 Favored 'General case' 0 C--N 1.343 0.299 0 CA-C-O 118.426 -0.797 . . . . 1.9299999999999999 109.968 172.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -51.93 -46.65 64.76 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.999 0.92 . . . . 2.7799999999999998 111.328 -178.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 56.3 m -55.06 -58.81 6.12 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.906 1.282 . . . . 1.0900000000000001 112.239 176.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 61.0 ttp -59.07 -43.82 91.81 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.633 0.773 . . . . 2.3999999999999999 111.217 -178.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.22 -46.59 80.01 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.535 1.134 . . . . 2.6699999999999999 111.647 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 67.8 m -63.92 -40.92 97.58 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.157 0.583 . . . . 1.8700000000000001 112.307 176.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 59.5 mtp -62.88 -39.33 94.12 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.631 0.65 . . . . 1.8600000000000001 112.029 172.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.01 -37.04 86.31 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.373 0.669 . . . . 1.22 112.554 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -64.03 -28.03 69.52 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.847 1.054 . . . . 2.3199999999999998 113.847 173.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -65.86 -40.5 91.73 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 120.167 1.349 . . . . 2.2400000000000002 111.971 172.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -72.7 -39.52 66.92 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.687 0.795 . . . . 3.2999999999999998 111.697 178.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -52.78 -46.16 67.46 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.037 1.335 . . . . 3.8700000000000001 111.298 172.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -62.97 -27.25 69.27 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.488 1.515 . . . . 2.9399999999999999 113.228 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 37.5 mt -80.96 -21.43 40.38 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.543 1.137 . . . . 3.0699999999999998 112.452 176.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.411 ' CD ' ' HZ1' ' A' ' 92' ' ' LYS . 67.3 mm-40 -91.12 -10.24 42.66 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 115.142 1.534 . . . . 3.77 115.142 172.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -83.3 -44.18 15.2 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.737 1.615 . . . . 3.7799999999999998 112.719 169.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -81.72 54.53 2.43 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 126.916 2.086 . . . . 4.5700000000000003 112.348 -167.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.411 ' HZ1' ' CD ' ' A' ' 89' ' ' GLU . 45.9 mmtt . . . . . 0 C--O 1.253 1.272 0 C-N-CA 128.297 2.639 . . . . 5.5800000000000001 115.024 175.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.432 ' HA ' ' OE1' ' B' ' 2' ' ' GLU . 65.3 mtt . . . . . 0 N--CA 1.476 0.826 0 N-CA-C 108.703 -0.851 . . . . 8.2400000000000002 108.703 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.432 ' OE1' ' HA ' ' B' ' 1' ' ' MET . 12.1 mp0 -107.11 -125.59 0.24 Allowed 'General case' 0 CA--C 1.538 0.499 0 O-C-N 125.219 1.574 . . . . 4.8200000000000003 109.432 -151.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . 0.413 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 6.4 p -85.2 170.1 14.29 Favored Pre-proline 0 C--N 1.322 -0.593 0 C-N-CA 130.188 3.395 . . . . 2.8799999999999999 110.26 -169.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . 0.413 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 42.1 Cg_endo -69.83 -33.14 16.93 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 121.215 1.277 . . . . 1.8799999999999999 112.907 -172.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.01 -39.88 68.88 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.085 0.857 . . . . 2.5699999999999998 112.222 -172.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.93 -33.78 67.34 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.595 1.089 . . . . 4.1100000000000003 112.279 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -68.51 -32.28 72.13 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 120.678 -1.264 . . . . 4.7699999999999996 112.522 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -69.04 -51.58 37.55 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.421 1.088 . . . . 0.89000000000000001 110.201 175.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 57.5 mt -54.28 -46.19 72.66 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.584 1.154 . . . . 1.9199999999999999 111.769 174.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 64.4 m -56.65 -52.39 65.08 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.04 0.936 . . . . 1.28 111.181 172.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 51.7 m -55.49 -44.23 76.33 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.659 1.184 . . . . 1.22 111.471 -175.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 9.7 mtt -57.68 -51.77 68.18 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.062 0.945 . . . . 3.27 111.731 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 76.3 t -64.29 -43.59 97.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 124.204 1.001 . . . . 2.0 112.067 178.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 31.3 m -55.6 -58.04 9.44 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.787 1.635 . . . . 1.21 110.248 178.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . 0.403 ' HG1' ' HE2' ' B' ' 19' ' ' TYR . 0.7 OUTLIER -70.48 -37.85 74.29 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 117.406 -1.283 . . . . 2.6800000000000002 109.571 -174.747 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -57.34 -48.0 80.11 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 118.945 0.793 . . . . 2.1499999999999999 111.003 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.12 -31.97 71.92 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 118.684 0.674 . . . . 2.8300000000000001 111.337 178.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 39.0 tttm -69.74 -32.67 71.34 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.304 1.224 . . . . 4.6200000000000001 114.304 173.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.403 ' HE2' ' HG1' ' B' ' 15' ' ' THR . 69.5 m-85 -71.52 -31.55 67.19 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.763 1.225 . . . . 3.3999999999999999 111.569 166.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 40.3 t -70.82 -35.16 72.37 Favored 'General case' 0 C--O 1.244 0.785 0 C-N-CA 125.793 1.637 . . . . 1.97 114.86 -176.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.17 7.41 67.47 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 125.375 1.464 . . . . 2.2000000000000002 113.774 167.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.43 -14.9 59.6 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.224 1.512 . . . . 3.8700000000000001 113.496 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.563 ' HG2' ' H ' ' B' ' 24' ' ' GLY 0.281 3.5 tm-20 164.0 -167.46 0.01 OUTLIER 'General case' 0 CA--C 1.564 1.502 0 C-N-CA 130.666 3.586 . . . . 3.46 109.712 -176.868 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . 0.563 ' H ' ' HG2' ' B' ' 23' ' ' GLU . . . 58.47 -149.07 36.8 Favored Glycine 0 N--CA 1.467 0.751 0 C-N-CA 126.17 1.843 . . . . 3.1200000000000001 112.316 -174.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 41.4 t -66.92 154.73 40.32 Favored 'General case' 0 C--O 1.249 1.071 0 O-C-N 121.27 -1.135 . . . . 2.98 110.274 153.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.0 1.09 37.19 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.415 1.486 . . . . 6.2800000000000002 112.67 177.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 57.8 tp -92.61 -30.11 15.78 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.365 1.466 . . . . 3.6400000000000001 112.239 174.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 16.6 p -128.32 167.38 17.02 Favored 'General case' 0 C--O 1.252 1.202 0 C-N-CA 128.703 2.801 . . . . 1.48 113.679 -163.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 10.5 mt -101.35 114.03 27.64 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.07 1.748 . . . . 1.5700000000000001 110.972 167.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 2.0 p -69.58 165.58 20.79 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.138 -0.976 . . . . 2.9300000000000002 112.935 166.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -41.8 -30.4 0.25 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.905 1.282 . . . . 3.8900000000000001 114.271 169.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.1 -42.96 10.8 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 119.92 -1.738 . . . . 6.1500000000000004 113.082 178.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -52.65 -44.17 65.96 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.621 0.769 . . . . 1.8899999999999999 110.663 167.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.93 -42.99 97.22 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.427 1.891 . . . . 2.3300000000000001 112.404 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -56.45 -40.94 75.64 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 120.274 -1.516 . . . . 3.02 112.457 170.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -68.28 -43.53 77.53 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 117.974 -1.012 . . . . 3.1400000000000001 112.127 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.0 tp -51.41 -61.22 2.38 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 125.294 1.438 . . . . 2.4199999999999999 108.665 173.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 24.5 mt -54.3 -45.23 67.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 CA-C-N 118.739 0.7 . . . . 1.25 109.85 -173.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -72.65 -31.72 65.32 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.223 0.609 . . . . 4.9400000000000004 111.751 -172.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . 0.543 ' O ' HG21 ' A' ' 3' ' ' THR . 36.6 mttp -89.25 -28.16 20.11 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 120.624 -1.298 . . . . 3.4199999999999999 113.696 178.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -65.83 -61.42 2.07 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.768 1.627 . . . . 5.7199999999999998 110.654 166.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.49 101.46 5.63 Favored 'General case' 0 C--N 1.342 0.253 0 C-N-CA 124.601 1.16 . . . . 2.23 108.454 -178.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 5.2 t -70.4 30.82 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 114.557 1.318 . . . . 4.5899999999999999 114.557 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 70.1 mt -118.25 -15.53 9.76 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.158 1.783 . . . . 3.4300000000000002 112.959 -163.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 104.24 -118.84 6.08 Favored Glycine 0 C--N 1.34 0.761 0 C-N-CA 124.454 1.026 . . . . 4.6600000000000001 112.62 177.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -92.5 111.3 22.84 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 113.328 0.862 . . . . 8.4299999999999997 113.328 -164.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 84.0 mmm -65.5 -28.52 69.25 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.823 0.82 . . . . 4.1900000000000004 112.07 155.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 tptt 72.3 144.09 0.07 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.875 2.87 . . . . 6.1200000000000001 111.303 -174.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 20.4 tp10 -49.61 -43.84 46.8 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.268 1.027 . . . . 4.5 113.55 -168.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 24.8 t -66.95 -7.95 25.98 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.316 1.598 . . . . 3.4300000000000002 115.316 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 12.3 t -105.5 -6.49 19.37 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 120.072 1.306 . . . . 2.2400000000000002 113.228 167.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 45.0 mm -73.55 -44.4 53.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 CA-C-N 120.172 1.351 . . . . 1.8500000000000001 110.718 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -71.13 -29.88 65.79 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.812 0.845 . . . . 2.98 112.632 -178.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -71.81 -44.58 63.69 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.847 1.203 . . . . 3.6899999999999999 111.396 167.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.78 -49.61 70.5 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.832 0.742 . . . . 2.1800000000000002 109.266 176.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 14.8 tpt -54.01 -51.32 64.35 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.794 1.638 . . . . 1.8 112.806 173.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -55.8 -39.33 71.17 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.571 1.548 . . . . 5.3099999999999996 112.195 173.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 30.5 m -74.48 -22.72 58.94 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.466 1.506 . . . . 2.04 110.664 -177.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 9.1 mt -83.17 -56.68 3.64 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.317 0.962 . . . . 1.75 113.212 169.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -70.82 139.57 50.96 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.877 0.695 . . . . 1.6599999999999999 112.877 -165.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 37.6 mmtm -135.02 -9.72 2.3 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.623 1.569 . . . . 3.8999999999999999 114.35 -175.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.23 -20.83 50.97 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.913 0.779 . . . . 2.5800000000000001 110.884 164.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 22.7 t 72.48 41.13 0.6 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.563 1.945 . . . . 2.7000000000000002 110.82 -178.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -114.43 -125.52 0.28 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.421 1.488 . . . . 3.2400000000000002 108.54 -167.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -144.04 -2.52 0.91 Allowed 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 116.753 2.131 . . . . 4.4500000000000002 116.753 165.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -113.66 141.82 46.76 Favored 'General case' 0 C--O 1.244 0.812 0 C-N-CA 125.853 1.661 . . . . 2.8500000000000001 111.291 177.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 45.1 mm -89.9 111.17 22.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 127.948 2.499 . . . . 1.04 109.846 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.94 159.27 33.01 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 128.092 2.557 . . . . 2.54 111.278 162.061 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -54.08 -35.39 62.03 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.256 1.206 . . . . 2.1299999999999999 114.256 -176.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -71.85 -36.38 70.12 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.71 -1.244 . . . . 3.6200000000000001 111.42 177.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -64.11 -51.78 62.32 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 124.344 1.058 . . . . 1.6799999999999999 109.259 171.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -52.05 -43.4 63.78 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.531 1.532 . . . . 2.23 113.309 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 35.8 m -62.91 -21.08 65.77 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.354 -0.841 . . . . 2.6400000000000001 113.098 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 21.2 t -64.24 -40.11 87.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 CA-C-N 119.496 1.044 . . . . 1.6599999999999999 110.661 170.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -59.19 -55.43 35.02 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 118.753 0.706 . . . . 1.8899999999999999 110.665 177.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 66.9 mt -57.77 -38.28 75.16 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.581 1.152 . . . . 1.3899999999999999 110.781 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 99.8 m -61.91 -50.06 73.71 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.179 0.992 . . . . 0.81000000000000005 112.303 173.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.9 mtm -64.57 -37.39 87.4 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 119.559 1.072 . . . . 1.52 112.18 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -60.93 -52.63 64.23 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.63 0.772 . . . . 2.6600000000000001 111.953 172.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 93.8 m -63.86 -35.89 82.14 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.389 0.514 . . . . 1.8300000000000001 112.389 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 49.2 mmm -60.73 -42.92 98.27 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.721 0.808 . . . . 2.1600000000000001 112.834 170.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.6 -33.64 71.26 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.518 1.053 . . . . 0.77000000000000002 112.003 176.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . 0.517 ' HB3' HG21 ' A' ' 13' ' ' VAL . 4.4 m-85 -69.82 -23.67 63.35 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.022 1.119 . . . . 2.1699999999999999 114.022 175.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -55.29 -49.6 71.71 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 120.561 1.528 . . . . 2.4399999999999999 111.056 166.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.16 -36.44 58.72 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.103 1.761 . . . . 3.04 112.196 -174.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -54.82 -47.14 74.44 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.217 1.407 . . . . 2.3700000000000001 111.281 166.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -67.18 -25.82 66.33 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.474 1.11 . . . . 2.0299999999999998 112.941 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 71.6 mt -78.2 -26.83 47.71 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 118.112 -0.947 . . . . 1.72 112.824 174.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -97.39 10.94 38.34 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.561 1.544 . . . . 3.71 114.263 174.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -93.56 -54.36 3.69 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.739 1.215 . . . . 3.1200000000000001 112.047 162.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -82.66 37.73 0.54 Allowed 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 125.866 1.666 . . . . 3.1400000000000001 112.721 -176.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.26 1.607 0 N-CA-C 118.896 2.924 . . . . 5.25 118.896 -145.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.2 mtt . . . . . 0 N--CA 1.478 0.933 0 N-CA-C 107.918 -1.141 . . . . 7.5700000000000003 107.918 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -139.02 139.3 37.8 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 105.787 -1.931 . . . . 4.0 105.787 -165.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 79.4 p -60.93 162.7 11.68 Favored Pre-proline 0 C--N 1.325 -0.483 0 C-N-CA 126.077 1.751 . . . . 1.4399999999999999 113.869 -170.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -61.8 -18.52 61.19 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.421 2.081 . . . . 1.3400000000000001 112.504 164.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.12 -45.37 34.05 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.508 1.049 . . . . 2.3199999999999998 110.562 175.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -61.32 -37.9 84.93 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.905 -1.122 . . . . 4.5599999999999996 111.148 172.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -69.79 -31.54 69.52 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.019 -1.05 . . . . 3.4199999999999999 112.971 172.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.67 -48.52 66.41 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.743 1.217 . . . . 0.90000000000000002 111.603 173.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 74.6 mt -57.85 -47.38 82.86 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.89 1.276 . . . . 1.5800000000000001 110.66 172.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 89.2 m -54.13 -48.48 70.76 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.113 1.365 . . . . 1.6200000000000001 111.8 172.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 92.1 m -66.55 -35.82 81.16 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.968 1.307 . . . . 1.3300000000000001 111.553 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -45.69 66.94 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.717 0.807 . . . . 4.0599999999999996 111.699 176.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.2 p -65.31 -29.72 48.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 119.355 0.98 . . . . 2.1000000000000001 112.234 171.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 55.3 m -63.83 -54.77 29.88 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 117.654 -1.165 . . . . 0.87 111.074 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.6 p -60.01 -36.64 77.66 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 119.525 1.057 . . . . 2.1299999999999999 110.481 174.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -68.06 -54.55 17.47 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 119.379 -0.928 . . . . 2.1800000000000002 110.928 -175.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -64.67 -29.44 70.44 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.921 0.888 . . . . 2.5 113.276 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 58.4 tttt -62.95 -70.84 0.18 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 127.537 2.335 . . . . 5.04 112.579 166.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -65.68 -24.85 67.11 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.136 -0.978 . . . . 2.0899999999999999 112.099 -172.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.7 t -60.21 -26.68 66.58 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 114.9 1.444 . . . . 1.8700000000000001 114.9 170.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -95.37 5.86 67.99 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 125.802 1.668 . . . . 1.3600000000000001 114.083 175.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.43 -44.74 92.83 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.96 1.38 . . . . 3.8999999999999999 111.462 172.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -146.69 161.05 41.4 Favored 'General case' 0 C--O 1.253 1.28 0 CA-C-O 123.49 1.614 . . . . 4.6799999999999997 113.24 176.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.18 -128.57 47.73 Favored Glycine 0 C--N 1.34 0.77 0 C-N-CA 126.944 2.211 . . . . 2.04 111.733 164.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.0 m -52.72 125.27 16.17 Favored 'General case' 0 C--O 1.245 0.822 0 C-N-CA 123.189 0.595 . . . . 2.8799999999999999 110.33 166.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -83.33 -2.88 56.79 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.223 1.009 . . . . 5.3200000000000003 113.328 176.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 9.8 mp -89.88 -34.13 16.2 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.878 2.071 . . . . 4.2000000000000002 111.691 174.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -126.98 163.52 23.51 Favored 'General case' 0 C--O 1.254 1.313 0 C-N-CA 127.661 2.384 . . . . 1.3 114.874 -167.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -109.35 105.63 15.1 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 127.582 2.353 . . . . 2.5899999999999999 112.097 -171.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.7 t -84.42 164.45 18.87 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.789 2.036 . . . . 1.96 112.057 175.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.1 tmm_? -60.96 -22.15 64.16 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 116.509 2.04 . . . . 4.8600000000000003 116.509 -161.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.62 -41.27 16.54 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 120.635 -1.291 . . . . 6.0 111.901 166.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -54.46 -49.97 68.81 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 120.302 1.41 . . . . 1.4299999999999999 110.532 175.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -65.64 -45.84 81.5 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.956 1.703 . . . . 2.6400000000000001 112.452 -177.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.255 1.1 ptmt -73.0 -32.69 65.31 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 118.111 -1.436 . . . . 3.6800000000000002 112.67 176.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -61.9 -44.34 96.99 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.434 1.47 . . . . 3.5299999999999998 112.97 171.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.9 tp -51.64 -64.96 0.65 Allowed 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 126.292 1.837 . . . . 2.1099999999999999 110.161 170.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 84.6 mt -55.44 -45.56 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-O 118.349 -0.834 . . . . 0.94999999999999996 111.641 -176.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.428 ' HZ3' ' CD ' ' A' ' 49' ' ' GLU . 24.2 mmmt -55.32 -28.74 55.68 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 118.69 0.677 . . . . 3.7400000000000002 112.69 -174.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -97.52 -34.42 11.0 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.472 1.909 . . . . 3.4399999999999999 113.286 -173.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -85.28 -50.43 7.36 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.357 0.663 . . . . 5.3399999999999999 111.616 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.9 mp -92.76 54.89 2.31 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.678 1.591 . . . . 3.3100000000000001 109.518 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.5 t -79.67 35.92 0.31 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.506 1.122 . . . . 2.9900000000000002 113.586 -166.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -91.9 -8.59 45.93 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 116.76 2.133 . . . . 3.9199999999999999 116.76 -161.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 97.86 1.71 58.55 Favored Glycine 0 N--CA 1.474 1.202 0 CA-C-N 119.179 0.899 . . . . 2.9199999999999999 114.437 -176.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.7 -152.4 0.29 Allowed 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 107.941 -1.133 . . . . 6.6500000000000004 107.941 143.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.88 39.48 20.35 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 124.165 1.936 . . . . 2.0499999999999998 110.736 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -74.52 141.71 44.83 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 112.396 -2.184 . . . . 4.6500000000000004 109.586 174.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.428 ' CD ' ' HZ3' ' A' ' 39' ' ' LYS . 2.0 mm-40 -52.1 -39.92 60.51 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.799 1.778 . . . . 4.46 115.799 -148.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.1 p -78.4 -28.87 46.95 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 115.337 1.606 . . . . 2.6600000000000001 115.337 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.3 t -56.25 -30.77 62.85 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.999 1.32 . . . . 1.8300000000000001 110.99 172.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 3.1 mt -74.68 -25.56 19.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 C-N-CA 124.141 0.976 . . . . 1.8 112.497 -176.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -86.81 -30.33 21.59 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.627 0.649 . . . . 3.6099999999999999 111.642 178.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -71.82 -34.51 69.38 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.193 0.906 . . . . 2.8199999999999998 111.621 167.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 53.8 tp -61.28 -52.59 64.1 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 117.34 -1.314 . . . . 1.72 110.15 165.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.2 ttt -53.33 -48.87 68.1 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 121.421 1.919 . . . . 1.54 112.112 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.69 -29.83 8.14 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.779 1.632 . . . . 3.52 113.361 174.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 50.2 m -93.49 -29.01 15.76 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.278 1.831 . . . . 2.6899999999999999 112.486 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.4 mt -78.66 -30.45 46.25 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.253 1.021 . . . . 2.2999999999999998 112.596 175.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -73.02 70.63 1.05 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.394 1.477 . . . . 1.3799999999999999 110.769 175.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.3 ttmp? -50.97 -29.61 12.74 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 115.602 1.705 . . . . 4.2199999999999998 115.602 -162.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -95.15 -18.98 20.47 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 115.495 1.665 . . . . 3.0899999999999999 115.495 175.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 59.96 108.94 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.363 1.465 . . . . 3.8500000000000001 112.221 -153.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.4 p30 -140.0 -78.73 0.31 Allowed 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.962 -1.086 . . . . 2.8399999999999999 110.405 173.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -166.81 -28.79 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 130.615 3.566 . . . . 5.8399999999999999 112.218 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -154.4 166.79 32.13 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.564 1.145 . . . . 2.2599999999999998 112.81 -173.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 6.9 mm -98.07 108.78 22.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 125.275 1.43 . . . . 0.98999999999999999 112.376 -170.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -74.67 159.13 32.47 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.814 1.646 . . . . 2.7000000000000002 111.665 165.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -46.38 -45.99 18.17 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.124 -1.61 . . . . 2.6400000000000001 113.281 170.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.4 pttm -72.53 -6.59 45.01 Favored 'General case' 0 CA--C 1.55 0.964 0 O-C-N 121.329 -0.857 . . . . 3.1800000000000002 113.282 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -91.42 -61.26 1.69 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.359 1.464 . . . . 1.5900000000000001 109.34 163.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -54.84 -22.96 16.23 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 128.019 2.528 . . . . 2.8500000000000001 115.497 -175.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.45 -30.68 20.51 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 124.986 1.315 . . . . 2.6400000000000001 112.484 167.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.2 p -69.16 -36.26 72.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 119.083 0.856 . . . . 2.4199999999999999 112.184 176.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -60.98 -48.14 83.2 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 118.966 0.803 . . . . 2.1299999999999999 111.317 174.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 73.0 mt -63.21 -36.13 82.61 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.78 0.832 . . . . 1.9399999999999999 111.573 177.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 57.8 m -66.2 -47.12 74.93 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.573 1.149 . . . . 0.83999999999999997 111.228 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.9 mtp -57.41 -43.35 83.7 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.826 1.25 . . . . 1.79 111.705 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 72.8 mt -67.8 -45.02 75.95 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.595 0.758 . . . . 1.4099999999999999 111.725 178.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 5.4 m -59.84 -34.79 73.56 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.547 1.067 . . . . 1.3400000000000001 113.749 174.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 56.3 mtp -72.44 -34.19 67.62 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.438 0.563 . . . . 2.27 112.026 174.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.34 -47.07 68.47 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.591 -0.693 . . . . 0.80000000000000004 112.499 175.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -68.83 -26.63 65.26 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.361 -0.837 . . . . 2.3100000000000001 113.147 176.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -63.86 -49.75 71.54 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.679 0.791 . . . . 2.73 111.902 168.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -60.84 -46.4 90.72 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.319 1.048 . . . . 3.29 111.878 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -50.26 -50.87 48.81 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.559 1.544 . . . . 2.1800000000000002 111.494 175.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -64.28 -26.58 68.56 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.197 1.399 . . . . 2.0600000000000001 113.201 -177.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 32.5 mt -78.01 -18.91 55.35 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.812 0.845 . . . . 1.5 111.926 175.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.438 ' CD ' ' HZ3' ' A' ' 92' ' ' LYS . 71.0 mm-40 -91.9 -36.76 13.29 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.165 1.386 . . . . 3.4100000000000001 113.811 173.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -61.52 -28.51 69.36 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.399 1.88 . . . . 3.46 113.607 177.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -91.48 14.95 13.38 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 114.798 1.407 . . . . 2.7000000000000002 114.798 -169.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.438 ' HZ3' ' CD ' ' A' ' 89' ' ' GLU . 58.2 mttp . . . . . 0 C--O 1.251 1.147 0 CA-C-O 115.034 -2.412 . . . . 3.71 116.01 -177.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 79.9 mmm . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 120.668 0.27 . . . . 7.8399999999999999 111.313 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -86.0 128.35 34.84 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 123.803 0.841 . . . . 6.5 110.083 -157.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . 0.414 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 80.5 p -78.06 175.15 4.9 Favored Pre-proline 0 N--CA 1.472 0.656 0 C-N-CA 126.293 1.837 . . . . 1.6599999999999999 113.733 -165.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . 0.414 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 17.6 Cg_endo -52.0 -23.14 16.09 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 124.529 3.486 . . . . 1.53 114.954 163.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 56.1 tp -70.41 -48.64 55.13 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 120.092 1.314 . . . . 2.7200000000000002 110.29 174.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.09 -30.65 70.48 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.308 0.504 . . . . 4.8399999999999999 111.203 172.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 21.9 mmtt -66.27 -25.57 66.93 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 119.717 -1.864 . . . . 4.5199999999999996 113.126 169.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.28 -45.32 73.42 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 119.9 1.227 . . . . 0.98999999999999999 111.613 172.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -60.56 -43.2 97.51 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.711 1.204 . . . . 2.8999999999999999 111.655 170.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 25.9 m -57.32 -47.15 82.29 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.192 1.397 . . . . 1.28 111.496 173.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 87.0 m -58.68 -44.29 90.18 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.223 1.009 . . . . 1.3799999999999999 109.867 175.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 3.0 tpp -53.83 -51.47 63.44 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.292 1.037 . . . . 3.3700000000000001 112.61 177.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 10.6 m -67.6 -27.65 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 CA-C-N 118.801 0.728 . . . . 2.1800000000000002 112.511 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 66.2 m -68.34 -47.13 68.31 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.538 1.135 . . . . 0.75 110.93 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.91 -40.63 89.5 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.159 0.584 . . . . 1.73 110.007 166.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -63.66 -55.75 21.06 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 120.276 -0.57 . . . . 1.95 111.355 -169.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 18.7 m170 -62.35 -35.39 78.97 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.454 0.701 . . . . 3.5800000000000001 112.344 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -74.59 -29.85 61.48 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.489 0.922 . . . . 4.1900000000000004 113.489 -175.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -94.95 -37.55 11.1 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.994 1.318 . . . . 2.1099999999999999 112.426 175.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 84.1 p -57.65 -33.27 68.11 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.777 1.171 . . . . 1.9099999999999999 112.666 176.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.88 -3.4 73.75 Favored Glycine 0 CA--C 1.528 0.901 0 CA-C-O 116.378 -2.345 . . . . 1.3400000000000001 116.282 -170.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -65.29 -39.65 92.83 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.779 2.29 . . . . 4.9500000000000002 112.338 178.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -122.0 126.87 49.5 Favored 'General case' 0 C--O 1.254 1.298 0 C-N-CA 129.074 2.949 . . . . 3.3599999999999999 110.46 176.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.98 -128.55 42.6 Favored Glycine 0 C--N 1.337 0.61 0 C-N-CA 126.059 1.79 . . . . 2.1899999999999999 113.646 166.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -52.04 148.11 6.52 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.373 2.669 . . . . 3.3599999999999999 114.194 172.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -106.82 -6.32 17.79 Favored 'General case' 0 CA--C 1.553 1.059 0 N-CA-C 114.45 1.278 . . . . 6.4299999999999997 114.45 -175.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 97.0 mt -99.49 3.56 45.66 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.926 1.29 . . . . 3.3900000000000001 113.005 175.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 2.0 p -145.64 137.95 25.6 Favored 'General case' 0 C--O 1.246 0.871 0 C-N-CA 125.667 1.587 . . . . 1.23 111.938 -166.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 48.4 mt -84.45 126.97 33.74 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 114.605 -1.18 . . . . 1.97 109.926 173.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 3.1 m -105.92 150.34 25.75 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 127.037 2.135 . . . . 3.4500000000000002 110.291 -168.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . 0.494 HH11 ' HG3' ' B' ' 31' ' ' ARG . 5.6 mmm-85 -37.61 -46.69 0.88 Allowed 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 117.095 2.258 . . . . 4.3300000000000001 117.095 -165.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.71 -34.23 22.97 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 119.604 1.093 . . . . 4.0300000000000002 112.635 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -50.02 -36.54 29.07 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.386 0.994 . . . . 1.8300000000000001 111.087 165.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.404 ' CD1' HD11 ' B' ' 38' ' ' ILE . 0.3 OUTLIER -70.34 -37.98 74.77 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 112.606 0.595 . . . . 2.2999999999999998 112.606 -174.827 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 26.7 mmtm -63.91 -44.08 94.02 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.646 1.178 . . . . 5.6399999999999997 111.777 171.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 36.2 tp10 -74.5 -15.24 60.88 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 125.56 1.544 . . . . 3.0600000000000001 112.812 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 44.7 tp -96.85 -52.17 3.99 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 120.964 1.711 . . . . 2.1299999999999999 111.831 175.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.404 HD11 ' CD1' ' B' ' 34' ' ' LEU . 36.6 mt -52.03 -52.04 26.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 CA-C-N 121.306 1.866 . . . . 1.2 109.995 -179.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 tttp -71.8 10.96 0.58 Allowed 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 125.394 1.478 . . . . 4.7999999999999998 113.528 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -128.43 -39.7 1.66 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.43 2.292 . . . . 3.4399999999999999 113.941 175.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -70.98 -13.7 62.1 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 119.505 1.048 . . . . 5.1100000000000003 112.514 169.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -134.45 114.46 12.91 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.925 1.69 . . . . 2.3199999999999998 108.292 175.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 12.3 p -85.66 -11.37 53.98 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.548 1.684 . . . . 4.5899999999999999 115.548 -166.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -58.49 -11.99 3.5 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 117.659 2.466 . . . . 3.9399999999999999 117.659 -163.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.36 -49.56 2.67 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 125.188 1.375 . . . . 3.5600000000000001 113.617 177.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -71.13 66.64 0.42 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.7 2.4 . . . . 5.3300000000000001 110.24 174.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.58 -26.3 8.72 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.866 1.666 . . . . 4.0800000000000001 111.558 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 20.0 mtpp 72.54 84.5 0.12 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.869 2.068 . . . . 4.6900000000000004 113.287 159.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -27.76 -52.2 0.08 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 128.856 2.862 . . . . 5.0199999999999996 116.445 -178.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 3.0 m -57.83 -28.8 64.42 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.857 1.208 . . . . 2.8199999999999998 114.215 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 15.0 t -77.75 -8.2 57.64 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.368 1.067 . . . . 3.1400000000000001 113.765 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 49.3 mt -85.2 -40.06 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 120.322 1.419 . . . . 1.8700000000000001 113.804 -165.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.24 -23.41 61.22 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 118.981 0.81 . . . . 3.1899999999999999 111.221 172.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -76.15 -44.52 37.92 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.451 0.7 . . . . 2.73 111.504 169.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 51.4 tp -55.01 -45.65 75.13 Favored 'General case' 0 C--N 1.344 0.355 0 O-C-N 121.039 -1.038 . . . . 2.21 110.045 168.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . 0.415 ' SD ' ' HD2' ' B' ' 31' ' ' ARG . 4.6 ttt -58.26 -51.12 71.12 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.951 0.796 . . . . 1.9199999999999999 111.463 175.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -54.97 -28.39 51.2 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.649 1.179 . . . . 4.0999999999999996 113.311 173.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.0 t -81.2 -30.3 34.34 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.31 1.044 . . . . 2.0 112.933 177.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 96.1 mt -86.25 -35.89 19.71 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.0 1.32 . . . . 2.3100000000000001 112.798 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -75.94 70.99 2.72 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.489 1.915 . . . . 1.6599999999999999 111.129 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.91 -8.91 2.49 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.475 1.51 . . . . 3.21 114.996 -173.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -110.07 -0.63 17.93 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 120.05 1.295 . . . . 2.5800000000000001 113.71 172.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 73.8 m 55.81 33.93 22.46 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.176 1.39 . . . . 2.7799999999999998 113.628 -178.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -102.37 3.8 38.27 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 129.799 3.24 . . . . 2.46 112.033 -168.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 67.26 -10.3 0.35 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 131.117 3.767 . . . . 4.0599999999999996 115.454 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -109.74 144.88 37.52 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 126.163 1.785 . . . . 2.6499999999999999 110.391 175.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 19.8 mt -114.22 106.7 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 O-C-N 121.161 -0.962 . . . . 1.25 111.241 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -68.91 159.99 31.59 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.989 2.116 . . . . 2.8799999999999999 110.923 172.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.6 -35.48 54.42 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 120.145 -1.597 . . . . 2.5800000000000001 112.829 170.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -63.53 -25.05 68.07 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.623 0.769 . . . . 3.8999999999999999 113.059 173.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -89.47 -54.77 3.94 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 125.835 1.654 . . . . 1.8300000000000001 110.17 174.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -58.42 -32.19 68.42 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 127.0 2.12 . . . . 1.76 113.908 -176.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 9.1 p -53.88 -28.01 33.69 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.199 -1.563 . . . . 1.8999999999999999 113.587 168.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 59.7 t -72.31 -31.23 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 120.265 1.393 . . . . 1.6399999999999999 111.25 177.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -63.43 -54.51 35.47 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.556 -0.715 . . . . 2.4399999999999999 110.192 173.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 72.1 mt -54.33 -40.1 67.68 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.552 1.141 . . . . 1.3300000000000001 111.366 174.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.4 m -59.94 -53.97 51.58 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.047 0.939 . . . . 0.80000000000000004 111.544 176.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.9 mtm -60.55 -40.04 90.15 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.373 0.533 . . . . 1.6000000000000001 112.222 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 98.1 mt -59.27 -52.43 65.68 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.356 0.662 . . . . 1.5 110.685 174.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 93.2 m -59.28 -33.55 71.19 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.537 1.31 . . . . 1.6399999999999999 114.537 177.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 81.6 mtp -70.19 -33.72 72.07 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.71 0.804 . . . . 1.99 112.74 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.73 -34.76 58.09 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.42 1.009 . . . . 0.92000000000000004 112.079 171.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -62.03 -27.53 68.95 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.133 0.973 . . . . 2.29 112.926 175.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -60.9 -51.72 68.08 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.738 0.815 . . . . 2.23 111.154 170.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.7 -30.64 64.39 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 126.142 1.777 . . . . 3.2200000000000002 111.913 -176.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.68 -51.19 70.43 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.492 1.517 . . . . 2.1299999999999999 110.793 166.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -61.29 -28.32 69.11 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.786 0.834 . . . . 2.2799999999999998 112.336 178.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 63.8 mt -70.64 -39.72 73.5 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.5 -0.75 . . . . 2.1499999999999999 112.083 171.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -75.55 -19.13 59.51 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 115.087 1.514 . . . . 3.3500000000000001 115.087 177.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -78.43 -32.61 48.66 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.143 1.377 . . . . 4.1200000000000001 112.547 171.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -83.6 -8.55 59.29 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.696 0.999 . . . . 3.75 113.696 -173.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.892 0 CA-C-O 116.335 -1.793 . . . . 5.96 115.462 -167.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 107.565 -1.272 . . . . 5.96 107.565 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -115.76 -104.17 0.41 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 125.527 1.767 . . . . 4.0 106.856 -157.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 81.2 p -113.12 155.09 44.85 Favored Pre-proline 0 N--CA 1.466 0.343 0 C-N-CA 124.661 1.184 . . . . 2.0299999999999998 110.316 165.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -67.7 -16.23 46.05 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 121.95 1.766 . . . . 2.27 111.339 165.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.37 -50.44 65.55 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 123.871 0.868 . . . . 2.3700000000000001 111.02 -178.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -58.95 -43.58 91.3 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 118.778 0.717 . . . . 3.6299999999999999 111.777 173.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.37 -24.16 65.67 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.246 -0.909 . . . . 5.6900000000000004 111.428 -175.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.52 -49.94 23.97 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.789 0.836 . . . . 1.8 111.094 166.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.5 mt -53.64 -32.11 50.05 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.48 1.036 . . . . 2.4399999999999999 112.176 175.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.27 -40.8 62.21 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 117.571 -1.204 . . . . 2.4500000000000002 112.137 173.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.5 t -61.81 -26.09 67.89 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 120.288 1.403 . . . . 3.0899999999999999 112.187 -177.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 13.4 mtm -65.23 -37.43 87.23 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.798 0.839 . . . . 3.1299999999999999 111.026 174.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 67.1 t -76.81 -32.7 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.076 1.351 . . . . 1.98 111.357 173.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 51.6 m -64.04 -49.41 72.48 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.295 1.038 . . . . 1.1799999999999999 110.65 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.4 p -64.72 -33.31 75.66 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.691 0.678 . . . . 2.3999999999999999 110.108 173.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.41 -56.5 19.61 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 118.411 0.55 . . . . 2.3300000000000001 109.627 178.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -45.67 84.37 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 120.48 -1.387 . . . . 2.6099999999999999 111.68 -178.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -68.23 -49.1 62.94 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.151 -0.968 . . . . 6.29 113.373 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -76.97 -28.17 55.04 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.875 1.216 . . . . 2.1600000000000001 112.427 178.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.8 p -68.97 -25.57 64.6 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-N 120.955 1.707 . . . . 2.1600000000000001 112.274 170.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -82.91 3.7 82.85 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 125.96 1.743 . . . . 1.9299999999999999 114.298 167.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.6 ttt-85 -64.21 -31.7 73.0 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.865 1.832 . . . . 6.2300000000000004 111.25 171.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -157.41 147.39 20.61 Favored 'General case' 0 C--O 1.249 1.075 0 C-N-CA 124.226 1.01 . . . . 3.8900000000000001 112.878 178.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.49 -123.63 30.78 Favored Glycine 0 C--N 1.338 0.694 0 C-N-CA 126.129 1.823 . . . . 2.7000000000000002 112.636 160.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.0 m -47.13 112.5 0.53 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.83 1.252 . . . . 3.3599999999999999 110.752 169.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.16 24.85 2.36 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.582 1.553 . . . . 4.6399999999999997 114.372 -169.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.5 tp -143.44 -43.23 0.28 Allowed 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 124.971 1.308 . . . . 4.1200000000000001 110.559 -177.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 16.9 p -79.83 144.52 33.42 Favored 'General case' 0 C--O 1.248 0.996 0 CA-C-O 122.859 1.314 . . . . 0.93000000000000005 110.849 172.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 28.0 mt -88.26 92.17 9.06 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 105.916 -1.883 . . . . 1.7 105.916 165.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.1 t -60.5 149.77 33.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 119.009 -0.52 . . . . 2.04 109.994 169.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -37.61 -49.7 1.11 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.507 1.923 . . . . 3.9199999999999999 113.26 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.492 ' H ' ' HD3' ' A' ' 32' ' ' LYS . 0.8 OUTLIER -70.06 -28.58 65.56 Favored 'General case' 0 CA--C 1.554 1.121 0 O-C-N 119.51 -1.994 . . . . 5.4900000000000002 115.032 -179.837 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -74.91 -38.37 61.84 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.42 1.488 . . . . 1.5800000000000001 109.921 174.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.7 tp -63.4 -39.63 95.02 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.878 0.871 . . . . 1.8300000000000001 111.462 173.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.2 ttmt -55.25 -40.41 70.88 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 119.094 0.861 . . . . 3.8199999999999998 112.005 175.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -60.6 -59.03 6.04 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.963 0.905 . . . . 3.5099999999999998 111.647 170.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.7 tp -56.34 -48.77 76.09 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.412 1.485 . . . . 2.0699999999999998 113.641 -172.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.2 mt -53.57 -61.32 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 CA-C-N 118.64 0.655 . . . . 0.93000000000000005 110.246 -174.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.87 1.04 28.59 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 113.608 0.966 . . . . 5.1299999999999999 113.608 -172.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 43.6 mmtt -91.77 -33.58 14.94 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.012 1.325 . . . . 2.9300000000000002 112.859 174.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -89.24 -51.66 5.46 Favored 'General case' 0 CA--C 1.532 0.25 0 O-C-N 124.265 0.978 . . . . 5.2400000000000002 110.303 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 46.7 mt -78.96 67.27 4.62 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.714 1.206 . . . . 2.6899999999999999 111.33 -176.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 98.9 m -63.78 -12.95 39.82 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.349 1.611 . . . . 3.8799999999999999 115.349 -163.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.503 HD23 ' H ' ' A' ' 44' ' ' LEU . 1.6 pt? -99.69 0.59 42.21 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 126.789 2.036 . . . . 3.5099999999999998 114.733 178.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -82.51 121.77 5.54 Favored Glycine 0 CA--C 1.531 1.088 0 O-C-N 121.595 -0.691 . . . . 3.79 114.109 -168.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -72.78 60.17 0.5 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.008 1.723 . . . . 6.2599999999999998 111.347 165.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.3 mmt -78.19 68.99 4.33 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 124.054 1.883 . . . . 3.4199999999999999 110.793 173.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -58.84 113.87 2.27 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 113.083 -1.871 . . . . 5.04 108.301 174.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -52.35 -35.98 52.48 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 117.097 2.258 . . . . 4.7199999999999998 117.097 -136.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.9 t -57.62 -25.56 60.29 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 120.541 1.519 . . . . 3.6600000000000001 113.597 177.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.1 t -69.34 -17.92 63.75 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.991 -1.068 . . . . 2.98 113.611 174.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 17.8 mm -61.08 -41.74 90.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 119.897 1.226 . . . . 1.55 109.679 168.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -77.59 -39.05 46.9 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.61 1.164 . . . . 3.4300000000000002 111.89 -169.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.46 ' CG ' ' HE2' ' A' ' 57' ' ' LYS . 1.2 m-20 -79.33 -26.93 42.1 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.589 1.156 . . . . 3.9700000000000002 112.888 175.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 43.9 tp -59.88 -52.99 63.07 Favored 'General case' 0 C--N 1.344 0.326 0 CA-C-N 118.858 0.754 . . . . 1.97 109.116 159.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -55.99 -48.62 75.52 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.295 1.038 . . . . 2.1899999999999999 111.544 -176.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.46 ' HE2' ' CG ' ' A' ' 54' ' ' ASP . 16.3 mtmm -51.92 -36.98 50.89 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.838 1.255 . . . . 5.0 114.304 171.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 50.8 m -84.27 -18.82 35.17 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.177 1.391 . . . . 2.5699999999999998 113.882 -178.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 97.8 mt -83.93 -54.54 4.8 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 124.412 1.085 . . . . 2.1299999999999999 109.973 170.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -78.72 90.22 4.61 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.438 1.095 . . . . 1.6799999999999999 112.482 175.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -78.91 -2.39 39.72 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.95 0.722 . . . . 3.2200000000000002 112.95 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -83.03 -30.46 28.06 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 114.299 1.222 . . . . 2.0800000000000001 114.299 173.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 28.6 t 64.63 23.93 12.9 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.998 0.919 . . . . 3.02 113.131 -159.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 55.3 p-10 -81.8 -10.41 59.34 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.039 1.336 . . . . 2.3999999999999999 111.813 176.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 63.57 4.61 1.85 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 129.545 3.138 . . . . 3.6899999999999999 114.247 -171.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -106.52 131.03 54.17 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 128.508 2.723 . . . . 2.5099999999999998 110.002 175.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 35.0 mm -87.9 113.97 25.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 O-C-N 120.62 -1.3 . . . . 1.51 108.936 168.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -76.87 162.37 27.67 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.462 1.505 . . . . 2.6499999999999999 109.485 167.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.37 -43.3 79.06 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 119.91 -1.744 . . . . 3.1000000000000001 112.944 -176.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.1 pttm -70.19 -14.51 62.66 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.023 1.329 . . . . 3.1099999999999999 114.435 174.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -85.41 -41.76 15.14 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.506 1.123 . . . . 1.9399999999999999 110.666 168.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -57.48 -29.85 64.59 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.637 -1.289 . . . . 2.3100000000000001 112.637 174.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.0 m -51.49 -32.42 27.37 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.678 1.191 . . . . 1.6699999999999999 113.738 166.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 32.7 t -70.06 -39.91 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-N 119.652 1.115 . . . . 1.8700000000000001 109.597 179.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -64.76 -54.13 36.21 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 123.458 0.703 . . . . 2.1000000000000001 109.368 177.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.1 mt -58.58 -35.43 72.4 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.232 1.013 . . . . 1.8500000000000001 112.075 178.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 86.3 m -63.99 -55.65 20.82 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.378 0.99 . . . . 0.80000000000000004 110.509 175.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 77.2 mtm -59.75 -43.88 94.09 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 118.921 0.782 . . . . 1.51 112.193 -175.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.01 -51.97 64.76 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.928 0.891 . . . . 2.4300000000000002 112.215 174.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 8.9 t -63.06 -32.3 73.64 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.38 0.511 . . . . 1.3899999999999999 112.38 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 80.6 mtp -69.55 -32.67 71.61 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.11 0.782 . . . . 1.54 113.11 171.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.64 -43.09 94.78 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.81 1.186 . . . . 0.90000000000000002 111.776 172.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -63.68 -28.17 69.72 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.077 1.14 . . . . 2.2400000000000002 114.077 176.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -61.12 -47.56 85.68 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.805 0.73 . . . . 1.77 111.673 171.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -66.85 -43.94 82.36 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.322 0.649 . . . . 3.1899999999999999 111.414 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -51.08 61.71 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.73 1.612 . . . . 2.1400000000000001 111.609 175.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -66.55 -35.03 79.22 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.192 -0.942 . . . . 3.5299999999999998 111.789 -178.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.1 mt -68.55 -33.05 73.43 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.299 0.64 . . . . 2.3799999999999999 112.092 175.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -75.87 -35.62 59.83 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 114.054 1.131 . . . . 2.8199999999999998 114.054 177.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -71.9 -26.57 62.38 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.17 1.788 . . . . 3.6299999999999999 112.678 178.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -87.79 14.27 9.01 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.553 1.316 . . . . 2.6800000000000002 114.553 -177.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.954 0 C-N-CA 126.479 1.912 . . . . 4.3600000000000003 113.507 178.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.0 ttp . . . . . 0 N--CA 1.475 0.789 0 N-CA-C 104.493 -2.41 . . . . 5.2699999999999996 104.493 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.78 -170.16 2.85 Favored 'General case' 0 CA--C 1.557 1.231 0 O-C-N 124.083 0.864 . . . . 4.5899999999999999 109.104 129.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . 0.486 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 72.3 p -121.43 177.6 1.46 Allowed Pre-proline 0 N--CA 1.482 1.168 0 C-N-CA 125.057 1.343 . . . . 1.6399999999999999 113.677 -161.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . 0.486 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 24.6 Cg_endo -59.07 -31.02 94.81 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.47 2.113 . . . . 1.5 113.404 167.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.99 -48.41 71.31 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 119.642 1.11 . . . . 2.6600000000000001 111.409 178.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -64.77 -39.65 93.96 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 118.773 0.715 . . . . 3.7200000000000002 111.891 174.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -58.09 -31.14 66.83 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.354 -1.466 . . . . 4.6200000000000001 112.632 172.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.35 -31.36 72.1 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.977 0.808 . . . . 1.02 112.631 175.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 58.0 mt -65.82 -52.32 51.56 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.334 1.054 . . . . 2.1400000000000001 110.033 175.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 90.4 m -52.46 -43.64 65.06 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.998 1.319 . . . . 1.8799999999999999 111.51 172.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 59.7 m -64.58 -40.67 95.95 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.764 1.226 . . . . 1.5800000000000001 112.534 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 1.5 tmm? -74.48 -43.81 54.32 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 118.624 0.647 . . . . 3.75 112.598 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 16.4 m -61.76 -20.48 23.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 O-C-N 120.636 -1.29 . . . . 2.3999999999999999 112.065 174.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 98.4 m -63.59 -55.5 23.27 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 117.388 -1.291 . . . . 1.6599999999999999 111.782 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 17.0 p -66.79 -33.46 75.67 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 120.048 1.295 . . . . 1.9399999999999999 110.188 175.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -65.0 -46.52 81.06 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 120.803 -0.359 . . . . 2.1099999999999999 111.917 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 23.8 m-70 -64.21 -49.56 71.48 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.096 0.958 . . . . 4.3799999999999999 111.343 171.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -56.15 -43.5 78.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.664 0.785 . . . . 4.5300000000000002 112.763 -175.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -91.66 -31.42 15.85 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.611 1.164 . . . . 2.71 113.174 -177.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 72.9 m -65.81 -42.07 91.09 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 121.271 1.85 . . . . 1.8999999999999999 111.469 172.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.74 -3.39 90.35 Favored Glycine 0 CA--C 1.531 1.073 0 C-N-CA 126.632 2.063 . . . . 1.7 114.555 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -26.18 67.42 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.871 1.668 . . . . 3.3500000000000001 112.053 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.561 ' HG2' ' HE3' ' B' ' 32' ' ' LYS . 0.0 OUTLIER -149.91 167.53 26.38 Favored 'General case' 0 C--O 1.245 0.846 0 C-N-CA 125.676 1.59 . . . . 5.3200000000000003 113.107 159.673 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.11 -105.14 0.42 Allowed Glycine 0 N--CA 1.473 1.161 0 O-C-N 126.227 2.204 . . . . 3.2799999999999998 115.698 128.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -61.4 89.92 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 107.056 -1.461 . . . . 4.9100000000000001 107.056 163.198 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 37.7 mttm -93.09 -26.53 17.42 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 120.315 -1.491 . . . . 6.71 114.695 -158.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.429 ' H ' HD23 ' B' ' 27' ' ' LEU . 2.0 pt? -80.62 -26.2 37.9 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.904 0.882 . . . . 4.4400000000000004 112.242 172.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.1 p -103.76 151.23 23.28 Favored 'General case' 0 C--O 1.246 0.903 0 C-N-CA 126.932 2.093 . . . . 1.1399999999999999 113.18 -177.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 20.7 mt -76.65 101.54 5.79 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 106.189 -1.782 . . . . 1.6399999999999999 106.189 154.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.422 ' HB3' ' HE2' ' B' ' 32' ' ' LYS . 17.9 t -62.61 147.41 49.36 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.777 -0.823 . . . . 2.0899999999999999 108.777 165.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -41.75 -41.68 2.39 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.801 1.64 . . . . 4.1500000000000004 113.674 -174.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.561 ' HE3' ' HG2' ' B' ' 23' ' ' GLU . 0.2 OUTLIER -60.37 -49.26 78.3 Favored 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 117.167 2.284 . . . . 6.2699999999999996 117.167 168.439 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -64.69 -35.67 81.8 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.801 1.637 . . . . 2.3599999999999999 110.86 173.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 40.3 tp -62.6 -51.09 68.67 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.179 0.592 . . . . 2.0899999999999999 110.531 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . 0.511 ' HA ' HG21 ' B' ' 52' ' ' ILE . 20.4 mmtt -52.32 -39.77 61.02 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.782 1.233 . . . . 4.0800000000000001 113.183 177.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -68.29 -57.64 5.64 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.147 1.379 . . . . 3.73 111.855 172.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 24.4 tp -52.6 -58.93 5.21 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.457 1.903 . . . . 2.5299999999999998 111.585 -174.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.417 ' CD1' HG23 ' B' ' 52' ' ' ILE . 54.0 mt -53.98 -42.82 55.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 CA-C-O 121.626 0.727 . . . . 1.3300000000000001 110.46 -177.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 65.2 tttt -64.15 -18.26 64.27 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 113.145 0.794 . . . . 4.5899999999999999 113.145 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 19.6 mmtp -97.44 -45.57 6.39 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.178 1.391 . . . . 4.1699999999999999 112.294 167.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -61.76 -35.97 79.67 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.605 1.962 . . . . 4.0899999999999999 112.038 -170.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -110.96 -70.52 0.81 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.72 1.208 . . . . 2.1800000000000002 109.766 167.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 2.2 t 67.24 -64.91 0.24 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.18 1.792 . . . . 5.4400000000000004 113.118 -169.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.4 ' HB3' ' H ' ' B' ' 45' ' ' GLY . 4.2 mm? 30.36 -135.06 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 127.942 2.497 . . . . 3.6299999999999999 112.33 -171.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . 0.4 ' H ' ' HB3' ' B' ' 44' ' ' LEU . . . -89.0 -35.79 8.02 Favored Glycine 0 CA--C 1.528 0.874 0 O-C-N 120.303 -1.498 . . . . 3.21 111.057 165.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -89.72 -27.77 19.85 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.369 1.868 . . . . 6.79 114.632 -159.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.77 68.69 7.11 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 123.951 1.834 . . . . 2.73 111.92 -175.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp -134.3 161.22 35.56 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 129.12 2.968 . . . . 6.8499999999999996 108.487 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -40.57 -64.29 0.54 Allowed 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 116.619 2.081 . . . . 3.3999999999999999 116.619 -131.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 13.5 m -65.83 -25.62 67.29 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.272 1.212 . . . . 2.46 114.272 -173.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 5.3 m -62.41 -5.25 2.34 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.611 1.165 . . . . 2.27 112.898 170.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . 0.511 HG21 ' HA ' ' B' ' 35' ' ' LYS . 62.9 mt -110.33 -22.69 4.86 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 125.606 1.562 . . . . 1.3100000000000001 112.042 175.058 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -80.06 -48.76 12.77 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.262 0.937 . . . . 3.3100000000000001 112.313 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -68.67 -33.05 73.31 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 118.917 0.781 . . . . 2.7999999999999998 110.252 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 8.3 tt -62.12 -44.3 96.94 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 117.269 -1.348 . . . . 2.3300000000000001 111.073 172.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ttt -58.44 -48.91 79.17 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 121.943 2.156 . . . . 2.1499999999999999 112.133 169.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.23 -20.96 20.6 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 120.09 1.313 . . . . 5.4100000000000001 113.47 174.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 31.0 t -89.25 -38.1 14.47 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.967 1.707 . . . . 2.3799999999999999 112.738 176.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 7.3 mp -71.72 -59.7 2.62 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 126.504 1.921 . . . . 2.3500000000000001 111.809 174.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -78.66 95.15 5.2 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 127.869 2.468 . . . . 1.4199999999999999 110.748 -170.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.2 -39.89 84.02 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 114.418 1.266 . . . . 2.8399999999999999 114.418 -169.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 53.2 p-10 -99.91 -6.21 27.07 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.045 1.498 . . . . 1.9399999999999999 115.045 -173.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 17.9 t 64.02 26.41 14.06 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.776 1.23 . . . . 2.3700000000000001 113.742 -177.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 50.8 p30 -68.16 -15.98 63.81 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.406 1.482 . . . . 2.1000000000000001 111.493 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 64.58 22.32 12.62 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 129.273 3.029 . . . . 4.3799999999999999 113.563 -175.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -131.74 123.76 28.35 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 127.775 2.43 . . . . 2.98 107.562 175.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 18.8 mm -90.81 110.72 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 O-C-N 120.993 -1.067 . . . . 1.3700000000000001 111.662 -173.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -76.13 150.54 37.18 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.881 1.273 . . . . 2.6600000000000001 110.167 161.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.04 -33.11 72.77 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 119.96 -1.713 . . . . 2.8399999999999999 112.333 -174.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 19.1 pttm -74.32 -9.12 58.29 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.326 1.232 . . . . 3.5299999999999998 114.326 173.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -81.82 -53.19 6.39 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 108.011 -1.107 . . . . 1.78 108.011 157.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -61.37 -25.56 67.25 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 116.518 2.044 . . . . 3.6699999999999999 116.518 -172.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 94.4 p -65.53 -19.69 66.03 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.207 -1.558 . . . . 1.6399999999999999 111.886 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 1.2 p -69.36 -27.78 35.83 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 N-CA-C 113.0 0.741 . . . . 2.48 113.0 170.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 45.8 t80 -61.03 -51.25 69.99 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 120.822 -1.174 . . . . 2.4300000000000002 110.454 170.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 33.5 mt -59.71 -38.4 81.51 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.419 1.088 . . . . 1.3799999999999999 110.658 177.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.4 m -59.86 -54.21 48.82 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.725 1.21 . . . . 0.91000000000000003 111.417 174.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -55.31 -42.81 74.2 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.708 1.14 . . . . 2.1699999999999999 112.942 177.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 93.7 mt -63.83 -48.64 75.99 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.604 0.762 . . . . 1.73 111.52 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 75.1 m -67.58 -32.93 74.03 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 113.038 0.755 . . . . 1.6799999999999999 113.038 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 88.6 mtp -68.71 -36.04 77.95 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.643 0.656 . . . . 2.0499999999999998 112.082 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.91 -42.98 72.63 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 119.068 0.849 . . . . 1.1000000000000001 112.049 172.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -63.0 -25.76 68.54 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 119.686 1.13 . . . . 3.0099999999999998 113.77 176.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -62.54 -51.51 67.11 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 120.0 1.273 . . . . 2.0600000000000001 111.854 168.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -71.65 -29.34 64.52 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.578 1.151 . . . . 3.4100000000000001 112.456 -174.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -58.86 -56.5 21.41 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.584 1.554 . . . . 3.3199999999999998 110.678 164.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -60.17 -27.18 66.91 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.684 1.194 . . . . 2.2000000000000002 113.152 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 68.7 mt -66.37 -40.9 90.01 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 117.507 -1.235 . . . . 2.29 112.021 171.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -86.89 -1.73 58.04 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.782 1.401 . . . . 4.0899999999999999 114.782 176.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -76.43 -33.58 58.78 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 120.79 -1.194 . . . . 3.3199999999999998 111.605 159.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -102.86 7.96 39.31 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.506 1.523 . . . . 2.8799999999999999 113.918 -170.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 N-CA-C 118.844 2.905 . . . . 4.9000000000000004 118.844 -161.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 108.096 -1.076 . . . . 5.9400000000000004 108.096 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 17.6 mp0 -115.87 -119.43 0.31 Allowed 'General case' 0 N--CA 1.445 -0.725 0 O-C-N 125.91 2.007 . . . . 3.4100000000000001 106.887 -159.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.663 HG21 ' HA ' ' B' ' 41' ' ' GLU . 3.9 p -151.03 162.73 25.98 Favored Pre-proline 0 N--CA 1.472 0.628 0 N-CA-C 113.828 1.048 . . . . 1.6699999999999999 113.828 -138.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -63.65 -39.17 36.46 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.312 2.675 . . . . 2.9300000000000002 113.131 179.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.2 tp -71.29 -49.98 37.27 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.136 1.335 . . . . 4.0300000000000002 111.423 -177.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -63.55 -37.57 87.83 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.546 0.738 . . . . 5.3899999999999997 109.868 -177.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -67.53 -35.71 79.6 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 120.878 -1.139 . . . . 4.8700000000000001 112.55 171.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.16 -41.7 85.57 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.832 1.196 . . . . 1.4099999999999999 112.428 173.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.4 mt -62.74 -44.6 95.77 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.154 1.382 . . . . 1.76 110.211 172.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 68.4 m -53.45 -50.98 64.13 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.444 1.097 . . . . 1.6599999999999999 110.649 172.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 99.2 m -56.08 -48.96 75.11 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.727 0.811 . . . . 1.55 110.866 175.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 40.3 ttm -60.85 -45.85 92.9 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.99 1.316 . . . . 2.9500000000000002 112.432 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.3 t -62.65 -41.15 91.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 126.157 1.783 . . . . 2.1000000000000001 110.021 175.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 88.2 m -64.37 -50.7 66.67 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 124.24 1.016 . . . . 0.83999999999999997 111.138 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.3 p -63.66 -36.67 84.62 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.153 0.888 . . . . 2.1600000000000001 110.603 174.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -66.05 -53.18 41.6 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.328 -0.549 . . . . 2.3599999999999999 111.094 -177.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -69.81 -37.24 76.19 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.073 -1.017 . . . . 3.9300000000000002 112.887 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -70.74 -48.48 54.25 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 119.637 1.108 . . . . 4.0999999999999996 112.355 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -69.56 -23.54 63.57 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.17 0.896 . . . . 2.3799999999999999 111.601 172.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.0 t -64.5 -21.37 66.66 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 120.126 1.33 . . . . 2.0699999999999998 112.973 169.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.9 -3.76 79.62 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.128 1.347 . . . . 1.6399999999999999 114.946 174.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -67.11 -33.4 75.39 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.723 1.762 . . . . 5.1200000000000001 111.871 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -146.89 141.01 26.11 Favored 'General case' 0 C--O 1.249 1.03 0 C-N-CA 125.039 1.336 . . . . 3.9199999999999999 111.096 -178.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 45.53 -124.3 6.69 Favored Glycine 0 C--N 1.338 0.689 0 C-N-CA 126.232 1.873 . . . . 2.9900000000000002 112.131 165.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.4 m -41.77 114.33 0.52 Allowed 'General case' 0 C--O 1.245 0.857 0 C-N-CA 125.643 1.577 . . . . 2.6899999999999999 111.949 173.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 44.7 mtpt -86.75 109.94 19.58 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.518 1.527 . . . . 4.75 107.648 151.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.8 mt 152.03 -61.12 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 130.971 3.709 . . . . 3.8100000000000001 107.431 -164.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.3 p -111.64 160.07 17.58 Favored 'General case' 0 C--O 1.246 0.918 0 C-N-CA 127.022 2.129 . . . . 1.02 112.685 -171.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.2 mt -92.15 108.31 19.85 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 114.285 -1.325 . . . . 1.72 108.382 160.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.85 162.48 24.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.25 0.547 . . . . 2.1099999999999999 111.908 167.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.1 tpt85 -45.87 -27.69 0.93 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 127.682 2.393 . . . . 3.3500000000000001 114.829 -169.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.1 -28.89 12.07 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.552 1.141 . . . . 4.9699999999999998 113.244 177.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -58.0 -50.06 74.69 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.455 0.702 . . . . 2.6099999999999999 109.288 171.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.3 tp -62.42 -51.31 68.03 Favored 'General case' 0 C--N 1.344 0.369 0 C-N-CA 123.709 0.804 . . . . 2.1400000000000001 111.223 175.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.3 ttmm -55.77 -38.84 70.42 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 118.547 0.612 . . . . 3.4100000000000001 112.261 -176.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -70.79 -41.8 71.18 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 117.724 -1.132 . . . . 3.7599999999999998 113.228 176.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.02 -54.09 50.07 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.709 1.604 . . . . 2.3199999999999998 111.065 177.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.7 mt -53.25 -47.39 56.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 CA-C-O 122.167 0.984 . . . . 0.81000000000000005 109.221 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -67.59 -8.49 34.76 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 125.246 1.418 . . . . 5.6699999999999999 113.522 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -94.22 -50.33 5.32 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 119.848 -1.782 . . . . 3.6200000000000001 110.646 160.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 73.5 tt0 -52.25 -65.79 0.5 Allowed 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 128.999 2.92 . . . . 4.6200000000000001 111.862 -171.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -77.81 115.61 17.69 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 125.777 1.631 . . . . 2.2799999999999998 108.397 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 21.6 p -83.24 1.1 42.52 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.988 1.107 . . . . 5.9900000000000002 113.988 171.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -150.54 -172.56 4.22 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.07 0.948 . . . . 4.04 112.7 -155.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.71 9.1 50.8 Favored Glycine 0 N--CA 1.472 1.099 0 C-N-CA 124.207 0.908 . . . . 4.9800000000000004 114.996 170.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 54.32 32.61 16.65 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.431 1.492 . . . . 6.1100000000000003 112.703 -169.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.87 23.85 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.034 1.734 . . . . 2.8100000000000001 114.899 -177.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.0 mtpt -78.94 -168.09 1.34 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 127.895 2.478 . . . . 5.0899999999999999 112.133 -175.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -44.5 -62.32 1.23 Allowed 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 116.649 2.092 . . . . 4.8600000000000003 116.649 -161.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.6 t -71.77 -25.44 62.03 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.592 1.087 . . . . 2.4900000000000002 112.788 -175.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.3 m -68.41 -21.53 64.67 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.025 1.33 . . . . 2.7400000000000002 112.045 174.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 81.8 mt -80.9 -31.75 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 123.857 0.863 . . . . 1.51 111.939 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -73.56 -33.03 64.48 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.762 1.165 . . . . 3.5899999999999999 113.67 -174.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -70.77 -40.86 72.38 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 118.708 0.685 . . . . 2.3700000000000001 111.185 163.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.12 -47.82 82.12 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 118.474 -0.774 . . . . 1.8 110.296 178.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.5 mtp -53.42 -50.27 65.56 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 120.114 1.325 . . . . 2.2200000000000002 111.332 177.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.65 -35.11 67.99 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.245 1.418 . . . . 3.5099999999999998 113.064 174.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.7 m -84.58 -32.71 23.64 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.949 1.3 . . . . 3.27 112.656 -175.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 88.8 mt -76.34 -46.93 25.29 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 125.848 1.659 . . . . 2.5600000000000001 112.271 175.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -70.31 141.18 52.37 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.842 1.657 . . . . 1.6100000000000001 112.984 -172.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -112.44 -26.29 8.78 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 126.295 1.838 . . . . 3.7999999999999998 113.468 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.28 -23.02 57.35 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 120.349 1.431 . . . . 2.4300000000000002 111.652 175.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.8 t 70.53 41.64 0.94 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.701 2.4 . . . . 2.23 111.862 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -116.09 -117.24 0.32 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.94 1.296 . . . . 3.0600000000000001 109.249 -160.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -146.63 -10.35 0.47 Allowed 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 116.269 1.951 . . . . 4.4800000000000004 116.269 163.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -105.99 140.01 39.66 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 127.682 2.393 . . . . 2.75 110.937 177.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.2 mm -94.24 112.93 27.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 113.018 -1.901 . . . . 1.1699999999999999 109.938 177.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -61.21 157.08 16.98 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.674 1.19 . . . . 3.5099999999999998 111.01 163.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.76 -27.74 60.04 Favored 'General case' 0 CA--C 1.553 1.063 0 O-C-N 120.518 -1.364 . . . . 2.0899999999999999 111.697 164.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -69.93 -38.81 76.32 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.32 1.848 . . . . 3.7400000000000002 111.983 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 64.4 mt-10 -73.16 -51.86 16.31 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.761 1.624 . . . . 1.6699999999999999 109.246 173.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -49.98 -32.36 14.86 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.647 1.579 . . . . 2.1000000000000001 113.289 174.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.1 m -62.3 -30.81 71.41 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.466 -1.396 . . . . 1.6499999999999999 113.743 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.6 m -79.71 -25.05 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 CA-C-N 120.897 1.68 . . . . 2.5099999999999998 112.282 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -65.72 -64.07 0.95 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.329 0.651 . . . . 1.8700000000000001 111.279 172.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -53.82 -44.83 70.55 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 125.319 1.447 . . . . 2.4700000000000002 111.139 -178.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 48.6 m -59.2 -41.41 88.46 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 118.233 -0.889 . . . . 1.04 113.082 176.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 67.1 mtm -64.24 -36.04 82.8 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.12 1.327 . . . . 1.9399999999999999 112.204 175.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 78.3 mt -64.77 -43.65 92.58 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 118.866 0.757 . . . . 1.3799999999999999 111.752 173.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 79.8 m -58.57 -42.43 87.96 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 112.903 0.705 . . . . 1.9399999999999999 112.903 171.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 80.2 mtp -64.42 -32.97 74.81 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.687 0.676 . . . . 2.1499999999999999 112.559 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.09 -43.51 57.42 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.769 1.168 . . . . 0.81000000000000005 112.514 173.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -61.47 -31.82 71.8 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.298 0.954 . . . . 2.4399999999999999 113.152 175.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -57.41 -49.68 75.42 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.572 0.749 . . . . 1.97 112.866 169.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.93 -32.68 65.46 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.149 0.58 . . . . 3.3999999999999999 111.697 -174.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.81 -48.65 79.11 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.388 1.475 . . . . 2.48 111.152 166.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -63.65 -36.59 84.32 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.551 1.54 . . . . 2.7200000000000002 111.959 176.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 19.8 mt -72.33 -13.05 61.39 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.635 1.174 . . . . 1.99 114.029 -178.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -93.87 -1.75 54.37 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 114.782 1.401 . . . . 3.6699999999999999 114.782 168.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -105.09 -66.68 0.96 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.11 0.964 . . . . 4.4100000000000001 110.568 165.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -79.8 41.41 0.49 Allowed 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 127.423 2.289 . . . . 4.9199999999999999 112.303 177.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.6 ptpm? . . . . . 0 C--O 1.251 1.159 0 C-N-CA 127.563 2.345 . . . . 7.9699999999999998 114.924 -178.901 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.474 0.761 0 N-CA-C 108.508 -0.923 . . . . 5.0199999999999996 108.508 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -170.72 -172.63 1.22 Allowed 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 128.549 2.74 . . . . 4.4500000000000002 106.107 -153.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 64.3 p -81.47 154.69 71.57 Favored Pre-proline 0 N--CA 1.469 0.518 0 O-C-N 121.895 -0.503 . . . . 2.02 111.797 172.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -66.39 -9.16 22.94 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.507 2.138 . . . . 1.5600000000000001 112.576 165.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 tt -75.45 -58.64 3.16 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.186 -1.388 . . . . 2.7200000000000002 109.586 169.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -48.1 -52.39 20.6 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.864 1.211 . . . . 4.3499999999999996 110.613 170.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 2.2 tptm -64.7 -31.69 73.02 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 113.645 0.98 . . . . 4.3700000000000001 113.645 -175.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.34 -31.29 72.4 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.775 0.83 . . . . 1.01 112.418 170.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 22.3 mt -75.15 -34.62 61.64 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.818 0.735 . . . . 1.8200000000000001 111.255 173.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.4 m -59.52 -46.67 88.18 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.326 0.65 . . . . 1.4099999999999999 110.959 166.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 30.1 m -60.56 -42.0 95.72 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.921 1.289 . . . . 1.6599999999999999 111.463 174.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 41.6 ttm -57.66 -49.98 74.67 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.372 0.669 . . . . 2.8999999999999999 111.331 172.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 10.5 t -59.52 -35.9 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 124.675 1.19 . . . . 1.7 112.389 174.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 89.0 m -65.68 -47.75 74.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.72 1.608 . . . . 0.80000000000000004 111.819 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.55 -50.21 73.85 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.769 0.713 . . . . 1.79 109.579 167.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -62.19 -46.01 90.83 Favored 'General case' 0 N--CA 1.463 0.218 0 O-C-N 124.192 0.933 . . . . 2.4100000000000001 111.489 -164.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -74.23 -34.77 63.76 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.131 0.789 . . . . 2.5600000000000001 113.131 176.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 16.6 ttmm -69.8 -23.96 63.41 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.021 -1.049 . . . . 4.5300000000000002 113.218 177.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 49.4 m-85 -77.73 -39.61 43.88 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.59 1.156 . . . . 2.0499999999999998 112.235 160.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 17.5 t -59.78 -19.23 49.23 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 116.032 1.864 . . . . 1.8300000000000001 116.032 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.85 -13.3 83.56 Favored Glycine 0 CA--C 1.54 1.649 0 CA-C-O 118.759 -1.023 . . . . 1.53 114.803 170.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -86.67 73.81 9.96 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.067 1.934 . . . . 5.4000000000000004 110.83 176.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 88.72 -178.16 0.02 OUTLIER 'General case' 0 C--O 1.247 0.946 0 C-N-CA 127.378 2.271 . . . . 3.0099999999999998 111.624 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.51 -150.54 21.08 Favored Glycine 0 C--N 1.339 0.718 0 C-N-CA 124.994 1.283 . . . . 2.1600000000000001 111.538 -177.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 2.3 m -80.3 170.15 16.79 Favored 'General case' 0 C--O 1.251 1.155 0 O-C-N 121.967 -0.725 . . . . 3.2999999999999998 111.412 166.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 61.5 mttt -63.9 162.48 13.68 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 125.082 1.353 . . . . 7.1699999999999999 109.5 144.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 9.3 tp 66.61 -24.77 0.11 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.702 2.001 . . . . 3.46 114.486 -174.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 57.7 p -110.01 152.85 25.4 Favored 'General case' 0 C--O 1.245 0.845 0 C-N-CA 124.445 1.098 . . . . 1.28 113.673 178.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 51.9 mt -107.48 99.22 8.75 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.868 -1.06 . . . . 1.71 110.717 163.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 35.0 t -55.67 160.16 2.66 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.578 1.151 . . . . 1.8200000000000001 113.381 161.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -45.59 -24.77 0.37 Allowed 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 117.302 2.334 . . . . 3.8100000000000001 117.302 -175.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.29 -50.53 5.77 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-N 120.392 1.451 . . . . 4.0199999999999996 114.096 174.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -54.64 -37.18 65.35 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.314 0.646 . . . . 2.04 110.68 179.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 49.9 tp -76.05 -47.19 25.65 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.322 0.86 . . . . 2.3399999999999999 113.322 172.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 17.4 ttmt -52.54 -47.55 66.66 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 120.693 1.588 . . . . 2.9900000000000002 110.986 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.6 tp10 -67.5 -36.0 80.24 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 116.871 -1.538 . . . . 3.7200000000000002 114.253 -178.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 tt -57.82 -54.81 42.69 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 125.672 1.589 . . . . 2.0899999999999999 111.86 173.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 mt -56.67 -39.92 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 N-CA-C 108.849 -0.797 . . . . 1.2 108.849 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 52.8 tttt -70.97 3.13 3.57 Favored 'General case' 0 CA--C 1.559 1.316 0 N-CA-C 114.7 1.37 . . . . 4.21 114.7 177.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 17.5 mmtm -112.24 -57.98 2.2 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 126.097 1.759 . . . . 3.9399999999999999 110.487 166.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . 0.663 ' HA ' HG21 ' A' ' 3' ' ' THR . 3.8 mp0 -53.5 -49.96 66.4 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.211 1.805 . . . . 4.5099999999999998 111.894 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -84.22 53.48 2.64 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 120.255 -1.528 . . . . 2.2400000000000002 111.182 176.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 13.1 t -58.81 -13.34 5.91 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.837 1.255 . . . . 3.2200000000000002 113.531 171.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.415 ' CD2' ' H ' ' B' ' 44' ' ' LEU . 2.8 mm? -48.12 -36.78 13.94 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 127.747 2.419 . . . . 2.9100000000000001 112.57 164.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.77 9.27 81.38 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.127 0.87 . . . . 2.9399999999999999 115.058 166.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -63.59 -49.12 74.63 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.218 1.009 . . . . 7.3899999999999997 110.696 170.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.92 110.64 1.61 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.74 0.816 . . . . 2.3399999999999999 112.097 172.224 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -128.57 146.7 50.77 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.444 1.498 . . . . 3.5099999999999998 109.616 172.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -6.0 -87.96 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 128.243 2.617 . . . . 3.8900000000000001 116.762 -158.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.9 m -57.59 -23.05 48.74 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.297 1.592 . . . . 3.0600000000000001 115.297 -173.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 29.2 t -66.94 -18.62 65.47 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.121 -0.987 . . . . 1.8500000000000001 113.133 173.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 13.8 mm -72.78 -37.3 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 123.923 0.889 . . . . 1.3700000000000001 110.534 171.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -80.13 -37.87 32.65 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.215 1.006 . . . . 3.9399999999999999 111.859 -170.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -67.16 -35.45 79.72 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.492 0.553 . . . . 2.2999999999999998 112.492 167.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 9.6 tt -63.64 -44.78 92.85 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 118.01 -0.995 . . . . 2.4700000000000002 111.035 171.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 26.9 mtp -56.94 -45.59 82.67 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 120.127 1.33 . . . . 2.8900000000000001 110.936 175.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.3 tttm -52.06 -38.02 55.69 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.425 1.09 . . . . 3.8500000000000001 113.001 168.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.8 t -67.36 -33.61 75.58 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 120.818 -1.176 . . . . 2.0299999999999998 112.731 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 20.6 mt -83.03 -45.52 13.94 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 120.943 -1.098 . . . . 1.8799999999999999 113.486 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -79.39 87.8 5.02 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.51 1.924 . . . . 1.8100000000000001 111.33 -156.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.88 -30.33 70.08 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 115.05 1.5 . . . . 3.1699999999999999 115.05 178.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . 0.286 0.0 OUTLIER -78.41 -22.86 47.13 Favored 'General case' 0 CA--C 1.558 1.274 0 CA-C-N 119.273 0.942 . . . . 2.6699999999999999 111.959 167.183 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 8.1 m 53.21 62.71 2.53 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 126.82 2.048 . . . . 3.4100000000000001 113.146 175.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -141.05 -60.53 0.49 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 118.512 -0.756 . . . . 2.6200000000000001 112.171 -140.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 161.73 -35.81 0.0 OUTLIER 'General case' 0 C--N 1.345 0.374 0 C-N-CA 131.511 3.924 . . . . 6.3300000000000001 115.004 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -106.87 135.85 47.7 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 126.358 1.863 . . . . 2.29 108.888 -178.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.43 ' HA ' ' OE1' ' B' ' 71' ' ' GLU 0.257 14.6 mt -99.7 109.85 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.599 0.76 . . . . 1.27 111.47 169.98 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . 0.433 ' HB2' ' H ' ' B' ' 71' ' ' GLU . 41.1 m-20 -54.23 153.44 5.25 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.491 1.916 . . . . 3.6099999999999999 111.049 166.198 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.33 -35.13 62.37 Favored 'General case' 0 CA--C 1.552 1.03 0 O-C-N 120.533 -1.354 . . . . 2.1800000000000002 110.942 165.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.471 ' HE3' ' HA ' ' B' ' 70' ' ' LYS . 0.1 OUTLIER -70.19 -35.81 74.19 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 120.548 -1.345 . . . . 7.0199999999999996 113.122 176.965 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . 0.433 ' H ' ' HB2' ' B' ' 68' ' ' ASP . 57.1 mt-10 -65.03 -51.23 62.71 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 119.143 0.883 . . . . 1.71 108.734 168.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -56.8 -32.78 66.02 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 120.396 -1.44 . . . . 1.8999999999999999 113.898 -177.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 63.9 p -57.45 -21.95 40.31 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 119.748 -1.845 . . . . 1.99 114.466 171.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 59.6 t -64.94 -36.88 78.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 119.71 1.141 . . . . 1.6000000000000001 111.547 171.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -61.83 -47.26 85.87 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.809 0.843 . . . . 1.5800000000000001 109.86 173.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 47.1 mt -58.54 -50.53 73.46 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 117.406 -1.283 . . . . 1.74 110.698 178.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 98.6 m -58.66 -46.92 86.13 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.983 1.265 . . . . 1.0700000000000001 111.333 176.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 59.1 ttp -58.01 -47.74 82.14 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.547 0.739 . . . . 2.6400000000000001 112.321 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 94.4 mt -69.84 -46.75 64.92 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.869 0.692 . . . . 1.4299999999999999 112.869 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.76 -33.79 76.45 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.503 1.047 . . . . 1.53 111.646 -178.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 61.5 mtp -75.11 -30.39 60.84 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 118.054 -0.974 . . . . 2.21 113.1 172.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.0 -39.46 94.16 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 120.7 1.591 . . . . 1.1100000000000001 111.863 171.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -67.98 -13.08 61.9 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.491 1.293 . . . . 2.3100000000000001 114.491 173.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -69.43 -45.53 68.92 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.268 0.94 . . . . 2.98 111.912 170.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.0 -44.13 93.57 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.108 1.763 . . . . 3.71 111.643 174.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -54.26 -45.27 72.35 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.646 1.578 . . . . 2.1000000000000001 112.242 175.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -66.23 -27.33 67.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.756 1.223 . . . . 3.2999999999999998 112.804 176.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 49.0 mt -74.32 -21.62 59.63 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 120.893 -1.129 . . . . 2.1200000000000001 112.235 175.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -88.8 3.21 51.85 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.488 1.515 . . . . 3.4100000000000001 114.411 168.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -92.89 -46.2 7.62 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.74 1.216 . . . . 4.5099999999999998 111.027 162.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.35 20.73 0.52 Allowed 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 125.29 1.436 . . . . 4.3099999999999996 114.234 -178.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.256 1.444 0 C-N-CA 128.06 2.544 . . . . 4.7599999999999998 117.736 -166.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.503 -0.828 0 N-CA-C 108.471 -0.936 . . . . 8.4100000000000001 108.471 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 -112.38 -138.08 0.37 Allowed 'General case' 0 CA--C 1.542 0.646 0 O-C-N 125.871 1.982 . . . . 4.0499999999999998 109.26 -155.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.498 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 6.2 p -99.12 175.54 2.4 Favored Pre-proline 0 C--N 1.316 -0.864 1 C-N-CA 132.644 4.378 . . . . 2.1200000000000001 111.011 -151.71 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.498 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 74.4 Cg_endo -77.07 -29.91 4.78 Favored 'Trans proline' 0 C--N 1.351 0.668 0 CA-C-N 121.076 1.42 . . . . 1.5800000000000001 112.886 -168.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 18.0 tp -85.71 -39.2 17.46 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 117.007 -1.473 . . . . 2.6000000000000001 112.519 -174.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -58.28 -37.93 75.98 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 120.487 1.494 . . . . 4.6799999999999997 109.915 172.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 ttmp? -65.41 -39.1 91.76 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.532 1.133 . . . . 3.5600000000000001 112.663 171.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.71 -40.66 69.32 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.043 0.937 . . . . 0.91000000000000003 113.106 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.3 mt -62.34 -42.78 99.67 Favored 'General case' 0 C--O 1.238 0.486 0 O-C-N 121.286 -0.884 . . . . 1.73 109.969 170.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 92.5 m -56.05 -44.35 78.77 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 117.042 -1.456 . . . . 1.5 110.748 170.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.0 m -56.54 -52.13 65.96 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 121.481 1.946 . . . . 1.48 112.329 178.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.08 -29.08 69.93 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 113.994 1.109 . . . . 3.0299999999999998 113.994 178.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 80.2 t -76.19 -32.22 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 123.954 0.901 . . . . 2.6299999999999999 112.741 171.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 56.8 m -61.34 -55.37 32.44 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.423 1.489 . . . . 0.85999999999999999 110.176 175.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.33 -25.26 64.12 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.862 1.265 . . . . 2.6200000000000001 111.504 -177.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -59.77 -37.65 79.64 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.256 -0.902 . . . . 1.7 111.675 167.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -76.99 -27.9 54.89 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 120.196 -1.565 . . . . 2.0499999999999998 112.954 175.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -56.44 -59.62 4.71 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.725 1.148 . . . . 5.4000000000000004 110.715 164.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -86.51 -45.71 10.85 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 114.298 1.222 . . . . 2.1400000000000001 114.298 -167.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.3 m -67.02 -31.03 71.3 Favored 'General case' 0 C--O 1.249 1.056 0 CA-C-N 120.605 1.548 . . . . 3.27 111.362 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.39 2.07 88.21 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 126.873 2.178 . . . . 1.6799999999999999 114.582 173.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.4 ttt85 -74.69 -46.08 40.18 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.749 1.775 . . . . 5.0199999999999996 111.264 175.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -133.0 147.98 52.27 Favored 'General case' 0 C--O 1.252 1.224 0 CA-C-O 122.663 1.22 . . . . 5.5199999999999996 112.845 -174.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.49 -122.96 14.07 Favored Glycine 0 C--N 1.343 0.936 0 C-N-CA 128.308 2.861 . . . . 2.3799999999999999 112.395 168.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.7 m -44.27 109.18 0.14 Allowed 'General case' 0 C--O 1.246 0.877 0 C-N-CA 125.065 1.346 . . . . 4.0700000000000003 110.995 161.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 40.4 tptt -72.71 -27.57 62.15 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.606 1.562 . . . . 5.9299999999999997 112.949 -172.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.445 ' H ' HD23 ' A' ' 27' ' ' LEU . 1.9 pt? -90.29 -17.3 27.65 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.503 1.521 . . . . 4.9299999999999997 114.253 178.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.8 p -106.26 152.6 23.31 Favored 'General case' 0 C--O 1.254 1.326 0 C-N-CA 123.921 0.888 . . . . 2.0800000000000001 111.293 178.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 12.2 mt -82.98 107.28 15.47 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 113.306 -1.77 . . . . 1.8600000000000001 106.912 148.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.2 t -66.56 162.69 20.34 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.552 -0.717 . . . . 2.0800000000000001 109.969 162.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -46.74 -36.62 7.42 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.89 1.223 . . . . 3.3900000000000001 113.226 -177.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -79.74 -30.79 40.95 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 120.728 -1.233 . . . . 5.79 113.858 177.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -69.36 -33.95 73.84 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.867 1.212 . . . . 1.5700000000000001 110.887 170.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -64.75 -53.47 46.64 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.606 1.162 . . . . 3.1699999999999999 109.597 174.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.1 mttm -50.87 -47.15 60.52 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.406 -0.809 . . . . 4.1699999999999999 112.49 170.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -53.91 -66.72 0.34 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.575 1.55 . . . . 3.2599999999999998 112.257 173.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.4 tp -49.09 -51.38 31.97 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.571 1.948 . . . . 2.0699999999999998 111.466 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 84.2 mt -61.21 -57.83 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 N-CA-C 109.321 -0.622 . . . . 1.21 109.321 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -60.53 -30.99 70.1 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 121.491 -0.755 . . . . 4.0499999999999998 112.399 -174.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.2 mmtm -76.11 -57.95 3.57 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.25 1.82 . . . . 3.6299999999999999 112.761 176.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -108.66 6.6 25.95 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 113.519 0.933 . . . . 6.25 113.519 -163.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.8 mt -142.91 50.21 1.44 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 127.557 2.343 . . . . 3.6099999999999999 108.171 168.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 24.7 t -73.19 51.34 0.31 Allowed 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 127.394 2.278 . . . . 3.75 115.9 -166.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -86.74 151.62 23.23 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.579 -1.325 . . . . 4.1100000000000003 111.67 178.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.11 -23.51 73.03 Favored Glycine 0 N--CA 1.48 1.625 0 N-CA-C 116.219 1.248 . . . . 3.21 116.219 -167.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -98.26 0.69 46.16 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.558 1.143 . . . . 6.3300000000000001 112.37 174.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.9 tpt -82.65 78.38 9.28 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.679 1.591 . . . . 2.0699999999999998 107.808 171.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.8 ttpt -143.87 167.9 21.21 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.849 1.66 . . . . 4.0700000000000003 110.577 -151.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -60.67 -42.37 96.92 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 119.44 -2.037 . . . . 3.6699999999999999 114.504 -161.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.9 m -72.37 -3.78 26.07 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.268 1.581 . . . . 3.1600000000000001 115.268 176.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.8 p -109.3 -34.81 6.45 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.688 1.131 . . . . 2.0600000000000001 112.106 166.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.1 mt -76.29 -38.98 34.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.409 1.484 . . . . 1.55 113.498 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -71.02 -34.46 71.34 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 120.114 1.324 . . . . 2.5899999999999999 112.898 -173.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -87.42 -26.34 23.34 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.815 1.646 . . . . 4.7800000000000002 113.068 175.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 62.3 tp -59.24 -44.57 92.35 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 118.312 -0.852 . . . . 2.2000000000000002 109.846 158.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -48.18 81.35 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 119.795 1.18 . . . . 1.8 110.06 179.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.2 mttp -58.11 -33.26 68.92 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.123 0.969 . . . . 5.6799999999999997 113.172 172.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.8 t -79.17 -27.02 42.65 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 114.368 1.247 . . . . 1.8300000000000001 114.368 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.5 mt -81.56 -25.87 35.49 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.734 2.014 . . . . 2.1299999999999999 111.373 174.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.517 ' C ' ' HE2' ' A' ' 61' ' ' LYS . 36.8 t0 -69.12 120.65 15.3 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.478 1.111 . . . . 1.8600000000000001 109.748 166.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.534 ' HE3' HG11 ' A' ' 74' ' ' VAL . 0.8 OUTLIER -84.38 6.3 23.74 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 119.909 -1.745 . . . . 3.23 114.29 -172.635 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -153.03 -86.06 0.07 Allowed 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 124.83 1.252 . . . . 3.3399999999999999 110.516 -170.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.0 m 156.82 92.73 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 130.191 3.396 . . . . 2.3700000000000001 108.004 -174.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.3 p30 -152.23 -6.45 0.22 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.976 1.31 . . . . 2.21 113.399 -177.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 63.91 1.71 1.2 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 128.238 2.615 . . . . 4.3799999999999999 114.288 -170.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -106.19 138.3 42.62 Favored 'General case' 0 C--O 1.246 0.872 0 C-N-CA 127.319 2.248 . . . . 3.3599999999999999 110.435 178.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 41.2 mm -103.85 98.37 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 113.709 -1.587 . . . . 1.1899999999999999 107.894 159.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.99 157.33 25.36 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.612 1.165 . . . . 2.73 111.64 163.583 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -55.95 -25.26 42.73 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 115.159 1.54 . . . . 2.6000000000000001 115.159 -178.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 mtmp? -87.35 -35.17 18.53 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 117.267 -1.349 . . . . 3.4300000000000002 111.893 170.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.421 ' O ' HG12 ' A' ' 74' ' ' VAL . 40.1 mt-10 -54.2 -49.84 68.44 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 120.382 1.446 . . . . 1.98 108.979 166.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -49.93 -32.3 14.48 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 128.09 2.556 . . . . 2.7000000000000002 114.953 -178.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 72.5 p -57.93 -27.4 63.34 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.041 -1.037 . . . . 2.5 112.809 174.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.534 HG11 ' HE3' ' A' ' 61' ' ' LYS . 2.0 p -73.99 -30.0 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.217 -0.927 . . . . 2.3500000000000001 112.015 179.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -64.98 -49.96 68.24 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.944 -0.762 . . . . 1.9199999999999999 108.944 169.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.0 mt -61.04 -36.6 79.99 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.177 0.591 . . . . 2.0600000000000001 111.695 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.2 m -59.99 -53.16 61.12 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.714 1.206 . . . . 1.05 111.402 174.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.9 mtm -66.94 -37.64 84.69 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 119.121 -0.466 . . . . 1.8899999999999999 112.192 -177.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 92.9 mt -60.53 -47.52 85.82 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 119.095 -0.479 . . . . 1.8899999999999999 111.331 171.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 19.6 m -55.47 -39.79 70.84 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.691 0.796 . . . . 2.0 112.795 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 36.1 mtp -70.12 -33.54 71.95 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 119.003 -0.523 . . . . 1.8899999999999999 112.235 176.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.53 -46.76 68.69 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 119.211 0.914 . . . . 0.95999999999999996 113.176 -178.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -68.34 -24.25 64.79 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.333 -0.854 . . . . 2.9300000000000002 112.613 175.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -71.8 -33.37 68.5 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 114.036 1.124 . . . . 1.78 114.036 174.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.0 -32.27 51.08 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.131 0.572 . . . . 3.1000000000000001 111.324 179.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -54.73 29.33 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.804 0.842 . . . . 2.3399999999999999 110.782 161.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -59.22 -14.96 12.58 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.277 1.431 . . . . 2.3199999999999998 113.89 177.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 41.0 mt -90.42 -12.54 37.15 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 117.273 -1.346 . . . . 2.04 114.624 172.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -102.41 -38.28 7.66 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.738 1.215 . . . . 2.8399999999999999 113.931 167.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -56.68 -33.83 66.79 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.274 1.829 . . . . 4.1200000000000001 113.287 -177.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.528 HD22 ' H ' ' A' ' 91' ' ' ASN . 0.1 OUTLIER -83.13 -8.24 59.53 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 116.744 2.127 . . . . 5.2599999999999998 116.744 -172.634 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.96 0 CA-C-O 116.054 -1.927 . . . . 3.6699999999999999 115.927 -169.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 18.1 mtt . . . . . 0 N--CA 1.476 0.848 0 N-CA-C 107.098 -1.445 . . . . 5.9199999999999999 107.098 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.412 ' O ' ' HE2' ' B' ' 7' ' ' LYS . 8.6 mp0 -130.1 137.48 50.2 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 125.561 1.788 . . . . 5.5199999999999996 107.507 -161.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.26 162.13 27.06 Favored Pre-proline 0 N--CA 1.48 1.051 0 C-N-CA 123.942 0.897 . . . . 2.6200000000000001 111.792 -177.526 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -63.54 -26.62 69.73 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 121.643 1.562 . . . . 2.27 112.94 178.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.91 -37.71 39.23 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.174 0.897 . . . . 2.8799999999999999 111.08 174.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -58.76 -42.04 87.98 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.314 0.961 . . . . 3.9300000000000002 111.369 170.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . 0.412 ' HE2' ' O ' ' B' ' 2' ' ' GLU . 68.3 mttm -62.56 -36.69 83.44 Favored 'General case' 0 N--CA 1.463 0.188 0 O-C-N 121.433 -0.792 . . . . 3.9900000000000002 111.714 176.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.29 -47.12 71.56 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 118.937 0.789 . . . . 1.2 112.554 172.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -55.84 -50.0 71.75 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.769 1.628 . . . . 2.7400000000000002 113.346 173.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 22.0 p -66.95 -35.91 81.04 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 117.461 -1.257 . . . . 2.1600000000000001 110.821 178.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 95.9 m -59.59 -43.41 93.68 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 119.688 1.131 . . . . 1.5600000000000001 110.641 170.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -60.58 -55.08 37.63 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.073 0.549 . . . . 3.8199999999999998 111.248 175.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 51.7 t -58.33 -31.79 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 CA-C-N 118.698 0.681 . . . . 1.95 111.879 178.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 92.5 m -65.73 -57.6 7.64 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 117.614 -1.184 . . . . 1.05 110.876 175.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.7 p -57.04 -37.55 71.93 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 119.744 1.157 . . . . 1.9099999999999999 111.611 175.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -66.8 -57.9 6.13 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 123.661 0.601 . . . . 1.98 109.969 -176.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.23 -33.62 67.69 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.65 -0.656 . . . . 2.1800000000000002 112.67 -175.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -64.55 -34.38 78.11 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.585 1.084 . . . . 5.3600000000000003 112.198 174.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -85.85 -30.11 23.2 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.077 0.853 . . . . 2.1299999999999999 111.833 176.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 35.3 t -69.45 -25.6 64.18 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 114.206 1.187 . . . . 1.6599999999999999 114.206 174.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.66 12.19 67.87 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.853 1.692 . . . . 2.0600000000000001 114.702 172.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -75.66 -36.73 60.05 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 118.757 1.278 . . . . 4.9699999999999998 111.935 172.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -157.34 156.87 33.07 Favored 'General case' 0 C--O 1.248 0.985 0 CA-C-O 121.637 0.732 . . . . 2.9900000000000002 111.519 -163.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.94 -128.13 46.46 Favored Glycine 0 C--N 1.338 0.689 0 N-CA-C 109.185 -1.566 . . . . 2.4300000000000002 109.185 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 38.7 m -79.02 153.51 30.21 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-O 122.345 1.069 . . . . 3.3500000000000001 111.975 164.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -57.3 174.18 0.21 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 115.174 -0.921 . . . . 7.46 110.669 142.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 23.6 mt 73.34 -56.99 0.64 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.603 1.561 . . . . 3.2400000000000002 109.405 -169.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 40.6 p -103.38 146.65 28.16 Favored 'General case' 0 C--O 1.255 1.367 0 N-CA-C 115.863 1.801 . . . . 1.1899999999999999 115.863 -170.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 64.9 mt -102.44 103.46 13.85 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 128.484 2.714 . . . . 1.8500000000000001 111.601 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.5 p -65.77 170.76 4.92 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 115.111 1.522 . . . . 2.7799999999999998 115.111 178.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . 0.417 ' HD2' ' SD ' ' B' ' 56' ' ' MET . 10.7 tpt180 -47.6 -11.41 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 128.147 2.579 . . . . 5.0800000000000001 115.659 167.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.43 -47.91 3.14 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.812 1.245 . . . . 4.3099999999999996 112.275 168.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -52.91 -38.45 61.83 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.743 0.817 . . . . 2.29 111.428 179.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.498 HD23 ' HG2' ' B' ' 56' ' ' MET . 7.6 tp -71.9 -45.66 60.44 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.605 0.762 . . . . 2.21 112.539 178.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -71.58 -37.19 71.04 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 120.609 -1.307 . . . . 5.21 111.145 -176.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -54.24 -52.15 62.27 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.157 1.383 . . . . 2.8799999999999999 111.982 164.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 42.9 tp -58.24 -53.17 61.32 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.988 1.267 . . . . 1.99 112.376 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 27.4 mt -54.64 -55.07 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 N-CA-C 109.131 -0.692 . . . . 1.22 109.131 176.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -68.2 -11.84 59.94 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.08 1.141 . . . . 4.2000000000000002 114.08 -173.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 12.8 mmtp -92.59 -29.64 16.05 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 125.057 1.343 . . . . 3.8900000000000001 114.034 178.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -100.28 -49.93 4.1 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.635 0.774 . . . . 5.7400000000000002 111.733 177.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -81.1 56.19 2.74 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.857 1.263 . . . . 2.3900000000000001 110.383 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 72.3 m -79.24 -7.31 58.17 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.382 1.473 . . . . 3.79 113.432 176.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.4 HD23 ' H ' ' B' ' 44' ' ' LEU . 1.8 pt? -83.94 137.56 33.58 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.847 1.259 . . . . 2.7200000000000002 112.015 -176.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.1 -108.14 2.44 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.414 -0.674 . . . . 3.8799999999999999 111.414 178.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -169.08 118.46 0.68 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.08 1.752 . . . . 5.7699999999999996 106.947 -174.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.66 -13.61 60.04 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 122.231 1.015 . . . . 3.8199999999999998 112.871 -173.026 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.4 mtpp 71.93 45.8 0.39 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 128.123 2.569 . . . . 5.1900000000000004 110.215 170.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . 0.268 7.3 pt-20 -63.4 2.96 0.34 Allowed 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 119.893 3.294 . . . . 4.1900000000000004 119.893 -138.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 29.4 t -53.47 -29.92 38.25 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 119.129 -2.232 . . . . 2.7999999999999998 111.488 149.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 8.6 t -68.63 -15.38 63.51 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.041 1.336 . . . . 2.6200000000000001 114.003 171.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 5.9 mm -68.96 -21.68 25.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 CA-C-N 120.512 1.506 . . . . 2.1600000000000001 111.461 173.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -77.36 -44.79 28.15 Favored 'General case' 0 C--O 1.224 -0.247 0 N-CA-C 113.754 1.02 . . . . 3.4399999999999999 113.754 164.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.35 -30.86 66.68 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.422 1.465 . . . . 2.54 114.086 -178.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -51.81 -39.45 58.75 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 117.997 -1.001 . . . . 2.5299999999999998 110.399 162.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . 0.498 ' HG2' HD23 ' B' ' 34' ' ' LEU . 23.1 mtp -63.32 -55.74 22.17 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-O 116.912 -1.518 . . . . 2.6099999999999999 112.383 173.259 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -61.13 -32.78 72.47 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 122.238 2.29 . . . . 4.4500000000000002 112.995 -175.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 21.2 m -72.49 -42.68 64.61 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.142 1.377 . . . . 2.1099999999999999 112.183 177.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 8.8 mp -74.41 -31.89 62.48 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 117.992 -1.004 . . . . 2.7200000000000002 112.858 173.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -108.4 56.06 0.63 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 128.568 2.747 . . . . 1.99 110.863 178.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . 0.583 ' H ' ' HE2' ' B' ' 61' ' ' LYS . 0.0 OUTLIER -58.17 -19.7 35.19 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 115.453 1.649 . . . . 3.2799999999999998 115.453 -173.536 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -89.34 -6.61 56.54 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.121 1.526 . . . . 1.77 115.121 173.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 57.8 m 63.06 22.96 13.72 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.903 1.681 . . . . 2.0800000000000001 114.635 174.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 37.0 p30 -89.8 -2.33 58.2 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.505 1.122 . . . . 2.8999999999999999 111.913 177.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 74.71 -31.41 0.21 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 129.935 3.294 . . . . 4.1900000000000004 114.559 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -73.41 135.55 44.21 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 122.629 1.204 . . . . 2.5600000000000001 110.188 176.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 77.9 mt -124.42 106.23 16.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 124.8 1.24 . . . . 1.5 108.551 -176.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -90.23 160.96 15.92 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 127.043 2.137 . . . . 3.71 109.919 165.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -39.18 -42.56 0.98 Allowed 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.985 1.714 . . . . 2.4399999999999999 113.892 170.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -80.16 -10.56 59.77 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.182 0.993 . . . . 4.0099999999999998 113.471 -171.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -91.08 -47.3 7.63 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.3 1.04 . . . . 1.8999999999999999 109.509 161.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -63.57 -28.06 69.67 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 129.083 2.953 . . . . 2.71 115.546 -171.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 13.4 p -54.48 -24.04 18.73 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.674 -1.266 . . . . 2.2000000000000002 113.033 175.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 p -58.1 -34.82 50.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 N-CA-C 113.009 0.744 . . . . 2.7000000000000002 113.009 171.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -66.3 -51.27 58.98 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.015 1.326 . . . . 1.6499999999999999 109.972 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 28.9 mt -61.16 -43.2 99.25 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.764 0.825 . . . . 1.48 110.123 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 24.1 m -57.49 -51.45 69.4 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.41 1.084 . . . . 1.1499999999999999 111.469 176.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 3.8 mmm -56.97 -44.7 82.88 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.568 0.747 . . . . 2.54 112.638 178.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 96.8 mt -68.23 -43.31 78.22 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.604 0.762 . . . . 1.45 111.668 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 80.0 m -61.64 -33.0 73.18 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.274 -0.891 . . . . 1.6000000000000001 112.554 175.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 41.1 mtp -69.14 -37.91 78.53 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.163 0.892 . . . . 2.8500000000000001 112.925 171.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.54 -46.34 88.84 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.207 0.912 . . . . 1.24 112.121 174.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -64.62 -27.72 69.13 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.094 1.146 . . . . 2.4500000000000002 114.094 174.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.67 -39.6 73.47 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.281 0.946 . . . . 2.4100000000000001 111.338 174.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -68.29 -40.41 81.77 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.906 0.882 . . . . 4.1799999999999997 111.475 177.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -52.68 -50.87 62.43 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.566 1.546 . . . . 2.9100000000000001 111.481 172.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -59.23 -25.72 64.26 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.256 1.422 . . . . 2.4500000000000002 113.144 -178.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 60.1 mt -77.37 -22.25 52.02 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 117.842 -1.075 . . . . 2.29 112.787 177.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -99.53 0.8 43.1 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.043 1.337 . . . . 4.1500000000000004 113.567 169.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -84.2 -36.28 22.9 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.815 1.246 . . . . 3.71 111.78 164.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -100.49 28.3 5.15 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.46 1.504 . . . . 3.2200000000000002 113.409 -170.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 3.7 ptmm? . . . . . 0 C--O 1.246 0.901 0 N-CA-C 118.011 2.597 . . . . 5.3700000000000001 118.011 -156.338 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.86 0 N-CA-C 107.992 -1.114 . . . . 6.6699999999999999 107.992 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -147.64 146.7 29.44 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 126.743 2.017 . . . . 5.0800000000000001 106.594 -164.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 75.6 p -53.17 162.78 1.02 Allowed Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 124.289 1.036 . . . . 1.6000000000000001 111.225 164.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.75 -19.49 36.1 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 121.952 1.768 . . . . 1.5 111.965 168.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -79.06 -41.41 28.84 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.977 0.911 . . . . 4.1699999999999999 112.24 178.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -58.06 -46.21 85.8 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.347 1.059 . . . . 4.0300000000000002 110.094 176.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -60.53 -31.86 70.92 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 114.078 1.14 . . . . 3.6800000000000002 114.078 172.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.14 -34.04 75.6 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.274 0.943 . . . . 1.0 111.655 -175.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 71.4 mt -57.86 -51.81 68.06 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.055 0.942 . . . . 1.9199999999999999 110.476 170.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 m -58.77 -43.84 90.5 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.026 1.331 . . . . 1.74 112.004 175.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 51.2 m -60.83 -38.78 86.63 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.668 1.587 . . . . 1.5900000000000001 110.853 178.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.86 -52.8 47.29 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.171 0.988 . . . . 3.8900000000000001 111.453 172.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t -54.73 -28.8 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 O-C-N 120.555 -1.341 . . . . 1.9199999999999999 112.503 174.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 94.4 m -68.56 -46.55 69.15 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.033 1.333 . . . . 1.3500000000000001 113.372 -177.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.0 p -69.41 -42.96 74.36 Favored 'General case' 0 CA--C 1.504 -0.817 0 CA-C-N 119.724 1.147 . . . . 2.27 108.85 172.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -60.92 -57.22 13.57 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 124.622 1.201 . . . . 2.1000000000000001 110.729 -171.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -64.76 -40.84 95.95 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 122.244 -0.285 . . . . 2.5600000000000001 110.554 -175.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -67.24 -41.74 85.16 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.359 -0.838 . . . . 3.8199999999999998 112.776 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -68.8 -37.04 78.99 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.421 1.01 . . . . 2.1000000000000001 112.297 173.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.5 m -62.71 -27.31 69.17 Favored 'General case' 0 C--O 1.25 1.114 0 N-CA-C 114.934 1.457 . . . . 2.73 114.934 172.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.29 -4.63 80.73 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 126.703 2.097 . . . . 1.3500000000000001 114.071 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -54.67 -37.37 65.66 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.395 1.598 . . . . 4.0 112.608 178.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 173.12 -155.57 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 128.858 2.863 . . . . 7.04 109.539 176.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 72.92 -142.09 31.39 Favored Glycine 0 C--N 1.336 0.582 0 C-N-CA 127.131 2.3 . . . . 2.1200000000000001 110.181 176.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.9 t -64.43 142.3 58.47 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 122.882 1.325 . . . . 2.5 110.153 149.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -97.49 137.64 36.13 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.885 1.674 . . . . 9.2100000000000009 107.609 174.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.6 mt 92.47 -31.16 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 129.219 3.008 . . . . 4.2000000000000002 111.416 -161.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.418 HG22 ' HA ' ' A' ' 68' ' ' ASP . 81.5 p -116.7 161.97 18.4 Favored 'General case' 0 C--O 1.251 1.142 0 N-CA-C 114.638 1.347 . . . . 1.55 114.638 179.071 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -120.45 102.81 8.7 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.647 1.179 . . . . 2.4199999999999999 112.162 -179.336 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.4 p -77.75 173.64 11.86 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 120.776 -1.202 . . . . 2.02 112.381 165.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -39.51 -42.86 1.19 Allowed 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 116.857 2.169 . . . . 3.4399999999999999 116.857 -163.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.57 -26.99 45.67 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 119.632 -1.917 . . . . 5.2999999999999998 114.057 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -72.95 -51.19 19.4 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 107.339 -1.356 . . . . 2.1699999999999999 107.339 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.21 -32.45 74.13 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.737 0.643 . . . . 1.96 112.737 175.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -67.13 -38.81 86.22 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 120.11 -1.619 . . . . 4.6200000000000001 112.784 173.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -64.66 -29.29 70.29 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-O 117.794 -1.098 . . . . 4.4800000000000004 113.634 171.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.1 tt -73.27 -66.79 0.64 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.203 1.401 . . . . 2.0800000000000001 112.358 177.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.9 mt -56.26 -43.94 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 124.647 1.179 . . . . 0.82999999999999996 110.525 -168.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.3 tttp -70.97 -3.85 21.64 Favored 'General case' 0 N--CA 1.439 -1.012 0 N-CA-C 113.994 1.109 . . . . 4.0899999999999999 113.994 -176.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -108.76 -21.63 12.59 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.196 1.798 . . . . 3.73 113.387 168.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -76.84 -62.08 1.76 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.855 2.062 . . . . 4.6200000000000001 110.047 178.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 60.3 mt -92.57 101.05 13.47 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.514 -1.366 . . . . 2.4300000000000002 113.241 -163.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 77.8 m -88.03 48.81 1.69 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.626 2.371 . . . . 4.2699999999999996 112.315 -169.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 38.8 mt -129.27 -1.21 5.09 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.55 1.94 . . . . 3.7799999999999998 113.791 -163.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 140.81 33.69 0.13 Allowed Glycine 0 N--CA 1.472 1.07 0 C-N-CA 125.763 1.649 . . . . 2.79 112.752 -170.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 26.78 65.08 0.08 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 130.209 3.404 . . . . 8.3300000000000001 113.355 172.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 52.1 mmm -20.82 117.27 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.797 2.439 . . . . 2.71 117.122 -158.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.3 tmtt? -48.41 122.84 5.79 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.604 1.962 . . . . 7.4000000000000004 110.297 178.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.31 -39.66 87.8 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.019 1.489 . . . . 5.0099999999999998 115.019 -157.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.2 t -76.35 -21.41 56.15 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.525 1.057 . . . . 3.4900000000000002 113.507 174.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.0 m -73.66 -9.64 58.88 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.774 -1.204 . . . . 2.71 112.527 173.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 20.1 mm -67.59 -25.96 34.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 123.608 0.763 . . . . 1.79 112.076 165.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -78.04 -46.45 20.88 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 114.223 1.194 . . . . 2.7000000000000002 114.223 -163.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.28 -33.22 73.96 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.005 0.821 . . . . 3.25 110.762 166.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 67.9 tp -61.48 -39.36 90.65 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 117.982 -1.009 . . . . 1.8700000000000001 113.33 177.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 18.0 ptm -74.94 -34.5 62.09 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 120.2 1.364 . . . . 1.8100000000000001 112.973 169.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -73.83 -23.35 59.63 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 120.781 -1.199 . . . . 6.5999999999999996 112.735 -178.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.1 t -58.43 -36.89 74.31 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.958 1.703 . . . . 2.5099999999999998 111.348 163.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.6 mt -74.17 -33.69 63.55 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.128 0.971 . . . . 2.3199999999999998 111.306 178.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -80.8 94.02 6.35 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.107 1.763 . . . . 2.52 114.131 -175.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.46 ' HZ1' HG21 ' A' ' 74' ' ' VAL . 12.0 mptt -63.02 -34.1 76.84 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.6 1.16 . . . . 3.5800000000000001 111.594 174.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.87 -34.86 51.45 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.706 1.202 . . . . 2.02 111.491 175.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.0 m 55.66 61.68 2.73 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.024 2.13 . . . . 3.79 111.509 -164.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -105.77 -55.35 2.34 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 117.399 -1.286 . . . . 2.7599999999999998 112.036 -167.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 152.29 -32.35 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.73 1 C-N-CA 133.368 4.667 . . . . 5.1600000000000001 116.091 175.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -90.87 143.5 26.66 Favored 'General case' 0 C--O 1.244 0.803 0 CA-C-O 123.079 1.419 . . . . 2.5299999999999998 108.314 169.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 35.6 mm -110.45 111.43 36.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 126.302 1.841 . . . . 1.6699999999999999 107.051 173.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.418 ' HA ' HG22 ' A' ' 28' ' ' THR . 0.0 OUTLIER -74.71 175.32 8.04 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.315 1.046 . . . . 2.9100000000000001 112.991 169.983 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -46.92 -48.56 21.3 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.122 1.369 . . . . 2.4100000000000001 113.682 170.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -80.67 -31.81 36.2 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.862 1.265 . . . . 5.6799999999999997 112.226 -171.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -55.58 -65.88 0.51 Allowed 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 123.98 0.912 . . . . 1.8 110.217 159.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -59.42 -32.6 70.33 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.26 2.224 . . . . 2.5499999999999998 114.619 -172.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 69.5 m -62.85 -14.87 51.13 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 119.909 -1.744 . . . . 2.1000000000000001 113.06 -176.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.46 HG21 ' HZ1' ' A' ' 61' ' ' LYS . 46.0 t -70.53 -24.22 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 O-C-N 120.893 -1.129 . . . . 2.04 112.418 171.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -67.16 -50.0 62.76 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.473 1.109 . . . . 1.97 110.356 171.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -56.15 -44.54 79.37 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.226 1.01 . . . . 2.27 111.411 172.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.4 m -53.43 -57.41 10.76 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 118.544 -0.741 . . . . 0.68000000000000005 111.578 174.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 14.3 ptp -66.58 -29.09 69.08 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 118.924 0.784 . . . . 1.8500000000000001 112.864 -177.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.1 mt -67.21 -50.86 59.25 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-N 119.011 0.823 . . . . 1.4399999999999999 111.44 171.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.2 m -62.18 -34.71 76.94 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 119.056 0.843 . . . . 1.8 112.151 177.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 35.5 mtp -65.56 -37.79 87.73 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.03 0.832 . . . . 1.75 112.732 172.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.38 -34.71 54.9 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 119.632 1.106 . . . . 1.01 113.152 175.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.468 ' CD2' HD11 ' B' ' 9' ' ' LEU . 0.2 OUTLIER -64.21 -28.42 69.73 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.018 0.826 . . . . 2.8300000000000001 112.993 175.618 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -56.41 -52.08 65.97 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.275 0.63 . . . . 2.1000000000000001 111.004 167.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.47 -32.96 66.65 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.094 1.357 . . . . 3.4700000000000002 112.509 -176.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -57.22 -48.94 77.53 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.476 1.51 . . . . 2.9199999999999999 110.889 170.186 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -61.41 -38.67 87.94 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.919 1.288 . . . . 2.8900000000000001 112.716 174.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.1 -20.97 64.08 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.484 0.92 . . . . 2.77 113.484 176.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -95.02 -4.49 46.41 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.513 1.301 . . . . 4.3700000000000001 114.513 172.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -96.65 -54.75 3.13 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.114 1.366 . . . . 3.9300000000000002 111.685 172.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.32 46.11 1.01 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.561 1.544 . . . . 4.0700000000000003 111.53 174.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.205 0 C-N-CA 129.165 2.986 . . . . 5.4900000000000002 115.736 -172.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 107.438 -1.319 . . . . 6.0 107.438 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -95.99 172.79 7.78 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 124.92 1.387 . . . . 6.3499999999999996 110.705 176.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . 0.444 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 0.2 OUTLIER -76.16 176.26 3.47 Favored Pre-proline 0 CA--C 1.542 0.661 0 C-N-CA 129.034 2.934 . . . . 3.04 111.99 179.307 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . 0.444 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 42.4 Cg_endo -71.04 -16.6 32.17 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 121.966 1.778 . . . . 2.0800000000000001 115.097 -173.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -73.01 -49.68 27.47 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 120.671 1.578 . . . . 2.3599999999999999 110.038 177.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . 0.504 ' H ' ' CD ' ' B' ' 6' ' ' GLU . 18.7 mp0 -67.45 -45.47 75.91 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.244 1.818 . . . . 5.8799999999999999 108.748 -178.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.55 -36.4 69.24 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.098 1.359 . . . . 6.2199999999999998 112.699 171.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.19 -48.78 64.33 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 117.515 -1.231 . . . . 2.2599999999999998 111.197 170.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.468 HD11 ' CD2' ' A' ' 83' ' ' TYR 0.274 0.3 OUTLIER -63.15 -24.11 67.74 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.68 1.582 . . . . 3.1600000000000001 112.962 179.674 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.1 m -52.16 -34.5 45.16 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.942 0.897 . . . . 1.3600000000000001 111.992 165.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.88 -22.04 58.88 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 117.222 -1.371 . . . . 2.6299999999999999 113.169 -179.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 19.9 mtp -72.02 -44.67 63.03 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 119.685 1.13 . . . . 3.6099999999999999 111.475 175.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 2.9 m -66.05 -23.84 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 O-C-N 121.055 -1.028 . . . . 2.3999999999999999 111.273 175.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 58.7 m -75.74 -49.49 18.06 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.501 1.52 . . . . 0.93000000000000005 111.707 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.2 p -66.57 -40.24 88.87 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 119.129 0.877 . . . . 1.5600000000000001 109.605 170.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -63.02 -58.88 5.81 Favored 'General case' 0 C--O 1.224 -0.284 0 O-C-N 123.872 0.732 . . . . 2.0899999999999999 110.488 -174.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -57.81 -46.43 84.7 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 118.004 0.365 . . . . 2.5600000000000001 110.588 -175.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.74 -30.53 65.7 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.333 0.864 . . . . 5.2599999999999998 113.333 -174.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -82.19 -19.69 39.32 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.104 0.866 . . . . 2.6099999999999999 112.811 169.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 21.3 p -81.22 -27.96 35.05 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.008 1.484 . . . . 1.4099999999999999 115.008 178.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.06 -9.58 86.01 Favored Glycine 0 CA--C 1.538 1.504 0 O-C-N 120.506 -1.371 . . . . 2.3300000000000001 112.736 168.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.7 -23.16 63.39 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.136 1.774 . . . . 3.8700000000000001 113.923 -168.075 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -150.41 157.95 43.61 Favored 'General case' 0 C--O 1.245 0.852 0 C-N-CA 126.863 2.065 . . . . 4.1600000000000001 108.454 172.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.69 -3.91 0.21 Allowed Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.383 1.468 . . . . 2.8700000000000001 114.011 -170.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 8.5 t 41.66 -137.74 0.19 Allowed 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 124.877 1.271 . . . . 4.9800000000000004 112.9 -144.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . 0.316 0.0 OUTLIER 53.2 -176.15 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.658 1 C-N-CA 132.703 4.401 . . . . 11.25 114.893 -173.301 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 14.4 tp -85.86 39.35 0.8 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.822 1.649 . . . . 4.6100000000000003 111.001 170.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 22.5 p -134.31 141.32 46.89 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.827 2.051 . . . . 1.1899999999999999 112.446 -167.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 53.8 mt -97.75 98.16 9.62 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.917 1.687 . . . . 1.77 111.2 172.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 29.1 t -54.09 151.9 6.51 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.167 1.387 . . . . 2.2200000000000002 110.893 158.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 25.4 ttm-85 -42.81 -37.56 1.84 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.52 1.928 . . . . 4.71 115.229 -172.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 17.1 tptt -87.39 -21.81 25.41 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 118.099 2.629 . . . . 8.9399999999999995 118.099 175.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -60.29 -49.62 76.9 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 108.178 -1.045 . . . . 2.3999999999999999 108.178 164.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -56.48 -50.4 71.87 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.967 1.707 . . . . 2.6000000000000001 111.386 -177.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . 0.413 ' HA ' HD12 ' B' ' 38' ' ' ILE . 0.0 OUTLIER -54.38 -42.52 70.44 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.056 1.132 . . . . 3.8900000000000001 114.056 -177.051 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -82.66 -35.53 26.79 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 118.251 -0.88 . . . . 4.9900000000000002 111.709 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.36 -42.29 81.77 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 118.096 -0.955 . . . . 2.1899999999999999 111.211 175.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.413 HD12 ' HA ' ' B' ' 35' ' ' LYS . 47.3 mt -44.9 -53.84 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 CA-C-N 120.178 1.354 . . . . 1.5800000000000001 110.27 171.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 4.5 ttpm? -78.19 -0.9 30.23 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 125.346 1.458 . . . . 3.6099999999999999 114.401 -174.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.85 -33.64 6.67 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 127.1 2.16 . . . . 4.1299999999999999 111.831 175.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.14 -68.51 0.38 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.889 1.675 . . . . 4.6299999999999999 107.185 170.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.13 141.25 52.7 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 121.33 -0.856 . . . . 3.2599999999999998 109.079 170.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 5.1 t -84.3 9.29 13.44 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.422 0.897 . . . . 4.3399999999999999 113.422 171.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 9.3 mp -89.71 153.38 20.75 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.372 1.469 . . . . 4.7199999999999998 111.688 -169.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.71 146.71 48.62 Favored Glycine 0 CA--C 1.532 1.146 0 N-CA-C 110.803 -0.919 . . . . 3.73 110.803 169.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.513 ' HG2' ' H ' ' B' ' 48' ' ' LYS . 23.4 tt0 -57.26 145.38 32.06 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.845 1.054 . . . . 10.41 113.845 -164.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 76.3 mmm -40.49 -40.95 1.33 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.322 1.849 . . . . 4.4900000000000002 113.271 161.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.513 ' H ' ' HG2' ' B' ' 46' ' ' GLU . 0.8 OUTLIER 99.53 140.05 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.968 1 C-N-CA 134.613 5.165 . . . . 3.4399999999999999 108.117 -172.267 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -43.13 -47.76 6.21 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.973 1.709 . . . . 3.8700000000000001 113.579 -176.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -65.02 -15.29 62.16 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 115.39 1.626 . . . . 2.8900000000000001 115.39 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 40.5 t -92.71 -15.27 26.9 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 120.074 1.306 . . . . 2.4500000000000002 112.663 171.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 37.3 mm -65.02 -26.96 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 124.752 1.221 . . . . 2.25 111.636 -177.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -63.72 -60.42 3.32 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 119.35 0.977 . . . . 5.96 112.417 178.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.35 -25.98 61.74 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.138 0.792 . . . . 3.4199999999999999 113.138 177.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -63.62 -58.21 7.64 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-O 118.766 -0.635 . . . . 2.2200000000000002 109.785 169.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ppp? -66.15 -36.28 82.69 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 118.935 0.789 . . . . 2.6600000000000001 110.873 -172.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -60.1 -23.8 64.12 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 127.774 2.43 . . . . 3.7200000000000002 113.994 173.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 9.3 t -80.34 -21.82 42.07 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.939 -1.101 . . . . 2.79 112.187 174.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.3 mt -90.67 -46.39 8.3 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.762 1.625 . . . . 2.25 109.809 178.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -67.6 137.05 55.36 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.89 1.276 . . . . 2.4300000000000002 110.82 172.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.21 -43.08 7.52 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.545 -1.347 . . . . 2.9199999999999999 111.43 175.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -86.39 -15.1 41.44 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.294 0.85 . . . . 2.0699999999999998 113.294 -168.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 9.3 t 67.85 16.33 9.66 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.588 1.555 . . . . 2.0099999999999998 112.218 -169.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -73.47 -24.67 60.24 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 130.384 3.473 . . . . 2.1600000000000001 110.318 174.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 64.69 0.52 1.16 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 128.524 2.729 . . . . 5.9699999999999998 115.573 169.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -77.14 130.67 37.64 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 108.088 -1.078 . . . . 2.1200000000000001 108.088 138.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 48.0 mt -100.54 112.97 34.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 124.999 1.32 . . . . 1.28 108.516 173.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.94 164.31 25.9 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 122.444 0.298 . . . . 2.5800000000000001 111.466 172.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -43.83 -42.68 5.79 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.366 1.466 . . . . 2.52 113.537 179.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 ttpm? -76.04 -25.47 55.67 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.406 2.282 . . . . 3.5099999999999998 113.842 -177.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -74.85 -50.4 17.18 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 107.77 -1.196 . . . . 1.6000000000000001 107.77 167.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -56.81 -36.04 69.46 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.618 1.967 . . . . 2.1200000000000001 115.14 -178.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 89.7 p -67.74 -15.28 63.56 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 118.684 -2.51 . . . . 1.77 113.599 175.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 27.9 t -70.37 -30.42 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 O-C-N 120.668 -1.27 . . . . 2.04 111.711 170.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -60.84 -53.44 57.37 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.528 -0.732 . . . . 2.27 110.427 166.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 41.5 mt -57.23 -39.14 74.9 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.648 0.779 . . . . 1.3700000000000001 112.189 176.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 91.5 m -55.34 -56.19 22.94 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.793 1.637 . . . . 0.93999999999999995 111.627 174.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 22.0 ptp -68.15 -35.83 78.7 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 112.917 0.71 . . . . 1.8100000000000001 112.917 -177.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 97.4 mt -61.84 -45.31 94.37 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 122.921 0.488 . . . . 1.76 110.904 172.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 3.0 t -61.18 -32.19 71.93 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.173 0.897 . . . . 1.8799999999999999 112.817 177.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 68.3 mtp -71.57 -34.86 70.32 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.918 1.081 . . . . 1.99 113.918 172.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.46 -44.2 83.4 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.763 1.165 . . . . 1.05 110.475 171.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -64.71 -22.02 66.88 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.009 0.744 . . . . 2.3399999999999999 113.009 -179.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -61.18 -62.12 2.07 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 119.245 0.929 . . . . 2.1400000000000001 112.59 162.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.97 -30.47 65.31 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 119.343 0.974 . . . . 3.6800000000000002 112.51 -172.05 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -58.44 -46.96 85.49 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.481 1.912 . . . . 3.6000000000000001 112.143 169.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -60.7 -29.7 69.49 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.443 -1.411 . . . . 3.1600000000000001 112.193 169.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 86.5 mt -83.99 -5.03 59.15 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 117.893 -1.051 . . . . 2.6600000000000001 113.443 171.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -89.83 -23.9 21.57 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.874 1.67 . . . . 6.4699999999999998 112.618 170.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.44 -44.63 64.45 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.803 1.241 . . . . 3.52 110.682 163.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -90.34 4.02 52.02 Favored 'General case' 0 CA--C 1.558 1.265 0 N-CA-C 114.944 1.461 . . . . 3.0600000000000001 114.944 -176.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 1.1 tttp . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 117.969 2.581 . . . . 5.5800000000000001 117.969 -166.375 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.8 mmt . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 108.868 -0.79 . . . . 5.9800000000000004 108.868 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -99.0 151.28 21.09 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 128.517 2.727 . . . . 4.8300000000000001 108.702 -176.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.05 153.95 42.22 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 126.485 1.914 . . . . 2.8700000000000001 112.278 -175.086 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -65.93 -26.83 51.26 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.699 2.266 . . . . 2.1099999999999999 113.482 -167.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -65.31 -36.03 82.81 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.597 0.759 . . . . 3.2599999999999998 111.238 171.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -73.11 -36.9 66.85 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.129 -0.982 . . . . 4.1200000000000001 111.321 174.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -61.93 -33.37 74.13 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.063 -1.023 . . . . 4.4900000000000002 112.491 169.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.31 -46.58 60.34 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.997 1.319 . . . . 1.23 112.232 174.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 66.6 mt -72.41 -29.48 63.77 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 120.605 -1.309 . . . . 2.04 113.026 177.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.8 p -71.1 -32.34 68.91 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 120.695 -1.253 . . . . 2.6699999999999999 112.669 169.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.1 m -53.96 -39.96 66.42 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.852 1.206 . . . . 1.3999999999999999 110.782 171.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -61.05 -44.24 97.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.072 0.949 . . . . 4.1500000000000004 113.48 176.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.8 m -71.5 -19.6 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 CA-C-N 119.969 1.259 . . . . 2.25 113.097 176.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 87.4 m -80.48 -33.36 36.65 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.715 2.006 . . . . 1.3100000000000001 113.211 -179.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 p -70.82 -39.78 72.85 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.216 0.916 . . . . 1.96 108.87 158.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -62.98 -57.37 10.96 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.407 0.549 . . . . 1.6499999999999999 112.326 -167.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 -54.79 -44.99 74.23 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.728 -0.608 . . . . 3.3599999999999999 111.812 174.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -67.62 -42.72 81.89 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.872 0.869 . . . . 4.1500000000000004 112.492 -171.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -78.35 -29.21 47.38 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.605 -0.685 . . . . 2.1099999999999999 112.457 174.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.4 t -56.98 -19.04 15.99 Favored 'General case' 0 C--O 1.247 0.939 0 N-CA-C 114.738 1.385 . . . . 1.97 114.738 174.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.68 -5.04 88.61 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 116.823 -2.098 . . . . 1.8799999999999999 116.869 175.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 -76.94 -23.9 52.41 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 119.87 1.835 . . . . 4.8399999999999999 115.633 -174.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -162.65 162.29 26.95 Favored 'General case' 0 C--O 1.248 0.993 0 C-N-CA 126.861 2.065 . . . . 5.0899999999999999 109.805 -173.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 47.09 -137.58 9.7 Favored Glycine 0 N--CA 1.474 1.214 0 C-N-CA 125.836 1.684 . . . . 1.9299999999999999 113.877 174.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.2 t -73.6 167.97 20.25 Favored 'General case' 0 C--O 1.251 1.164 0 CA-C-O 123.121 1.439 . . . . 2.5800000000000001 112.982 173.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 38.9 mttp -117.07 67.47 0.73 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 130.604 3.562 . . . . 7.4400000000000004 109.501 -175.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 164.18 -10.77 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.969 1 C-N-CA 133.71 4.804 . . . . 3.8100000000000001 110.502 -174.458 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.6 p -107.76 160.46 15.7 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.466 2.307 . . . . 1.3899999999999999 112.282 167.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.8 mt -108.76 101.53 10.65 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.75 1.62 . . . . 1.51 111.307 162.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.4 m -71.1 160.8 32.23 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 125.102 1.361 . . . . 2.8999999999999999 113.138 -177.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -41.07 -47.03 3.08 Favored 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 115.472 1.656 . . . . 5.0099999999999998 115.472 -172.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.52 -30.29 13.41 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 121.122 1.783 . . . . 4.46 113.271 -178.086 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -49.87 -41.73 46.09 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.665 1.186 . . . . 1.51 110.32 163.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -68.55 -50.31 52.88 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.496 1.118 . . . . 2.7200000000000002 112.032 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -56.77 -38.52 72.59 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.223 -0.923 . . . . 4.1100000000000003 113.232 -178.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.0 tp10 -66.03 -44.17 85.44 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.36 0.664 . . . . 3.71 112.786 173.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.2 -51.65 69.06 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.664 1.185 . . . . 2.0499999999999998 111.94 -176.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 35.3 mt -54.21 -48.65 66.26 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 CA-C-O 121.925 0.869 . . . . 0.82999999999999996 110.478 179.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? -69.35 -8.88 50.33 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.371 1.068 . . . . 5.2000000000000002 112.405 -176.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.61 -71.14 0.66 Allowed 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.738 1.615 . . . . 4.5 112.805 157.474 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -40.61 -51.39 2.98 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.256 1.422 . . . . 4.3499999999999996 111.864 -172.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.32 9.76 17.0 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 115.608 1.707 . . . . 2.8599999999999999 115.608 -162.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 53.1 t -73.13 74.72 1.26 Allowed 'General case' 0 CA--C 1.551 1.012 0 CA-C-O 123.945 1.831 . . . . 3.5600000000000001 113.043 -177.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -80.5 -47.75 13.82 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 126.366 1.866 . . . . 5.0099999999999998 109.243 166.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -125.04 162.52 19.32 Favored Glycine 0 CA--C 1.534 1.281 0 N-CA-C 108.054 -2.018 . . . . 4.7999999999999998 108.054 139.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.07 120.42 31.24 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.686 1.743 . . . . 7.8899999999999997 110.591 -178.335 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.9 ptm -70.55 141.0 51.9 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.071 -1.018 . . . . 2.3300000000000001 110.825 168.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.41 166.91 22.08 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.93 1.085 . . . . 4.5 113.93 -166.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.35 -45.33 69.11 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 127.06 2.144 . . . . 5.9900000000000002 114.087 -168.366 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.4 p -76.06 -40.41 53.3 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 126.099 1.76 . . . . 2.4100000000000001 112.342 177.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.8 m -61.02 -28.6 69.17 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.43 -0.794 . . . . 2.4300000000000002 112.597 174.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.3 mt -70.91 -35.09 58.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-O 117.612 -1.185 . . . . 1.24 112.243 171.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.32 -29.0 57.13 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 120.432 1.469 . . . . 3.04 113.5 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -72.67 -38.01 67.75 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.103 0.865 . . . . 2.3700000000000001 112.025 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -58.67 -47.32 84.9 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.445 0.698 . . . . 2.46 109.666 169.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.26 -44.76 80.0 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.796 1.239 . . . . 1.8999999999999999 111.93 173.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.12 -22.92 61.63 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 119.881 1.219 . . . . 4.0599999999999996 113.047 173.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.1 t -80.84 -36.93 30.85 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 119.81 -1.806 . . . . 2.46 112.714 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.5 mp -64.57 -49.08 72.58 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 121.073 -1.017 . . . . 2.9300000000000002 110.608 168.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -103.05 71.44 1.13 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.255 1.822 . . . . 2.4399999999999999 111.718 -164.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -50.97 -27.94 8.77 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.916 1.686 . . . . 3.1699999999999999 114.074 -168.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 41.4 p30 -100.69 -11.52 19.89 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.318 1.847 . . . . 2.9300000000000002 114.744 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.4 t 50.49 52.65 14.41 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.825 1.25 . . . . 4.1600000000000001 112.047 -168.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.5 p30 -83.9 -11.13 57.37 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.575 1.55 . . . . 2.48 111.1 174.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 70.28 13.72 7.6 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 130.256 3.423 . . . . 4.4500000000000002 113.997 -177.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -131.65 120.97 23.55 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 127.209 2.204 . . . . 2.48 108.924 179.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 47.4 mt -101.72 108.14 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.004 -1.06 . . . . 1.6000000000000001 111.709 -178.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -64.34 155.74 31.34 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 127.71 2.404 . . . . 2.5499999999999998 111.571 164.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -34.68 68.33 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.477 -1.389 . . . . 2.04 114.324 -179.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? -83.72 -24.66 31.12 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 120.497 -1.377 . . . . 2.9900000000000002 112.502 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -60.46 -54.25 47.85 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 108.777 -0.823 . . . . 1.9299999999999999 108.777 157.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -62.07 -33.05 73.69 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 126.706 2.003 . . . . 3.1200000000000001 115.77 -174.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.41 -21.65 65.56 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 120.872 -1.143 . . . . 1.8100000000000001 112.452 -171.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.1 p -57.45 -35.29 49.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 123.632 0.773 . . . . 2.3199999999999998 112.573 170.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.469 ' CE1' HD11 ' A' ' 79' ' ' LEU . 18.2 t80 -61.79 -61.01 2.81 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 126.144 1.778 . . . . 2.1299999999999999 111.299 -173.274 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.5 mt -68.15 -24.54 65.0 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.451 -0.785 . . . . 2.3999999999999999 111.332 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 30.0 m -61.59 -54.88 37.07 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.199 0.909 . . . . 0.68999999999999995 110.983 168.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 78.1 mtm -58.36 -37.66 75.66 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.258 0.935 . . . . 1.46 112.888 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.469 HD11 ' CE1' ' A' ' 75' ' ' PHE . 43.6 mt -73.36 -46.24 50.25 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.853 0.686 . . . . 1.5700000000000001 112.853 178.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 1.7 t -71.11 -25.86 62.78 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.418 -0.801 . . . . 1.8100000000000001 112.721 178.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 44.6 mmm -58.82 -48.51 81.06 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.807 1.243 . . . . 1.74 111.657 165.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.67 -37.85 85.58 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.17 -0.957 . . . . 0.84999999999999998 112.067 174.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -64.88 -33.11 75.24 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.161 1.171 . . . . 2.27 114.161 173.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -58.25 -46.7 85.49 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.608 1.095 . . . . 2.1899999999999999 111.499 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -75.47 -35.36 60.87 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.086 1.354 . . . . 3.8500000000000001 111.984 -172.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.21 -46.02 79.63 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.991 1.716 . . . . 2.25 110.981 167.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -69.02 -27.49 65.72 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.672 1.189 . . . . 2.5899999999999999 112.466 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 78.6 mt -70.33 -41.36 73.33 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.967 -1.083 . . . . 1.8500000000000001 111.546 171.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -71.47 -13.73 61.91 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.954 1.464 . . . . 3.21 114.954 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -75.14 -58.95 2.97 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.377 -0.827 . . . . 4.6299999999999999 111.182 163.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -68.32 -11.52 59.63 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 115.524 1.675 . . . . 3.8799999999999999 115.524 -165.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.908 0 C-N-CA 126.583 1.953 . . . . 4.9299999999999997 115.223 -179.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 118.02 -0.991 . . . . 5.6699999999999999 108.834 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -131.06 -131.82 0.2 Allowed 'General case' 0 CA--C 1.544 0.729 0 O-C-N 124.032 0.832 . . . . 9.1699999999999999 113.043 -164.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 72.4 p -66.84 168.75 9.64 Favored Pre-proline 0 C--O 1.237 0.42 0 C-N-CA 128.832 2.853 . . . . 2.8799999999999999 113.189 -156.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -65.01 -14.51 45.7 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 121.571 1.514 . . . . 1.96 112.489 168.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.2 -40.92 74.31 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-N 119.987 1.267 . . . . 3.0299999999999998 112.298 174.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -60.26 -27.6 67.38 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 120.676 1.58 . . . . 4.1500000000000004 112.58 171.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -74.7 -25.64 59.28 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.646 -1.284 . . . . 5.4400000000000004 111.869 171.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.45 -47.89 30.79 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.726 1.211 . . . . 1.02 112.116 172.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mp -60.5 -41.63 94.71 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 120.552 1.523 . . . . 2.4100000000000001 112.086 176.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 17.6 p -65.68 -39.41 91.29 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 118.147 -0.93 . . . . 2.0600000000000001 112.231 174.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 87.8 m -57.3 -45.48 84.13 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.775 1.17 . . . . 1.28 110.893 169.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 4.4 tmm? -60.18 -53.08 61.91 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.089 1.355 . . . . 3.79 111.584 -176.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 9.9 p -64.79 -25.06 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 O-C-N 121.241 -0.912 . . . . 2.1600000000000001 112.801 175.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 56.3 m -74.9 -45.42 42.82 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 117.978 -1.01 . . . . 0.75 111.276 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 8.6 p -58.48 -38.44 77.62 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.825 0.738 . . . . 1.5900000000000001 110.105 164.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -63.77 -51.98 62.41 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.927 -0.309 . . . . 2.4100000000000001 111.723 -173.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -78.16 -21.81 49.67 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 114.157 1.169 . . . . 2.23 114.157 -177.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -68.6 -54.88 13.75 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.068 0.849 . . . . 4.3499999999999996 111.374 167.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -73.25 -27.49 61.61 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 121.577 -0.702 . . . . 2.3500000000000001 112.412 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 10.5 p -68.74 -25.66 64.85 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.92 1.691 . . . . 2.3700000000000001 113.21 172.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.24 5.4 84.4 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 126.684 2.088 . . . . 1.6499999999999999 114.678 170.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -70.42 -29.11 65.63 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.166 1.483 . . . . 3.6800000000000002 112.171 172.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -156.75 153.84 29.03 Favored 'General case' 0 C--O 1.249 1.034 0 CA-C-O 121.899 0.857 . . . . 3.9500000000000002 112.255 176.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 58.08 -127.82 46.03 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 126.689 2.09 . . . . 2.5600000000000001 110.972 166.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.91 121.69 11.14 Favored 'General case' 0 C--O 1.249 1.027 0 O-C-N 122.267 -0.549 . . . . 3.0499999999999998 110.127 167.086 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -76.72 54.74 1.0 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 128.367 2.667 . . . . 7.4800000000000004 110.393 166.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 53.7 tp -161.28 -51.09 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 126.213 1.805 . . . . 2.7400000000000002 107.906 -178.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.6 p -92.28 157.42 16.67 Favored 'General case' 0 C--O 1.254 1.338 0 CA-C-O 123.513 1.625 . . . . 1.49 112.626 175.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -103.4 107.21 17.95 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 111.636 -2.529 . . . . 3.0800000000000001 107.814 167.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 41.4 t -70.91 143.03 51.1 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 108.594 -0.891 . . . . 2.1200000000000001 108.594 161.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -24.36 -51.51 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 128.727 2.811 . . . . 5.5700000000000003 116.352 -175.217 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -44.18 91.63 Favored 'General case' 0 CA--C 1.554 1.112 0 N-CA-C 116.107 1.891 . . . . 5.04 116.107 174.134 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -59.95 -43.74 94.81 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.862 2.065 . . . . 1.8 109.514 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.38 -44.93 70.5 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.245 1.418 . . . . 3.3399999999999999 110.834 -179.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -54.96 -42.11 71.94 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.069 -1.02 . . . . 2.8700000000000001 112.283 174.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -59.9 -49.06 79.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.532 0.733 . . . . 3.0299999999999998 111.805 174.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.5 tp -57.78 -44.52 86.29 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.144 0.978 . . . . 2.23 112.715 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 73.8 mt -56.74 -55.4 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 N-CA-C 109.558 -0.534 . . . . 1.29 109.558 171.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -63.5 -17.52 62.84 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 112.95 0.722 . . . . 4.5800000000000001 112.95 -175.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -87.25 -48.56 7.92 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 125.902 1.681 . . . . 4.7000000000000002 113.917 -178.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -116.09 -8.84 11.77 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 125.399 1.687 . . . . 6.5499999999999998 114.384 -159.254 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 24.0 tp -121.34 88.72 2.99 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.753 1.221 . . . . 2.5499999999999998 109.073 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 17.9 p -82.4 13.89 3.34 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 115.088 1.514 . . . . 4.4400000000000004 115.088 -157.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 8.0 mp -75.98 134.16 40.24 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.121 0.968 . . . . 3.5299999999999998 111.173 -169.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.59 -20.97 59.86 Favored Glycine 0 CA--C 1.532 1.15 0 CA-C-O 119.625 -0.541 . . . . 2.9399999999999999 113.83 177.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -87.39 -3.81 59.02 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.886 1.275 . . . . 5.6900000000000004 113.629 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 7.3 tpt -77.06 39.16 0.23 Allowed 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 124.309 2.004 . . . . 2.27 112.144 171.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -57.84 125.89 25.01 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 127.138 2.175 . . . . 3.98 109.848 -174.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 65.1 tt0 -58.38 -29.37 65.97 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 115.267 1.58 . . . . 3.5499999999999998 115.267 -166.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -66.66 -14.39 62.41 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 120.556 1.525 . . . . 2.4100000000000001 113.789 173.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 9.4 t -97.19 -7.84 31.44 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.669 1.588 . . . . 2.2999999999999998 112.422 172.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 12.5 mt -65.28 -40.39 88.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 119.843 1.202 . . . . 1.29 110.813 176.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -72.0 -23.89 61.48 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.206 0.817 . . . . 3.0800000000000001 113.206 -174.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -76.1 -37.22 58.38 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.467 0.707 . . . . 2.3900000000000001 111.809 172.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 10.3 tt -62.62 -49.39 75.38 Favored 'General case' 0 C--N 1.343 0.316 0 O-C-N 121.506 -0.746 . . . . 2.4399999999999999 110.184 168.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.09 -48.78 67.49 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 124.341 1.056 . . . . 3.1800000000000002 111.72 177.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -58.4 -36.47 73.61 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.313 1.845 . . . . 4.0300000000000002 113.056 173.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 67.9 m -77.57 -19.43 55.67 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.317 1.847 . . . . 2.1699999999999999 114.315 177.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 20.4 mt -78.08 -54.37 6.34 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.338 -0.851 . . . . 1.8 109.568 159.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -82.88 53.43 2.41 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 129.699 3.2 . . . . 2.0600000000000001 112.197 -172.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -58.53 -19.17 35.42 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.049 1.74 . . . . 3.2200000000000002 113.642 -172.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 50.9 p30 -96.23 -8.33 33.23 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.39 1.876 . . . . 2.1800000000000002 115.145 174.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 68.1 m 60.68 28.64 18.35 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.916 1.686 . . . . 2.1499999999999999 114.743 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 47.1 p30 -79.11 -8.54 59.06 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.173 -0.954 . . . . 2.29 111.562 177.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 71.12 -15.22 0.42 Allowed 'General case' 0 C--O 1.236 0.369 0 C-N-CA 131.038 3.735 . . . . 3.9700000000000002 115.282 171.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -78.3 150.14 33.37 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-O 122.752 1.263 . . . . 3.71 110.16 159.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 37.1 mm -113.72 112.14 39.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 125.824 1.649 . . . . 1.3100000000000001 108.561 164.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . 0.444 ' CG ' ' HZ2' ' B' ' 70' ' ' LYS . 0.0 OUTLIER -82.73 168.68 16.97 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.607 1.163 . . . . 2.8799999999999999 111.315 163.54 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -56.63 -33.27 66.14 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.508 0.929 . . . . 2.5499999999999998 113.508 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.444 ' HZ2' ' CG ' ' B' ' 68' ' ' ASP . 8.6 mtmp? -70.14 -44.28 69.19 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.555 -1.34 . . . . 4.1699999999999999 111.975 176.378 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -59.59 -47.91 83.74 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 118.838 0.744 . . . . 1.77 109.812 171.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -59.42 -31.91 69.71 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.849 1.66 . . . . 2.0499999999999998 114.851 179.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 38.3 t -56.43 -30.63 63.06 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.753 -1.217 . . . . 1.99 112.518 171.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 45.5 t -60.13 -44.47 95.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 O-C-N 121.394 -0.817 . . . . 1.54 110.471 175.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -58.24 -53.3 59.88 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.659 0.784 . . . . 1.6000000000000001 111.384 176.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 59.8 mt -60.28 -40.2 89.6 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.131 0.973 . . . . 1.55 111.604 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.9 m -62.02 -53.26 58.12 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.322 1.449 . . . . 0.80000000000000004 110.981 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.9 mtm -57.43 -38.79 74.95 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.383 0.512 . . . . 1.52 112.383 179.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 95.1 mt -70.39 -47.28 61.59 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 118.572 -0.728 . . . . 1.5800000000000001 111.699 178.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 65.0 m -64.4 -30.18 71.23 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 120.034 1.288 . . . . 1.8 113.872 175.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 81.3 mtp -64.39 -48.69 74.49 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.074 0.852 . . . . 2.2400000000000002 111.242 165.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.76 -39.01 92.84 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.298 0.953 . . . . 0.89000000000000001 112.513 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -66.66 -33.31 75.36 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.427 1.012 . . . . 3.3199999999999998 112.803 174.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.96 -49.99 58.5 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.271 1.028 . . . . 1.78 111.001 172.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -64.2 -46.69 82.8 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.802 1.241 . . . . 4.2000000000000002 110.725 -175.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -62.39 -41.26 98.53 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.234 1.813 . . . . 2.0600000000000001 112.509 174.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -64.26 -32.43 74.02 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 120.802 -1.186 . . . . 2.7200000000000002 111.104 174.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 66.0 mt -73.22 -17.25 61.37 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 117.934 -1.031 . . . . 1.8300000000000001 113.573 173.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -83.34 -15.01 51.66 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.905 1.23 . . . . 4.8700000000000001 113.679 168.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -85.57 -59.65 2.25 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.075 1.35 . . . . 3.1200000000000001 111.645 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.62 -4.67 32.3 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 115.064 1.505 . . . . 2.8599999999999999 115.064 -170.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.046 0 C-N-CA 126.649 1.98 . . . . 4.7800000000000002 114.969 175.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.6 ttm . . . . . 0 N--CA 1.476 0.852 0 N-CA-C 107.289 -1.374 . . . . 8.3300000000000001 107.289 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.4 mp0 -123.29 -67.8 0.92 Allowed 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 107.169 -1.419 . . . . 4.9199999999999999 107.169 -157.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 24.9 p -151.73 157.73 34.4 Favored Pre-proline 0 C--O 1.238 0.485 0 C-N-CA 128.569 2.747 . . . . 3.2400000000000002 108.617 177.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.77 -25.98 16.43 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 122.926 2.418 . . . . 2.6899999999999999 111.199 162.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.66 -47.01 85.55 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.676 1.59 . . . . 2.8599999999999999 112.351 -178.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -60.8 -34.73 74.95 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.258 0.481 . . . . 4.0599999999999996 111.746 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.33 -28.82 65.42 Favored 'General case' 0 CA--C 1.552 1.033 0 O-C-N 119.851 -1.781 . . . . 4.3899999999999997 112.17 175.424 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.16 -39.89 62.95 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.63 -0.669 . . . . 1.7 111.657 173.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 97.6 mt -59.9 -47.0 87.55 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.859 0.754 . . . . 1.3799999999999999 110.887 172.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.2 m -52.96 -54.52 33.76 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.424 1.49 . . . . 2.5499999999999998 112.031 171.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.7 t -66.86 -28.48 68.37 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-N 120.5 1.5 . . . . 2.6600000000000001 112.879 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.98 -48.45 63.1 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 117.782 -1.104 . . . . 3.77 112.365 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.0 p -63.74 -24.5 35.97 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-N 120.689 1.586 . . . . 2.27 111.848 175.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.9 m -73.9 -53.07 10.96 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.347 1.459 . . . . 0.72999999999999998 111.923 179.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.4 p -63.77 -35.01 79.18 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.701 1.137 . . . . 2.0499999999999998 110.533 171.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -59.05 -62.87 1.56 Allowed 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 108.925 -0.768 . . . . 1.8799999999999999 108.925 177.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.99 -31.13 69.74 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.647 1.112 . . . . 2.4700000000000002 112.725 -172.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -57.77 -49.25 77.22 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.704 -0.623 . . . . 4.2300000000000004 112.358 169.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -83.94 -29.57 26.99 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.951 -1.093 . . . . 2.9199999999999999 113.397 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.9 p -69.46 -30.69 68.65 Favored 'General case' 0 C--O 1.242 0.689 0 O-C-N 120.82 -1.175 . . . . 2.2999999999999998 111.047 172.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.57 -1.15 70.04 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 127.518 2.485 . . . . 1.72 115.467 171.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -72.23 -42.56 65.55 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.879 1.839 . . . . 5.8799999999999999 111.37 -177.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -149.56 166.44 29.22 Favored 'General case' 0 C--O 1.244 0.775 0 C-N-CA 125.781 1.633 . . . . 3.8500000000000001 113.011 -177.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.62 -132.77 51.62 Favored Glycine 0 C--N 1.339 0.735 0 C-N-CA 125.292 1.425 . . . . 2.5800000000000001 110.779 171.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.5 m -64.34 138.21 58.31 Favored 'General case' 0 C--O 1.249 1.051 0 O-C-N 121.934 -0.745 . . . . 2.6400000000000001 110.555 163.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 36.1 pttt -67.81 -24.81 65.33 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.31 0.644 . . . . 5.3799999999999999 111.929 171.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.0 mt -81.57 -23.74 36.95 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.931 1.292 . . . . 3.71 113.683 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 61.1 p -109.26 146.15 34.74 Favored 'General case' 0 C--O 1.244 0.799 0 CA-C-N 119.934 1.243 . . . . 1.24 111.276 175.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.84 83.37 2.54 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.245 -1.02 . . . . 2.1499999999999999 108.245 163.251 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.0 m -58.16 143.62 43.4 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 123.914 0.885 . . . . 3.7000000000000002 108.803 176.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 35.7 ptt-85 -47.47 -34.89 7.89 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 117.241 2.312 . . . . 6.3300000000000001 117.241 -158.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.5 ptmm? -51.76 -39.53 58.71 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 116.337 1.977 . . . . 4.6600000000000001 116.337 168.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -68.1 -52.57 33.49 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 128.334 2.654 . . . . 1.6499999999999999 108.747 169.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.6 tp -64.37 -33.95 77.03 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.799 0.666 . . . . 2.6099999999999999 112.799 -172.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -8.84 54.07 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 115.184 1.55 . . . . 4.8099999999999996 115.184 -179.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -74.96 -66.79 0.71 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 118.592 -0.718 . . . . 3.9500000000000002 109.758 156.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 31.8 tp -44.33 -54.49 5.76 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.319 1.448 . . . . 2.5299999999999998 113.26 -167.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 28.6 mt -48.14 -44.47 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 123.43 0.692 . . . . 0.96999999999999997 112.102 -176.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . 0.275 0.0 OUTLIER -84.45 -9.07 58.71 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-O 118.626 -0.702 . . . . 4.1600000000000001 110.896 -167.769 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -67.28 -57.58 6.39 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.733 1.151 . . . . 2.6699999999999999 109.627 168.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -54.95 -69.16 0.14 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.885 2.074 . . . . 4.5099999999999998 110.421 171.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -79.23 65.23 4.34 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.66 1.219 . . . . 2.6699999999999999 108.402 176.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.8 p -59.96 -55.09 38.31 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.411 1.884 . . . . 3.5 111.647 176.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.464 HD12 ' H ' ' A' ' 44' ' ' LEU . 4.4 mp -14.28 -110.82 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.737 1 C-N-CA 132.378 4.271 . . . . 4.7000000000000002 115.876 -174.789 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -147.13 -28.63 0.07 OUTLIER Glycine 0 N--CA 1.473 1.119 0 O-C-N 121.473 -0.767 . . . . 3.6000000000000001 114.595 175.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 27.1 mp0 -63.24 -43.04 99.15 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 128.339 2.656 . . . . 5.5199999999999996 111.581 -177.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.17 67.59 6.04 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 123.961 1.838 . . . . 2.1200000000000001 110.333 165.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.3 tptp -72.5 160.23 32.64 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 111.49 -2.595 . . . . 6.8799999999999999 109.652 160.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.565 ' CD ' ' H ' ' A' ' 49' ' ' GLU . 4.4 mp0 -52.25 -45.85 65.53 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.624 1.57 . . . . 4.75 113.188 -170.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.8 t -80.02 -15.17 57.77 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.507 1.299 . . . . 3.04 114.507 178.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.9 m -68.04 -19.27 64.87 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.129 1.332 . . . . 2.6800000000000002 111.712 173.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 70.6 mt -85.93 -24.12 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 125.548 1.539 . . . . 1.49 112.808 -175.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -57.0 -58.08 9.74 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.698 -0.852 . . . . 3.6200000000000001 108.698 162.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -66.45 -38.61 87.74 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.339 0.866 . . . . 2.5299999999999998 113.339 -175.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.68 -51.35 70.32 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 118.582 -0.723 . . . . 2.3999999999999999 110.395 171.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.08 -33.26 70.03 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.236 0.925 . . . . 1.8200000000000001 112.5 -176.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.3 mtpt -58.72 -39.38 80.67 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.446 1.021 . . . . 4.7599999999999998 112.489 170.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.7 t -77.41 -30.37 53.48 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.617 0.969 . . . . 1.77 113.617 173.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.52 -36.36 76.36 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 124.398 1.079 . . . . 2.6200000000000001 112.143 178.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -72.45 77.48 1.04 Allowed 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.682 1.193 . . . . 1.6200000000000001 111.276 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 3.5 0.21 Allowed 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.863 1.665 . . . . 5.3600000000000003 114.974 -170.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 38.7 p30 -137.67 -0.79 2.11 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 127.298 2.239 . . . . 3.0899999999999999 114.525 173.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.9 m 60.73 37.48 18.92 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 115.182 1.549 . . . . 4.1299999999999999 115.182 168.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -88.11 -32.0 18.92 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 126.905 2.082 . . . . 2.7599999999999998 112.975 177.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 105.89 -1.17 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.043 1 C-N-CA 136.455 5.902 . . . . 4.0999999999999996 114.087 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -107.92 136.38 47.73 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 128.21 2.604 . . . . 2.4900000000000002 110.429 178.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 24.7 mm -112.05 114.34 46.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 124.173 0.989 . . . . 1.5800000000000001 108.468 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -103.48 156.92 17.4 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.558 2.343 . . . . 3.3199999999999998 108.589 173.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -37.82 -45.19 0.81 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.976 1.71 . . . . 2.4399999999999999 114.241 176.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.3 pttt -63.9 -18.31 64.07 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.965 1.306 . . . . 3.6800000000000002 114.025 -177.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -105.14 -53.17 2.71 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 127.797 2.439 . . . . 2.9100000000000001 108.147 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -45.25 -35.1 3.17 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 128.384 2.674 . . . . 2.0699999999999998 114.81 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.1 m -68.79 -15.3 63.47 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 120.657 -1.277 . . . . 1.9399999999999999 113.182 178.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 84.3 t -67.06 -31.37 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-N 119.348 0.977 . . . . 2.2599999999999998 110.637 169.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -59.33 -53.19 61.08 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 118.983 0.811 . . . . 1.77 110.323 168.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 22.1 mt -62.73 -35.91 81.28 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.255 0.622 . . . . 1.5700000000000001 111.186 -176.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.4 m -63.2 -42.39 99.31 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 125.12 1.368 . . . . 1.1599999999999999 111.507 172.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 44.3 ttm -61.6 -42.6 99.1 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.499 1.12 . . . . 3.3799999999999999 111.431 178.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.34 -56.66 10.05 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.056 0.543 . . . . 2.7999999999999998 111.253 173.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.3 m -60.99 -34.34 74.65 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.8 1.037 . . . . 1.5800000000000001 113.8 -175.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 56.0 mtp -76.7 -24.99 53.11 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.927 1.24 . . . . 2.25 113.918 173.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.3 -43.63 40.61 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 120.525 1.511 . . . . 0.93999999999999995 111.454 169.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -63.61 -28.73 70.12 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.494 1.043 . . . . 2.23 112.914 173.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -54.38 -56.72 15.72 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.577 0.751 . . . . 2.0699999999999998 111.75 165.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.75 -42.35 81.93 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.855 0.862 . . . . 3.2400000000000002 111.661 -176.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.52 -44.44 69.14 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.589 1.956 . . . . 2.2400000000000002 112.347 172.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -70.62 -32.2 69.44 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.577 -1.327 . . . . 3.0800000000000001 111.723 176.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.3 mt -84.41 -1.52 55.69 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 125.466 1.507 . . . . 1.9399999999999999 113.546 174.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -74.11 -22.42 59.48 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 121.088 -1.007 . . . . 5.2300000000000004 112.348 162.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -106.28 -65.07 1.1 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.379 1.872 . . . . 5.0099999999999998 111.39 176.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -84.22 42.84 0.9 Allowed 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 126.726 2.011 . . . . 4.2199999999999998 112.467 -178.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.5 mmtt . . . . . 0 C--O 1.252 1.215 0 C-N-CA 130.375 3.47 . . . . 8.2899999999999991 115.959 -177.669 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.75 0 N-CA-C 103.636 -2.727 . . . . 5.1100000000000003 103.636 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.722 ' CD ' ' H ' ' B' ' 2' ' ' GLU . 7.5 mp0 -58.03 171.37 0.53 Allowed 'General case' 0 C--O 1.246 0.908 0 C-N-CA 126.119 1.767 . . . . 6.04 109.203 140.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 48.4 p -90.74 165.59 21.96 Favored Pre-proline 0 N--CA 1.469 0.486 0 C-N-CA 125.053 1.341 . . . . 1.75 112.629 -163.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -63.41 -20.66 70.51 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 121.818 1.679 . . . . 2.1600000000000001 112.898 168.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -80.19 -43.39 21.62 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-O 117.136 -1.412 . . . . 2.4300000000000002 111.905 175.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -56.93 -46.98 81.67 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.436 1.471 . . . . 4.6200000000000001 110.922 168.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -57.97 -27.8 63.78 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.103 -0.998 . . . . 5.1699999999999999 112.959 172.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.09 -39.85 54.39 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 120.597 -1.314 . . . . 1.6599999999999999 111.659 176.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 96.0 mt -66.22 -32.5 73.96 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.016 0.926 . . . . 1.73 112.011 171.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.4 m -60.44 -55.98 26.96 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.087 0.858 . . . . 1.8500000000000001 110.777 161.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 83.4 m -53.07 -39.48 63.33 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.15 1.38 . . . . 2.48 111.375 -174.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -48.25 -42.6 30.91 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.027 1.731 . . . . 3.9700000000000002 112.864 174.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 66.4 t -62.41 -28.64 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 124.967 1.307 . . . . 2.2000000000000002 112.674 178.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 14.5 m -66.07 -39.96 90.5 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.991 1.716 . . . . 1.1200000000000001 112.423 -179.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -44.94 68.34 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 126.548 1.939 . . . . 1.8400000000000001 108.713 169.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -67.73 -43.97 78.72 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 123.719 0.637 . . . . 2.04 111.721 -169.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.46 -47.84 83.93 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.895 0.878 . . . . 2.9300000000000002 111.479 170.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 3.7 ttmp? -73.19 -40.61 64.63 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.667 0.988 . . . . 3.8100000000000001 113.667 -171.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -70.67 -26.07 63.27 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.047 -0.978 . . . . 2.3199999999999998 112.187 166.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 32.3 m -68.19 -40.54 82.19 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 120.702 1.592 . . . . 1.49 113.118 167.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.59 -12.88 83.78 Favored Glycine 0 CA--C 1.532 1.153 0 C-N-CA 125.769 1.652 . . . . 1.78 112.9 -178.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.06 97.83 0.53 Allowed 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 105.832 -1.914 . . . . 4.5700000000000003 105.832 153.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 65.17 175.45 0.21 Allowed 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 126.175 1.79 . . . . 5.4400000000000004 114.655 167.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.66 -140.03 30.56 Favored Glycine 0 N--CA 1.474 1.231 0 C-N-CA 125.919 1.723 . . . . 2.1899999999999999 113.036 174.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 67.6 m -78.36 162.42 26.47 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.517 -0.99 . . . . 3.3199999999999998 112.553 171.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 19.2 ttmt -85.65 128.24 34.72 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 127.187 2.195 . . . . 7.1299999999999999 107.363 156.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.0 tt 91.59 -24.66 0.06 Allowed 'General case' 0 N--CA 1.492 1.625 0 C-N-CA 128.819 2.848 . . . . 3.54 112.321 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.55 137.1 47.06 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 125.287 1.435 . . . . 1.8100000000000001 109.623 170.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 75.7 mt -98.29 98.39 9.65 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.928 1.291 . . . . 1.5900000000000001 110.627 175.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 3.6 m -52.43 153.56 2.93 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 122.102 0.953 . . . . 2.3199999999999998 112.493 163.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 19.1 ttp85 -48.52 -39.55 23.7 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.893 1.277 . . . . 3.6299999999999999 114.162 -172.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -68.59 -40.72 80.37 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 119.58 -1.95 . . . . 6.3600000000000003 111.7 178.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -53.77 -51.13 64.39 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.638 1.575 . . . . 1.76 109.245 177.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 15.0 tp -64.77 -45.61 85.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.477 1.111 . . . . 2.04 112.657 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 2.1 tmpt? -58.17 -34.31 70.18 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 118.883 0.765 . . . . 4.8399999999999999 111.711 175.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -68.64 -54.54 15.75 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.624 0.769 . . . . 4.4000000000000004 111.676 172.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.43 -52.74 64.17 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 126.16 1.784 . . . . 2.1099999999999999 112.294 -176.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 29.0 mt -59.72 -44.44 93.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 119.338 0.972 . . . . 1.45 110.092 178.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.425 ' HZ1' ' CD ' ' B' ' 49' ' ' GLU . 13.8 tppt? -66.65 -11.79 55.36 Favored 'General case' 0 CA--C 1.557 1.23 0 O-C-N 121.512 -0.743 . . . . 5.0499999999999998 112.488 178.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmtm -105.46 -35.59 7.43 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.796 2.038 . . . . 5.2300000000000004 114.591 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -69.71 -63.26 1.11 Allowed 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 124.8 1.24 . . . . 5.04 109.668 170.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -86.32 56.83 4.16 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.022 0.929 . . . . 2.4199999999999999 108.976 179.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 4.8 t -70.09 24.78 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 125.588 1.555 . . . . 3.6099999999999999 114.868 -173.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 38.6 mt -77.41 -3.86 42.41 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 128.746 2.818 . . . . 3.54 113.516 -177.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.14 -49.24 4.19 Favored Glycine 0 N--CA 1.47 0.945 0 C-N-CA 125.042 1.306 . . . . 3.9100000000000001 112.692 179.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -60.48 -10.16 4.61 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.583 1.553 . . . . 5.46 114.381 176.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 8.0 tpt -71.31 69.05 0.54 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.106 1.762 . . . . 2.0600000000000001 111.203 170.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -88.94 153.41 21.05 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.656 1.982 . . . . 3.7799999999999998 112.845 -166.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.425 ' CD ' ' HZ1' ' B' ' 39' ' ' LYS . 5.3 mp0 -49.64 -57.32 7.42 Favored 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 127.12 2.168 . . . . 4.25 112.096 -165.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 12.0 m -73.12 -0.21 13.45 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.317 1.599 . . . . 2.5699999999999998 115.317 -179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 15.7 t -97.27 -33.39 11.47 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.437 1.095 . . . . 2.7400000000000002 111.451 164.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 38.8 mt -58.81 -35.33 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 124.677 1.191 . . . . 1.6100000000000001 110.015 166.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -61.66 -25.04 67.14 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.515 1.126 . . . . 3.8399999999999999 113.829 170.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.491 ' HA ' ' HE2' ' B' ' 57' ' ' LYS . 7.8 t70 -89.93 -32.95 16.6 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 121.021 1.737 . . . . 4.1799999999999997 113.051 173.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -52.0 -41.72 62.41 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 118.646 -0.693 . . . . 2.5600000000000001 109.42 158.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -53.49 52.56 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 120.139 1.336 . . . . 2.1400000000000001 111.55 175.389 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . 0.491 ' HE2' ' HA ' ' B' ' 54' ' ' ASP . 30.0 mtmm -51.1 -44.1 61.21 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 118.988 0.813 . . . . 3.7000000000000002 112.9 176.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 38.9 m -76.06 -40.39 53.37 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.895 1.278 . . . . 2.02 113.279 -176.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 9.6 mp -71.36 -35.8 71.26 Favored 'General case' 0 C--O 1.225 -0.194 0 O-C-N 120.959 -1.088 . . . . 2.3399999999999999 111.808 178.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -100.11 98.49 9.2 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 119.612 1.096 . . . . 1.4299999999999999 113.897 -163.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -98.14 -14.8 20.22 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.933 1.693 . . . . 3.27 115.278 -176.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.88 -21.27 60.15 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 119.448 1.022 . . . . 2.5800000000000001 110.303 152.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 50.6 m 60.78 66.69 0.89 Allowed 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.04 1.736 . . . . 4.3399999999999999 111.165 168.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -147.3 -116.49 0.07 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.665 1.586 . . . . 3.5600000000000001 109.5 -148.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -149.74 -5.18 0.36 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 116.57 2.063 . . . . 4.54 116.57 169.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -115.37 139.13 50.27 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.89 1.276 . . . . 2.46 111.527 167.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 8.0 mm -94.27 110.78 24.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 126.24 1.816 . . . . 1.1699999999999999 109.858 172.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -58.22 156.26 10.1 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.593 1.157 . . . . 3.3999999999999999 110.705 166.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.99 -39.52 66.1 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.164 -1.585 . . . . 2.3500000000000001 111.525 169.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -76.59 -18.07 58.84 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.751 1.389 . . . . 3.8799999999999999 114.751 178.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -73.97 -50.33 20.46 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 108.322 -0.992 . . . . 1.8799999999999999 108.322 163.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -61.1 -26.28 67.56 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 128.814 2.845 . . . . 1.96 115.338 -177.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 68.6 m -47.91 -34.55 9.17 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 120.851 -1.156 . . . . 2.21 113.441 172.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 6.6 m -69.22 -22.45 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 O-C-N 121.208 -0.933 . . . . 2.6400000000000001 113.155 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -64.97 -59.54 4.05 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.101 0.96 . . . . 1.8100000000000001 110.031 175.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 58.6 mt -55.19 -37.65 67.34 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.792 0.837 . . . . 1.52 110.839 176.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 30.8 m -57.95 -61.84 2.25 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.619 1.168 . . . . 0.91000000000000003 111.677 173.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 24.3 ptp -68.08 -32.21 72.37 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 118.949 0.795 . . . . 1.8300000000000001 112.848 -174.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -46.02 81.22 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.923 0.889 . . . . 3.25 110.529 175.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.6 t -69.9 -27.67 64.98 Favored 'General case' 0 CA--C 1.545 0.786 0 O-C-N 121.736 -0.602 . . . . 2.1200000000000001 112.5 175.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 61.6 mtp -67.19 -40.38 86.53 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.837 -1.164 . . . . 1.96 112.768 168.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.81 -37.3 78.76 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.566 1.076 . . . . 0.77000000000000002 111.397 172.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 5.0 m-30 -65.7 -24.16 66.93 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.955 1.094 . . . . 2.1899999999999999 113.955 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -70.28 -41.3 73.59 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 119.82 1.191 . . . . 2.2400000000000002 111.866 174.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -65.61 -44.56 86.19 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.375 1.07 . . . . 3.3199999999999998 110.519 176.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.82 -47.05 77.88 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.14 1.776 . . . . 2.0600000000000001 111.884 174.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -63.66 -21.37 66.34 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.192 1.397 . . . . 2.6099999999999999 112.382 175.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 85.5 mt -88.27 -7.19 57.16 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 114.305 1.224 . . . . 1.79 114.305 176.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -70.18 -35.2 73.79 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.171 0.896 . . . . 5.1399999999999997 111.779 161.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -100.75 -65.34 0.97 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.538 1.935 . . . . 3.54 112.681 -168.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -79.91 34.36 0.29 Allowed 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 125.594 1.558 . . . . 3.9100000000000001 112.501 175.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.875 0 C-N-CA 131.521 3.928 . . . . 7.1699999999999999 117.518 -172.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.9 ptt? . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 108.569 -0.9 . . . . 7.9000000000000004 108.569 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -110.67 -93.92 0.43 Allowed 'General case' 0 CA--C 1.537 0.445 0 O-C-N 124.907 1.379 . . . . 3.75 108.633 -153.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.433 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 1.2 p -153.26 179.61 1.25 Allowed Pre-proline 0 N--CA 1.478 0.965 0 C-N-CA 127.03 2.132 . . . . 1.46 109.123 169.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.433 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 95.0 Cg_endo -76.9 -9.31 18.12 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 121.471 1.447 . . . . 1.47 113.7 171.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -76.92 -49.63 15.15 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.022 1.329 . . . . 2.71 112.67 -178.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -56.66 -34.96 67.86 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.574 1.079 . . . . 4.5 110.876 169.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.7 mtpm? -73.24 -26.65 61.21 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.575 -1.328 . . . . 4.71 113.415 173.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.0 -49.99 39.11 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.756 1.222 . . . . 1.21 109.921 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.3 mt -56.16 -45.49 79.65 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.319 1.048 . . . . 1.8500000000000001 111.258 171.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.4 m -54.42 -53.34 55.48 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.091 0.956 . . . . 1.77 111.736 171.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 t -67.39 -32.76 73.9 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 120.094 1.315 . . . . 2.2200000000000002 112.172 -178.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 95.4 mtp -59.0 -51.65 69.16 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.412 1.085 . . . . 2.8900000000000001 112.452 169.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.2 m -68.82 -28.55 40.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 CA-C-N 119.153 0.888 . . . . 2.1800000000000002 112.745 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 90.9 m -60.84 -57.02 14.41 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.88 1.272 . . . . 0.85999999999999999 110.089 173.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -57.94 -40.06 79.59 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 122.789 0.436 . . . . 2.21 110.736 172.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -64.14 -47.86 78.29 Favored 'General case' 0 C--N 1.334 -0.077 0 C-N-CA 119.901 -0.719 . . . . 1.97 112.078 -171.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -40.67 74.57 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.881 1.218 . . . . 2.8100000000000001 111.759 178.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -58.37 -47.33 84.17 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.684 1.993 . . . . 3.73 113.427 178.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -70.78 -37.38 73.33 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.827 0.851 . . . . 2.3900000000000001 112.481 168.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.3 m -64.22 -20.59 66.13 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.816 -1.178 . . . . 2.27 113.771 178.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -98.33 40.35 2.51 Favored Glycine 0 CA--C 1.533 1.186 0 C-N-CA 127.501 2.477 . . . . 1.99 113.11 171.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.1 mmp_? -105.08 -17.89 14.34 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.275 1.03 . . . . 4.96 113.169 167.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -175.03 172.41 2.84 Favored 'General case' 0 C--O 1.248 0.984 0 C-N-CA 127.172 2.189 . . . . 4.7000000000000002 110.737 -173.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.57 -135.48 50.57 Favored Glycine 0 C--N 1.337 0.629 0 C-N-CA 124.915 1.245 . . . . 1.97 111.726 171.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.1 m -84.89 164.46 18.38 Favored 'General case' 0 C--O 1.246 0.872 0 CA-C-O 121.494 0.664 . . . . 2.54 112.079 163.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -84.64 156.31 21.6 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.18 0.992 . . . . 4.9299999999999997 110.224 157.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.2 tp 73.15 -2.74 2.64 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.745 2.018 . . . . 3.9300000000000002 112.392 -159.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 61.3 p -138.89 150.41 45.93 Favored 'General case' 0 C--O 1.253 1.272 0 C-N-CA 125.342 1.457 . . . . 0.95999999999999996 113.798 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.1 mt -114.87 109.79 18.68 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.711 2.004 . . . . 1.5600000000000001 111.631 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.9 t -84.42 173.76 10.63 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.042 1.337 . . . . 2.3199999999999998 112.042 167.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -51.36 -41.72 60.83 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 114.724 1.379 . . . . 3.8900000000000001 114.724 -163.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.42 ' HZ2' ' HB2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -82.68 -28.94 30.27 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 120.332 1.424 . . . . 3.7400000000000002 113.414 178.545 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -56.45 -46.09 80.5 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.281 0.946 . . . . 1.7 109.81 166.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -73.09 -41.86 63.61 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.124 0.97 . . . . 2.3300000000000001 111.016 -173.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.74 -41.16 77.04 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.253 -0.905 . . . . 6.4400000000000004 113.28 167.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -70.61 -31.43 68.41 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.943 0.72 . . . . 3.2599999999999998 112.943 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 tt -64.75 -63.48 1.11 Allowed 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.47 -0.937 . . . . 2.23 108.47 174.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.7 mt -56.28 -56.72 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-N 119.044 0.838 . . . . 1.05 112.305 -172.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 mmmm -79.26 4.22 15.67 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.496 1.295 . . . . 5.0599999999999996 114.496 -171.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -112.37 -36.5 5.26 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 117.718 -1.134 . . . . 3.21 113.656 166.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -66.27 -34.15 77.35 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.104 1.361 . . . . 3.9399999999999999 112.81 172.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -105.82 108.72 20.38 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 107.974 -1.121 . . . . 2.3999999999999999 107.974 168.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 28.2 p -80.13 51.99 1.47 Allowed 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.101 0.96 . . . . 4.7699999999999996 113.227 -178.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.5 mp -111.11 153.51 25.59 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.773 2.029 . . . . 4.54 112.722 -170.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -82.91 -17.95 66.44 Favored Glycine 0 CA--C 1.536 1.355 0 O-C-N 121.219 -0.926 . . . . 3.8199999999999998 112.59 166.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -79.34 -157.18 0.12 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 129.561 3.144 . . . . 5.9000000000000004 111.024 178.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.8 tpt 55.86 22.01 5.29 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 123.494 1.616 . . . . 3.1400000000000001 113.589 -178.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.6 tttm -72.03 154.44 41.13 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 113.732 -1.576 . . . . 5.6699999999999999 114.136 -141.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.7 mp0 -66.02 -22.17 66.43 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 116.058 1.873 . . . . 5.5999999999999996 116.058 -134.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.7 t -67.09 -15.23 63.59 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.3 -1.5 . . . . 2.4700000000000002 113.783 171.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.7 t -82.98 -12.23 57.46 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.667 1.187 . . . . 2.9199999999999999 113.4 170.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 18.0 mm -74.87 -35.05 34.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 124.568 1.147 . . . . 1.6899999999999999 110.924 -176.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.92 -33.23 75.23 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.661 1.584 . . . . 3.0600000000000001 110.899 176.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -75.23 -47.39 28.35 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-O 118.397 -0.811 . . . . 2.4199999999999999 111.79 165.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.23 -45.12 68.58 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.581 1.082 . . . . 2.3900000000000001 110.87 -172.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.6 ppp? -62.88 -48.67 77.97 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 122.149 -0.344 . . . . 2.29 111.701 175.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -18.95 47.81 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.406 2.282 . . . . 4.0499999999999998 114.342 173.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.9 m -94.98 -27.63 15.55 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 127.411 2.284 . . . . 3.1699999999999999 112.934 177.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 96.9 mt -76.91 -33.46 57.75 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.366 1.066 . . . . 1.9199999999999999 112.002 165.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -73.35 68.65 1.09 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.985 2.114 . . . . 1.78 112.582 -173.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.1 tttt -54.29 -23.84 16.68 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 127.97 2.508 . . . . 4.5899999999999999 114.009 -175.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -85.06 -23.13 28.69 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.472 1.286 . . . . 2.4100000000000001 114.472 173.057 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.3 t 57.73 63.75 1.73 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.043 1.337 . . . . 2.54 112.432 -167.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -120.12 -108.75 0.35 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.427 2.291 . . . . 2.7400000000000002 109.338 -172.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -142.45 -19.9 0.69 Allowed 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 115.231 1.567 . . . . 6.04 115.231 167.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -132.7 145.5 51.1 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 122.599 1.19 . . . . 2.4700000000000002 110.815 -169.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 8.8 mm -86.88 113.48 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 125.713 1.605 . . . . 1.27 107.666 174.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.34 174.12 11.92 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.767 0.827 . . . . 3.0899999999999999 111.702 167.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -54.5 -38.24 66.25 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-O 122.564 1.173 . . . . 2.2599999999999998 112.163 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -78.45 -22.06 48.17 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.107 2.163 . . . . 3.1200000000000001 113.577 -173.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -79.01 -54.11 6.35 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.213 1.805 . . . . 1.72 109.005 161.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -53.7 -37.72 63.55 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 128.122 2.569 . . . . 2.4399999999999999 115.005 -173.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -20.23 56.7 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 120.988 -1.07 . . . . 2.02 113.755 174.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 53.3 t -70.13 -28.24 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 120.875 -1.141 . . . . 1.79 110.973 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -64.58 -53.56 45.93 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.369 -0.832 . . . . 1.98 110.928 171.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -54.64 -45.79 73.84 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.427 1.091 . . . . 2.1200000000000001 110.548 177.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 88.1 m -53.6 -49.28 68.12 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.373 1.069 . . . . 0.81000000000000005 112.263 176.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 50.4 mtm -62.18 -47.48 84.29 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 118.684 0.675 . . . . 1.3700000000000001 112.596 178.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.8 mt -65.56 -36.75 84.7 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.737 -0.602 . . . . 1.5800000000000001 112.125 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 4.3 t -68.44 -32.34 72.3 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 118.467 -0.777 . . . . 1.3200000000000001 112.477 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -47.72 85.12 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 118.855 0.752 . . . . 3.6899999999999999 110.921 171.185 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.26 -38.02 89.04 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.196 0.907 . . . . 1.6899999999999999 113.086 -175.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -68.68 -29.93 68.5 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.134 0.79 . . . . 2.6699999999999999 113.134 174.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -73.79 -44.27 56.45 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.943 0.792 . . . . 2.3799999999999999 111.669 171.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -72.44 -16.7 61.82 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.435 1.094 . . . . 4.4900000000000002 111.664 -173.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -50.91 -57.83 7.52 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.624 1.97 . . . . 3.1200000000000001 111.682 166.037 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -55.18 -28.9 56.22 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.973 0.909 . . . . 3.79 112.584 176.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 71.6 mt -83.39 -18.47 38.69 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.782 0.833 . . . . 1.96 111.324 -172.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.412 ' HA ' ' HZ3' ' A' ' 92' ' ' LYS . 71.3 mm-40 -90.4 -15.32 31.22 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.905 1.446 . . . . 3.7999999999999998 114.905 164.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -77.15 -29.2 54.47 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.607 1.163 . . . . 3.4700000000000002 111.818 163.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -85.95 56.89 4.18 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.711 2.005 . . . . 5.2800000000000002 112.64 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.412 ' HZ3' ' HA ' ' A' ' 89' ' ' GLU . 39.7 mmtm . . . . . 0 C--O 1.25 1.118 0 C-N-CA 128.548 2.739 . . . . 4.9400000000000004 114.037 172.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.479 1.007 0 N-CA-C 107.927 -1.138 . . . . 5.7199999999999998 107.927 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -69.57 170.06 11.42 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 126.459 1.904 . . . . 6.0899999999999999 109.663 168.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 71.6 p -71.03 159.62 85.02 Favored Pre-proline 0 N--CA 1.476 0.854 0 O-C-N 121.984 -0.447 . . . . 1.8999999999999999 111.52 177.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -62.46 -20.06 69.36 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.005 1.803 . . . . 1.3 112.738 174.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -83.13 -41.72 18.19 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.736 1.215 . . . . 3.2999999999999998 111.949 174.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -58.29 -31.88 67.9 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.606 1.094 . . . . 3.6099999999999999 110.923 164.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.81 -30.46 62.73 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.106 -1.621 . . . . 4.0800000000000001 112.921 172.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.16 -43.35 92.08 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.206 -0.934 . . . . 1.0 111.027 168.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 81.6 mt -61.36 -44.77 96.6 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.429 1.091 . . . . 1.54 111.84 169.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 85.7 m -53.43 -47.2 69.84 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.73 1.212 . . . . 2.1600000000000001 110.543 174.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 27.3 m -59.42 -52.5 65.36 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.041 0.937 . . . . 1.5800000000000001 109.326 174.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 4.3 tpp -50.13 -53.56 26.71 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.943 1.697 . . . . 3.2799999999999998 112.299 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 21.2 m -70.99 -21.27 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 112.706 0.632 . . . . 2.4500000000000002 112.706 -175.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 61.5 m -83.42 -45.29 13.84 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.034 1.333 . . . . 0.84999999999999998 111.283 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -54.61 -41.08 69.52 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.497 -0.557 . . . . 1.6499999999999999 109.497 164.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -71.75 -35.22 70.05 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 120.326 -0.55 . . . . 2.1800000000000002 111.662 -176.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -64.42 -51.12 64.74 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 120.444 -1.41 . . . . 2.6699999999999999 112.095 170.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -55.93 -51.84 66.23 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.924 0.889 . . . . 6.3600000000000003 111.788 177.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.476 ' CD2' HD13 ' B' ' 37' ' ' LEU . 56.1 m-85 -83.43 -34.99 25.35 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 117.372 -1.299 . . . . 1.9399999999999999 112.504 -172.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 60.2 p -68.39 -28.68 67.31 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 121.351 1.887 . . . . 1.6699999999999999 111.733 174.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.27 17.37 5.08 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 125.81 1.671 . . . . 1.7 114.516 170.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 5.6 mmp_? -92.45 62.88 4.03 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 120.372 2.086 . . . . 6.6100000000000003 109.608 166.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 71.2 -177.91 0.21 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.195 1.398 . . . . 4.3300000000000001 112.123 -175.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.72 -146.0 50.14 Favored Glycine 0 CA--C 1.53 0.988 0 N-CA-C 109.829 -1.309 . . . . 2.1699999999999999 109.829 -156.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 73.3 m -78.67 153.97 30.54 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.277 -1.131 . . . . 3.5099999999999998 111.405 161.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 15.4 ttpt -68.24 55.81 0.07 Allowed 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 125.344 1.458 . . . . 7.7699999999999996 111.153 160.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -170.88 -31.99 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 126.42 1.888 . . . . 3.2999999999999998 111.658 -165.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 20.7 p -119.34 151.58 38.22 Favored 'General case' 0 C--O 1.242 0.694 0 C-N-CA 125.764 1.626 . . . . 1.0800000000000001 113.422 -175.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 87.4 mt -114.53 119.44 36.82 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.274 2.23 . . . . 1.77 112.243 178.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 4.8 t -104.18 179.22 4.34 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 113.506 0.928 . . . . 2.98 113.506 162.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 31.0 ttp180 -56.16 -36.02 67.84 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.71 1.744 . . . . 4.0800000000000001 115.71 -161.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -29.04 64.0 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 120.457 -1.402 . . . . 5.4800000000000004 113.452 173.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -72.22 -51.68 19.93 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 108.006 -1.109 . . . . 2.1000000000000001 108.006 177.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 mt -67.71 -33.15 74.33 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-O 117.475 -1.25 . . . . 2.5 113.884 176.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.7 ttmt -53.13 -48.63 67.75 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 120.816 1.644 . . . . 3.46 111.788 170.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -66.38 -45.54 79.7 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.378 0.881 . . . . 3.8599999999999999 113.378 176.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . 0.476 HD13 ' CD2' ' B' ' 19' ' ' TYR . 55.1 tp -74.05 -45.24 50.72 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 117.682 -1.152 . . . . 2.04 112.572 -175.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 28.6 mt -57.25 -52.43 56.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 CA-C-N 121.041 1.746 . . . . 1.3700000000000001 107.999 176.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . 0.344 0.0 OUTLIER -70.49 8.46 0.82 Allowed 'General case' 0 CA--C 1.558 1.268 0 CA-C-O 122.022 0.915 . . . . 5.4900000000000002 113.106 -178.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 10.1 mmtm -118.99 -29.6 5.23 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 127.158 2.183 . . . . 5.8200000000000003 115.696 170.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -67.86 -29.73 68.94 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.964 1.256 . . . . 5.6100000000000003 109.706 160.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.451 HD21 HD11 ' B' ' 79' ' ' LEU . 3.7 mm? -111.49 63.86 0.62 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 126.391 1.877 . . . . 2.6400000000000001 109.015 170.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.9 t -62.72 -33.69 75.64 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 120.443 -1.411 . . . . 3.3999999999999999 111.945 -178.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.421 HD23 ' H ' ' B' ' 44' ' ' LEU . 1.8 pt? -90.49 -5.0 56.57 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.022 1.729 . . . . 4.0 114.996 172.227 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -103.79 10.98 52.97 Favored Glycine 0 N--CA 1.475 1.296 0 CA-C-O 118.401 -1.222 . . . . 3.4300000000000002 115.915 -162.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 70.87 -83.52 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.339 1.855 . . . . 5.6299999999999999 112.663 169.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 1.1 mmt 70.71 87.91 0.11 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 128.455 2.702 . . . . 3.3599999999999999 113.309 -168.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 mttp -61.59 133.61 55.85 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.655 -1.278 . . . . 3.5899999999999999 110.951 166.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -36.06 -56.89 0.72 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 127.12 2.168 . . . . 3.7999999999999998 114.998 -177.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 29.3 t -67.28 -15.01 63.44 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.389 1.255 . . . . 3.4100000000000001 114.389 -176.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 10.5 t -85.43 -12.51 51.82 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.405 1.002 . . . . 2.3100000000000001 112.796 171.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 71.3 mt -77.74 -37.53 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 CA-C-N 119.316 0.962 . . . . 2.7599999999999998 109.871 179.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -70.79 -39.93 72.85 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.718 1.207 . . . . 2.9100000000000001 113.108 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -68.77 -40.25 79.8 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 118.489 0.586 . . . . 2.9900000000000002 111.4 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 25.4 tp -59.23 -48.42 81.68 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 117.429 -1.272 . . . . 1.8999999999999999 110.437 172.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 58.0 mmm -50.18 -48.83 53.86 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 120.158 1.344 . . . . 2.29 111.823 173.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -16.82 48.83 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.107 1.763 . . . . 4.2800000000000002 113.994 175.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.13 -31.9 12.23 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.399 1.48 . . . . 2.2599999999999998 113.659 171.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . 0.453 HD22 ' HB2' ' B' ' 75' ' ' PHE . 13.1 mt -76.21 -24.13 54.65 Favored 'General case' 0 N--CA 1.463 0.186 0 O-C-N 120.933 -1.104 . . . . 1.99 111.56 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -94.04 149.05 21.58 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.504 1.122 . . . . 1.98 113.664 168.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -99.78 -11.76 20.53 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.734 1.614 . . . . 3.6800000000000002 113.169 172.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.63 -62.79 1.53 Allowed 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.342 0.868 . . . . 1.8200000000000001 113.342 -157.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 58.6 m 109.98 12.57 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.116 1 C-N-CA 132.332 4.253 . . . . 2.77 111.667 -157.146 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 48.0 p-10 -83.82 8.18 15.62 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 119.377 -2.077 . . . . 2.71 112.289 -165.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 55.18 2.05 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 130.564 3.546 . . . . 4.1699999999999999 115.923 -166.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -131.88 121.14 23.57 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 125.499 1.52 . . . . 2.8100000000000001 111.342 -168.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 2.8 mp -93.06 103.84 15.1 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.398 1.479 . . . . 1.8500000000000001 107.736 177.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.24 160.18 32.65 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.268 1.427 . . . . 3.3599999999999999 111.517 169.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -47.69 -46.93 29.89 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.579 1.551 . . . . 2.2599999999999998 112.512 -179.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -69.2 -17.45 63.8 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.817 0.847 . . . . 4.8099999999999996 112.776 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -84.44 -51.96 6.53 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.592 1.157 . . . . 1.9199999999999999 109.966 170.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -53.13 -25.81 14.54 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.89 2.476 . . . . 1.75 114.14 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.27 -20.17 65.22 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.776 -1.202 . . . . 2.5099999999999998 111.426 177.53 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.3 p -70.45 -31.32 46.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 O-C-N 120.79 -1.194 . . . . 2.0699999999999998 112.252 172.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.453 ' HB2' HD22 ' B' ' 59' ' ' LEU . 10.7 t80 -63.36 -56.16 18.61 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 108.682 -0.858 . . . . 1.8100000000000001 108.682 174.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 96.2 mt -53.88 -39.56 65.81 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.832 1.253 . . . . 1.4099999999999999 112.385 175.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 97.8 m -62.16 -53.58 53.28 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.294 1.038 . . . . 0.94999999999999996 111.862 176.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 19.7 ptp -68.82 -32.87 72.88 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 118.604 0.638 . . . . 1.8500000000000001 112.64 -177.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.451 HD11 HD21 ' B' ' 42' ' ' LEU . 2.0 mm? -65.64 -49.69 67.77 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.043 0.937 . . . . 2.4300000000000002 112.277 170.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 12.8 t -65.45 -32.0 73.38 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.035 0.383 . . . . 1.6599999999999999 112.035 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -45.9 92.84 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.837 0.744 . . . . 2.6000000000000001 112.255 167.034 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.02 -40.73 94.68 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.176 0.898 . . . . 0.80000000000000004 111.89 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -60.95 -24.8 66.35 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.431 1.271 . . . . 2.04 114.431 176.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -70.03 -42.55 72.8 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.636 1.107 . . . . 1.98 111.909 174.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -69.8 -41.3 75.23 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.959 0.904 . . . . 3.02 110.315 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -51.45 -53.09 40.62 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.581 1.552 . . . . 2.3100000000000001 110.9 169.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -61.96 -24.25 66.89 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.54 1.536 . . . . 2.9399999999999999 113.705 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 47.0 mt -79.7 -23.44 42.4 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.529 -1.357 . . . . 1.8600000000000001 112.456 174.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -94.55 -6.69 43.09 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.74 1.385 . . . . 4.04 114.74 170.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -86.38 -37.57 18.28 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 127.35 2.26 . . . . 3.7400000000000002 113.488 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -82.33 49.55 1.45 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.193 1.797 . . . . 3.8399999999999999 113.244 -167.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? . . . . . 0 C--O 1.252 1.219 0 C-N-CA 128.095 2.558 . . . . 7.71 114.334 178.06 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.478 0.958 0 CA-C-O 117.242 -1.361 . . . . 6.8300000000000001 110.226 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 46.62 -120.51 1.04 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.769 2.028 . . . . 3.75 112.821 167.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 66.2 p -153.17 162.43 26.47 Favored Pre-proline 0 N--CA 1.472 0.665 0 C-N-CA 124.893 1.277 . . . . 1.8500000000000001 111.61 -161.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -64.5 -11.75 30.06 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 122.426 2.084 . . . . 1.6000000000000001 113.128 166.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.91 -38.05 15.94 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.104 1.362 . . . . 2.5800000000000001 111.471 178.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -55.44 -50.5 69.67 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 108.961 -0.755 . . . . 4.8499999999999996 108.961 159.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.428 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -59.18 -31.08 68.68 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.665 -0.647 . . . . 3.7599999999999998 112.6 177.063 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.34 -53.69 39.95 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.429 0.692 . . . . 1.21 110.861 172.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 44.8 mt -54.77 -44.75 73.95 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.058 0.943 . . . . 1.95 112.234 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.8 p -69.37 -36.87 77.25 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 117.844 -1.074 . . . . 2.2599999999999998 112.447 176.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.4 m -62.32 -39.92 94.62 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 120.292 1.405 . . . . 1.3500000000000001 111.564 171.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 72.8 mtp -60.59 -51.92 67.37 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.067 0.947 . . . . 3.21 112.173 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.3 p -63.46 -34.37 67.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 CA-C-N 118.692 0.678 . . . . 2.52 111.506 173.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 85.3 m -61.74 -53.71 52.31 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 117.923 -1.037 . . . . 0.81999999999999995 111.067 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.5 p -55.97 -43.29 77.43 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.036 0.835 . . . . 2.23 109.559 172.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -64.64 -54.63 28.84 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.302 0.376 . . . . 1.98 111.51 -169.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.7 -32.65 73.45 Favored 'General case' 0 CA--C 1.548 0.869 0 O-C-N 121.544 -0.723 . . . . 2.5099999999999998 111.831 179.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -76.81 -12.87 60.04 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.453 1.279 . . . . 4.1699999999999999 114.453 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -92.43 -33.24 14.61 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 119.527 1.058 . . . . 2.46 112.56 155.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.8 p -42.76 -48.3 5.6 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 117.389 2.366 . . . . 3.7799999999999998 117.389 -163.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -88.01 4.82 85.49 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 125.393 1.473 . . . . 1.95 114.319 -173.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 35.3 mtp180 -92.6 50.26 1.57 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.663 1.232 . . . . 5.5 108.957 175.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 115.34 151.76 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.877 1 C-N-CA 131.832 4.053 . . . . 4.4000000000000004 111.455 -177.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.86 -159.99 48.51 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 120.752 -1.218 . . . . 2.27 113.391 -179.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.4 t -75.22 161.91 28.93 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.885 -0.773 . . . . 3.77 111.981 172.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.0 mmtp -49.96 -24.92 2.84 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.279 1.432 . . . . 4.7199999999999998 112.404 155.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 18.9 tp -93.47 -13.64 27.65 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 117.35 -1.309 . . . . 3.8500000000000001 114.095 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 53.7 p -128.04 145.04 51.11 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-N 120.714 1.597 . . . . 0.96999999999999997 114.983 -168.012 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.8 mt -101.19 120.44 40.23 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.772 1.629 . . . . 1.5800000000000001 111.876 170.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.4 p -78.37 171.81 14.53 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.961 1.467 . . . . 2.9700000000000002 114.961 -177.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -45.43 -27.6 0.73 Allowed 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 115.021 1.489 . . . . 3.3700000000000001 115.021 167.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.93 -38.97 6.43 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.863 1.265 . . . . 3.8599999999999999 113.148 -178.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -67.63 -30.06 69.53 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.062 1.345 . . . . 2.1899999999999999 111.584 175.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.2 tp -75.33 -47.97 25.3 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.097 0.959 . . . . 1.8700000000000001 112.417 173.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -15.2 57.59 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.95 1.463 . . . . 4.79 114.95 -172.639 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -94.87 -39.23 10.34 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.951 1.093 . . . . 4.6299999999999999 113.951 175.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 39.6 tp -58.33 -50.78 72.43 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.469 1.031 . . . . 2.3599999999999999 111.558 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.1 mt -52.51 -57.09 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-O 121.628 0.728 . . . . 0.98999999999999999 109.081 175.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.404 ' HE2' ' OE1' ' A' ' 49' ' ' GLU . 25.9 ttpp -67.11 -8.3 29.71 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.254 1.205 . . . . 3.8399999999999999 114.254 -176.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.9 mmtm -95.27 -33.43 12.57 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 125.358 1.463 . . . . 3.7999999999999998 112.212 172.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -68.61 -66.96 0.51 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.086 1.754 . . . . 4.9500000000000002 110.045 169.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -70.52 22.54 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 126.667 1.987 . . . . 2.8300000000000001 113.667 176.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 12.9 t -67.36 2.27 1.78 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.708 2.003 . . . . 3.29 113.951 177.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -68.96 -10.99 60.23 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.638 0.775 . . . . 4.79 112.639 167.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 145.38 13.08 0.22 Allowed Glycine 0 CA--C 1.528 0.889 0 CA-C-O 117.909 -1.495 . . . . 3.5699999999999998 116.709 169.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -124.49 -175.13 3.18 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.674 1.737 . . . . 4.71 113.282 -176.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 63.35 33.84 13.59 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-O 123.552 1.644 . . . . 2.3300000000000001 113.686 169.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.409 ' H ' ' HD2' ' A' ' 48' ' ' LYS . 2.7 mptt -59.77 151.75 24.61 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 113.359 -1.746 . . . . 5.0999999999999996 110.429 166.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.404 ' OE1' ' HE2' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -44.31 -44.12 7.9 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.941 1.46 . . . . 4.3799999999999999 114.941 -165.93 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.0 t -63.73 -15.57 58.89 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 115.061 1.504 . . . . 2.96 115.061 -178.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 43.4 m -90.02 -7.8 53.08 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.371 0.987 . . . . 2.1299999999999999 113.091 172.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 45.2 mt -88.25 -35.75 8.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 117.745 -1.122 . . . . 1.5700000000000001 113.326 -166.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.87 -25.75 64.78 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.427 1.467 . . . . 2.6699999999999999 113.197 -176.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.55 -44.09 71.61 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.899 0.772 . . . . 3.3999999999999999 111.169 164.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 tp -62.54 -43.49 98.68 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 118.611 -0.709 . . . . 2.1099999999999999 109.922 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.5 tpt -53.93 -53.96 45.49 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 125.914 1.686 . . . . 1.49 110.791 170.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.83 -35.67 64.19 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.008 1.323 . . . . 4.2699999999999996 113.147 176.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 61.3 m -86.69 -33.3 20.09 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 126.15 1.78 . . . . 1.99 111.964 -173.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.555 HD11 ' HB2' ' A' ' 75' ' ' PHE . 1.8 mm? -69.57 -42.78 74.07 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 126.776 2.03 . . . . 2.5 112.015 169.45 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -74.72 63.09 1.11 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 123.384 1.564 . . . . 1.51 110.77 -176.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -69.84 -4.95 22.5 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.83 1.252 . . . . 5.5099999999999998 113.427 -164.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -110.5 -5.69 15.08 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.85 2.46 . . . . 2.4900000000000002 113.785 171.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 37.7 t 58.69 64.55 1.41 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.074 1.35 . . . . 2.73 112.797 172.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -115.07 -88.97 0.56 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.384 1.473 . . . . 2.8100000000000001 108.67 176.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -173.19 -26.32 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.746 2.419 . . . . 6.1799999999999997 114.724 -176.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -124.78 163.22 22.6 Favored 'General case' 0 C--O 1.243 0.729 0 CA-C-O 123.249 1.5 . . . . 3.1000000000000001 111.944 175.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.6 mm -104.95 100.08 9.8 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.882 2.473 . . . . 1.03 110.401 -178.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -66.16 163.13 18.31 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.538 0.735 . . . . 3.7999999999999998 111.636 167.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -47.13 -42.32 19.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.603 0.761 . . . . 2.1000000000000001 112.882 -178.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 -30.39 67.03 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 120.895 -1.128 . . . . 7.7400000000000002 112.649 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -68.3 -54.36 18.02 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 107.855 -1.165 . . . . 1.96 107.855 171.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -51.2 -37.34 46.13 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.864 2.066 . . . . 2.5499999999999998 114.401 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.0 p -66.17 -14.89 62.6 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 120.307 -1.496 . . . . 1.6399999999999999 114.647 173.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 44.7 t -71.82 -33.02 46.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 CA-C-N 120.441 1.473 . . . . 2.1400000000000001 111.212 171.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.555 ' HB2' HD11 ' A' ' 59' ' ' LEU . 19.4 t80 -56.32 -54.72 42.09 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.466 1.03 . . . . 1.74 110.637 172.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 67.0 mt -64.07 -30.49 71.56 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.165 0.986 . . . . 1.8700000000000001 111.864 -178.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 15.3 m -68.13 -50.98 51.22 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.284 0.947 . . . . 0.87 111.942 170.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 65.3 mtp -51.87 -48.01 64.23 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.182 0.901 . . . . 1.8600000000000001 111.088 177.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 99.6 mt -65.45 -48.68 71.88 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.086 0.955 . . . . 1.22 112.599 176.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 34.6 t -64.84 -33.04 75.06 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.352 0.978 . . . . 1.8400000000000001 113.213 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 88.7 mtp -63.39 -46.59 85.73 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 118.687 0.676 . . . . 1.76 110.813 168.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.94 -42.94 97.18 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.626 0.602 . . . . 1.1100000000000001 112.626 -178.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -65.39 -25.71 67.68 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.574 -0.704 . . . . 2.7200000000000002 112.346 178.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -69.56 -37.21 76.94 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.103 0.865 . . . . 3.2200000000000002 112.351 173.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -70.65 -47.46 59.88 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.979 1.312 . . . . 2.8100000000000001 110.703 172.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -52.41 -47.42 66.32 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 126.09 1.756 . . . . 2.8999999999999999 110.98 177.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -53.53 -33.1 53.32 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.504 1.522 . . . . 2.5600000000000001 113.045 177.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 24.7 mt -81.86 -20.73 38.31 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.99 0.916 . . . . 1.5800000000000001 112.506 -177.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -96.5 -7.85 33.61 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.641 1.348 . . . . 2.9399999999999999 114.641 172.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -108.43 -53.37 2.64 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.89 2.076 . . . . 3.71 112.686 -174.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -81.68 55.84 2.82 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 123.222 1.487 . . . . 3.8900000000000001 110.844 174.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt . . . . . 0 C--O 1.251 1.17 0 C-N-CA 127.92 2.488 . . . . 4.2699999999999996 114.807 167.97 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 18.5 ttt . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 108.221 -1.029 . . . . 11.380000000000001 108.221 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -149.13 -12.84 0.31 Allowed 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 116.065 1.876 . . . . 4.7699999999999996 116.065 -153.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . 0.4 ' HB ' ' HD2' ' B' ' 4' ' ' PRO . 1.2 p 66.51 -176.95 0.04 OUTLIER Pre-proline 0 N--CA 1.483 1.213 0 C-N-CA 125.314 1.446 . . . . 1.97 109.769 -173.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . 0.4 ' HD2' ' HB ' ' B' ' 3' ' ' THR . 92.1 Cg_endo -81.8 -15.04 9.73 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 121.759 1.639 . . . . 1.8200000000000001 113.139 166.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.26 -39.31 68.49 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.604 1.093 . . . . 2.48 111.967 -174.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -50.69 -55.46 16.42 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.604 0.762 . . . . 5.1200000000000001 110.522 167.496 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 43.4 mttm -67.54 -19.23 65.26 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.221 -0.924 . . . . 3.7799999999999998 112.365 -176.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.59 -43.17 39.83 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.018 1.327 . . . . 0.87 111.891 171.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 56.7 mt -61.47 -44.62 96.78 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.177 1.391 . . . . 1.51 111.69 169.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 88.2 m -58.26 -48.99 78.7 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.542 1.537 . . . . 1.27 110.445 171.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 23.2 m -54.92 -49.96 70.0 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 119.539 1.063 . . . . 1.3 110.897 175.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 14.9 mmm -50.68 -51.46 49.18 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.684 1.194 . . . . 2.8300000000000001 112.623 174.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 4.0 t -59.31 -40.7 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.848 0.859 . . . . 1.78 112.34 175.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 87.9 m -72.28 -44.12 63.25 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.766 1.627 . . . . 0.90000000000000002 111.753 -173.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 19.2 p -67.74 -44.88 76.53 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 108.913 -0.773 . . . . 1.76 108.913 172.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -63.57 -53.65 48.41 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 123.597 0.561 . . . . 2.3599999999999999 110.518 -173.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -66.19 -30.01 70.4 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 112.506 0.558 . . . . 2.5899999999999999 112.506 -178.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 19.4 ttmm -70.91 -47.06 61.22 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 120.868 -1.145 . . . . 4.0999999999999996 112.117 176.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -73.18 -32.95 65.14 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.351 -0.843 . . . . 2.21 112.486 176.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 53.1 p -68.44 -29.02 67.58 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-N 119.666 1.121 . . . . 1.6299999999999999 113.012 176.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.35 -5.91 84.59 Favored Glycine 0 C--N 1.342 0.88 0 C-N-CA 127.625 2.536 . . . . 1.5 114.756 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -64.48 -41.68 96.33 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.896 1.848 . . . . 3.2799999999999998 111.392 175.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -147.93 156.02 42.22 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 123.252 1.501 . . . . 3.48 114.799 -173.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.43 -126.79 43.21 Favored Glycine 0 C--N 1.34 0.765 0 C-N-CA 127.156 2.313 . . . . 1.8500000000000001 111.123 171.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 2.3 m -54.53 116.31 2.6 Favored 'General case' 0 C--O 1.249 1.035 0 CA-C-O 121.207 0.527 . . . . 4.0899999999999999 109.736 162.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -18.81 60.65 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.445 0.906 . . . . 6.4500000000000002 113.445 -176.061 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.476 ' H ' HD23 ' B' ' 27' ' ' LEU . 2.0 pt? -91.27 -13.71 32.2 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.622 1.569 . . . . 4.2599999999999998 113.58 177.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -127.86 162.27 27.09 Favored 'General case' 0 C--O 1.249 1.042 0 N-CA-C 114.226 1.195 . . . . 1.54 114.226 -178.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 91.8 mt -107.16 108.51 20.0 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.89 2.476 . . . . 1.72 111.592 -178.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 95.9 p -70.72 163.37 27.31 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 121.26 -0.9 . . . . 2.1899999999999999 113.211 164.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -42.28 -38.16 1.72 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 125.642 1.577 . . . . 6.3499999999999996 114.545 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.63 -28.0 25.06 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 116.438 2.014 . . . . 4.0999999999999996 116.438 176.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -67.53 -48.64 66.41 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 120.103 1.32 . . . . 1.6699999999999999 109.221 166.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 24.6 tp -58.07 -42.95 86.63 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.679 1.191 . . . . 1.8300000000000001 111.827 177.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -51.37 -40.79 59.91 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.915 0.886 . . . . 3.5699999999999998 111.885 177.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -64.33 -51.98 60.7 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.948 0.499 . . . . 2.9700000000000002 110.364 177.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 29.6 tp -57.65 -55.24 37.35 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 117.067 -1.444 . . . . 2.25 111.0 -178.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 30.7 mt -54.46 -51.44 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-N 120.201 1.364 . . . . 0.98999999999999999 110.469 178.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 44.1 tttm -65.89 -18.53 65.4 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.755 1.02 . . . . 4.4299999999999997 113.755 -176.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm -85.78 -59.75 2.22 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.752 1.621 . . . . 3.1600000000000001 110.609 168.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 72.3 tt0 -43.54 -62.52 1.06 Allowed 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 130.97 3.708 . . . . 5.1600000000000001 112.846 -177.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -82.22 -37.65 25.69 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.296 1.038 . . . . 3.4300000000000002 111.939 178.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 8.2 t 70.33 -44.44 0.57 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 127.691 2.396 . . . . 3.2400000000000002 114.998 175.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -63.31 -4.24 2.46 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 117.351 2.352 . . . . 3.2799999999999998 117.351 -167.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.48 16.55 77.71 Favored Glycine 0 N--CA 1.474 1.215 0 O-C-N 120.812 -1.18 . . . . 3.9300000000000002 115.105 173.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -46.05 -71.36 0.08 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 127.45 2.3 . . . . 7.9800000000000004 112.204 176.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.84 125.46 26.89 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.944 0.878 . . . . 2.7799999999999998 111.431 173.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -87.18 173.88 8.96 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.836 -0.54 . . . . 3.5 109.809 166.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.01 -37.5 74.41 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 115.062 1.504 . . . . 3.4700000000000002 115.062 -169.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 13.1 t -72.59 -11.15 60.53 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 114.148 1.166 . . . . 2.7400000000000002 114.148 172.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 1.7 m -94.17 -31.68 14.04 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.992 1.717 . . . . 2.8700000000000001 111.544 172.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 86.6 mt -65.99 -32.96 60.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.293 0.637 . . . . 1.76 110.718 170.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.0 -66.12 0.56 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.232 1.013 . . . . 3.0800000000000001 111.207 176.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.61 -24.64 62.78 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 113.885 1.068 . . . . 3.9199999999999999 113.885 -173.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.77 -52.96 63.46 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.52 0.728 . . . . 2.21 109.992 164.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -60.89 -49.47 77.34 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.377 1.071 . . . . 1.6499999999999999 111.922 -179.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 24.8 mtpt -57.16 -36.22 70.5 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.44 1.096 . . . . 5.1200000000000001 113.011 173.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 52.1 m -75.07 -30.64 61.02 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 120.956 -1.09 . . . . 2.6400000000000001 113.479 177.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 mp -65.34 -52.8 51.41 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 118.031 -0.985 . . . . 2.8799999999999999 110.504 167.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -73.93 74.91 1.66 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.322 2.249 . . . . 1.45 114.343 -169.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . 0.496 ' HZ3' HG11 ' B' ' 74' ' ' VAL . 14.8 mptt -53.96 -27.57 32.12 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 115.113 1.523 . . . . 3.4700000000000002 115.113 -176.542 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -88.25 -15.28 36.29 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.723 1.209 . . . . 1.8799999999999999 113.379 177.529 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 29.4 t 58.17 32.05 21.54 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.473 1.109 . . . . 2.1600000000000001 112.552 -176.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -84.47 -0.24 52.19 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.378 1.471 . . . . 2.3500000000000001 112.02 -175.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 82.3 -0.96 1.42 Allowed 'General case' 0 C--O 1.238 0.477 0 C-N-CA 130.36 3.464 . . . . 4.4800000000000004 113.204 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -126.38 135.21 51.16 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 123.045 1.403 . . . . 2.27 113.106 178.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 21.3 mm -74.58 100.0 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-N 115.016 -0.993 . . . . 1.49 109.232 170.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.35 158.31 31.91 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.293 1.037 . . . . 4.9900000000000002 109.846 169.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.57 -35.17 53.36 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 120.517 -1.364 . . . . 2.8599999999999999 113.496 175.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.451 ' HD3' ' H ' ' B' ' 70' ' ' LYS . 1.0 OUTLIER -67.18 -25.96 66.4 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.862 0.865 . . . . 5.2599999999999998 112.48 177.45 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -88.03 -40.74 13.6 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.246 1.418 . . . . 2.2799999999999998 110.35 174.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -54.78 -23.67 19.05 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 120.39 -1.444 . . . . 2.1000000000000001 113.059 173.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 36.1 t -65.8 -30.61 71.28 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.518 1.527 . . . . 2.3300000000000001 112.989 174.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.496 HG11 ' HZ3' ' B' ' 61' ' ' LYS . 0.9 OUTLIER -86.85 -28.57 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.714 0.805 . . . . 2.48 111.544 -176.974 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -58.93 -67.03 0.41 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.945 1.298 . . . . 1.6100000000000001 111.396 179.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -59.92 -36.77 77.71 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.452 1.101 . . . . 3.71 112.0 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 31.5 m -51.19 -54.35 26.33 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.664 0.786 . . . . 0.97999999999999998 110.492 173.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.4 mtm -58.68 -46.11 87.94 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 118.544 0.611 . . . . 1.5900000000000001 111.593 179.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.08 -45.54 94.32 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.147 0.579 . . . . 1.48 112.436 178.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.4 t -72.68 -29.41 63.38 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.328 -0.857 . . . . 2.0800000000000001 113.1 -178.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 91.5 mtp -69.9 -39.45 76.2 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 118.79 -0.624 . . . . 2.0499999999999998 110.948 170.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.65 -36.16 81.93 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.493 1.042 . . . . 0.85999999999999999 112.524 173.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -68.26 -35.43 77.89 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.083 1.142 . . . . 2.5699999999999998 114.083 170.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 17.1 t30 -64.72 -42.38 95.28 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.521 1.055 . . . . 1.74 112.607 171.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -73.43 -24.7 60.28 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.11 0.964 . . . . 4.0199999999999996 111.186 -177.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -55.98 26.53 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.492 1.517 . . . . 2.7400000000000002 112.104 160.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -57.46 -26.62 61.51 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.862 1.665 . . . . 2.3100000000000001 112.3 -179.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 55.0 mt -77.05 -7.89 56.48 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.728 1.381 . . . . 2.4399999999999999 114.728 174.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -94.78 -29.78 14.58 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 113.86 1.059 . . . . 4.4699999999999998 113.86 162.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -74.6 -46.91 35.49 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.956 1.302 . . . . 3.6099999999999999 112.464 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -136.77 41.36 2.52 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 127.723 2.409 . . . . 4.4500000000000002 110.874 -165.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 36.8 mttm . . . . . 0 C--O 1.253 1.239 0 C-N-CA 130.386 3.475 . . . . 8.5500000000000007 117.047 -175.607 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 109.585 -0.524 . . . . 8.5199999999999996 109.585 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -92.23 -80.04 0.37 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.148 0.499 . . . . 3.4199999999999999 111.421 -144.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 67.3 p -110.49 165.2 13.14 Favored Pre-proline 0 N--CA 1.472 0.645 0 C-N-CA 126.474 1.909 . . . . 1.4299999999999999 110.652 -168.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -69.62 -23.09 31.81 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 121.118 1.212 . . . . 1.4199999999999999 112.26 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.34 -40.39 44.28 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.7 1.137 . . . . 2.7000000000000002 113.63 173.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -64.75 -34.44 78.33 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.114 1.325 . . . . 4.0599999999999996 110.625 172.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 59.1 mttt -68.21 -29.02 67.76 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 120.051 -1.656 . . . . 4.5199999999999996 112.255 170.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.13 -50.79 29.76 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.273 1.029 . . . . 1.1000000000000001 111.204 174.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.2 mt -55.9 -43.56 77.41 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.745 1.218 . . . . 1.6899999999999999 111.87 174.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 85.4 m -53.49 -54.71 33.16 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.342 1.057 . . . . 1.77 111.366 168.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.3 m -58.55 -37.24 75.28 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.489 1.115 . . . . 1.3100000000000001 111.924 -179.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 60.0 mtp -61.91 -52.54 63.67 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.032 0.933 . . . . 3.25 111.113 174.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 19.2 m -67.77 -28.25 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 CA-C-N 119.803 1.183 . . . . 2.27 113.299 177.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 57.2 m -58.64 -55.85 29.73 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.891 1.276 . . . . 0.91000000000000003 110.851 174.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -74.53 -34.45 63.01 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 119.304 -0.379 . . . . 2.54 110.275 -176.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.426 ' CZ ' HD23 ' A' ' 29' ' ' LEU . 21.2 t80 -61.66 -51.59 67.8 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 118.397 -0.811 . . . . 1.8200000000000001 110.999 176.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -66.29 -39.25 89.25 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 120.307 1.412 . . . . 2.5899999999999999 112.23 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -53.71 52.65 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.756 1.222 . . . . 4.9299999999999997 113.097 176.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -74.13 -32.2 63.07 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.358 -0.839 . . . . 2.46 112.091 176.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.5 t -58.79 -38.6 78.91 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 120.429 1.468 . . . . 2.1699999999999999 114.145 178.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.55 -6.17 83.74 Favored Glycine 0 CA--C 1.528 0.85 0 CA-C-O 117.958 -1.468 . . . . 1.96 115.184 -171.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -69.0 -41.56 77.63 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.239 1.519 . . . . 6.79 112.616 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -149.98 143.49 25.24 Favored 'General case' 0 C--O 1.247 0.93 0 C-N-CA 124.217 1.007 . . . . 4.6100000000000003 110.551 -154.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.39 -131.8 34.4 Favored Glycine 0 C--N 1.337 0.592 0 CA-C-N 114.522 -1.217 . . . . 1.99 110.973 -178.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.9 m -65.4 155.02 36.72 Favored 'General case' 0 C--O 1.247 0.973 0 C-N-CA 123.896 0.878 . . . . 2.79 112.995 170.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -112.86 10.73 19.1 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 115.037 1.495 . . . . 4.6100000000000003 115.037 170.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.8 mp -93.11 -1.66 56.22 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.339 1.056 . . . . 4.3799999999999999 111.485 167.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -159.7 148.29 17.56 Favored 'General case' 0 C--O 1.247 0.972 0 C-N-CA 126.841 2.056 . . . . 1.8 110.915 -157.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.426 HD23 ' CZ ' ' A' ' 16' ' ' PHE . 3.1 mm? -96.21 103.14 15.02 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 113.859 -1.518 . . . . 2.79 108.354 175.109 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.3 p -70.95 155.93 40.23 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.854 -1.066 . . . . 2.7599999999999998 110.348 171.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.1 ttm-85 -40.56 -50.9 2.98 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.665 1.186 . . . . 3.8399999999999999 113.897 -169.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -74.16 -30.33 62.21 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 115.39 1.626 . . . . 5.96 115.39 -175.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -58.12 -44.93 88.02 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.165 0.586 . . . . 1.96 111.227 166.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.73 -46.48 65.81 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.246 1.018 . . . . 2.9900000000000002 110.854 -175.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.1 ttmt -60.31 -44.29 95.56 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.43 -1.419 . . . . 4.1100000000000003 112.702 177.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.12 -43.2 87.09 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 114.026 1.121 . . . . 5.1799999999999997 114.026 168.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.9 tp -62.01 -54.01 47.57 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.4 1.08 . . . . 2.1899999999999999 111.149 179.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.7 mt -56.51 -44.52 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 CA-C-N 118.893 0.77 . . . . 0.90000000000000002 109.962 175.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -67.96 -18.98 64.91 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 114.149 1.166 . . . . 3.9300000000000002 114.149 -176.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -91.81 -40.48 11.19 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.57 1.548 . . . . 3.0699999999999998 112.498 -179.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -81.29 -26.38 35.77 Favored 'General case' 0 CA--C 1.552 1.041 0 O-C-N 124.413 1.071 . . . . 4.6600000000000001 111.815 176.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.0 mt -133.62 131.74 39.96 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 123.277 1.513 . . . . 2.71 113.442 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 4.3 t -149.15 7.51 0.71 Allowed 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.508 1.67 . . . . 4.4800000000000004 115.508 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -87.43 170.35 11.45 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.327 1.051 . . . . 3.3799999999999999 111.556 170.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.55 -131.08 26.44 Favored Glycine 0 N--CA 1.472 1.079 0 N-CA-C 109.977 -1.249 . . . . 3.73 109.977 -172.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -119.89 86.28 2.53 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.666 0.746 . . . . 7.29 109.137 148.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.0 tpt -74.65 78.47 2.02 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 120.51 -1.369 . . . . 2.1400000000000001 109.287 169.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.9 tttm -89.44 151.37 22.05 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.799 1.407 . . . . 6.0899999999999999 114.799 -157.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.3 -40.31 81.64 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.589 0.959 . . . . 4.5199999999999996 113.589 174.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.7 t -83.84 -41.76 17.15 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.134 0.974 . . . . 2.77 113.458 174.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.9 m -61.92 -24.82 67.21 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.492 1.117 . . . . 2.8799999999999999 112.442 177.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 65.8 mt -69.51 -28.13 36.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 124.265 1.026 . . . . 1.29 113.111 167.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.92 -30.19 68.61 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.958 1.708 . . . . 2.7799999999999998 112.123 -176.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -79.68 -35.77 38.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.747 0.819 . . . . 3.1699999999999999 112.401 168.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.9 tp -59.63 -32.42 70.42 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.559 -0.713 . . . . 2.02 111.236 170.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 6.0 tpt -55.16 -46.78 75.75 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.292 1.437 . . . . 1.8700000000000001 111.517 173.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -65.87 -29.28 69.71 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.799 1.24 . . . . 3.1899999999999999 112.524 171.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.9 t -75.35 -31.29 60.49 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.041 0.936 . . . . 2.1400000000000001 112.794 177.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.0 mp -71.38 -55.55 7.75 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.39 1.076 . . . . 2.7999999999999998 111.348 167.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -70.78 148.5 47.84 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 113.07 0.767 . . . . 2.1200000000000001 113.07 -168.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm -125.44 7.54 7.69 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.758 1.223 . . . . 3.3700000000000001 113.0 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -122.17 -21.19 5.98 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.587 1.155 . . . . 2.5699999999999998 112.995 176.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 7.8 t 74.35 20.89 2.49 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.408 2.283 . . . . 2.2200000000000002 112.584 -171.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 p30 -83.4 -23.75 32.24 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.928 2.091 . . . . 1.97 112.287 -163.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 73.59 19.23 3.35 Favored 'General case' 0 CA--C 1.548 0.874 1 C-N-CA 132.1 4.16 . . . . 3.8399999999999999 113.736 -172.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -121.85 122.57 39.74 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 128.719 2.808 . . . . 3.71 109.211 169.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 18.2 mm -91.47 107.75 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 O-C-N 120.652 -1.28 . . . . 1.1100000000000001 110.441 175.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 59.1 t0 -74.85 151.81 38.98 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 127.07 2.148 . . . . 2.7599999999999998 109.66 164.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -46.33 -43.61 16.11 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 115.299 1.592 . . . . 2.25 115.299 -177.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.458 ' H ' ' HD2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -69.98 -21.59 63.22 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 113.831 1.048 . . . . 3.0299999999999998 113.831 178.673 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -74.03 -53.36 10.19 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.718 1.207 . . . . 1.6699999999999999 108.634 165.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -52.9 -30.04 31.89 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 120.304 -1.497 . . . . 2.23 114.401 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 33.1 t -40.76 -45.1 2.36 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.125 1.77 . . . . 3.21 113.284 165.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.3 m -75.05 -27.99 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 CA-C-N 118.925 0.784 . . . . 2.3399999999999999 112.419 -172.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -59.25 -58.23 9.53 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 118.724 0.693 . . . . 1.79 110.499 168.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 38.3 mt -65.42 -29.61 70.33 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.517 0.727 . . . . 1.5600000000000001 111.902 -177.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.0 m -65.91 -46.64 77.53 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.331 1.052 . . . . 0.94999999999999996 111.196 174.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 59.0 mtm -61.45 -47.79 84.09 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.668 1.122 . . . . 1.5600000000000001 112.116 177.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 96.7 mt -62.21 -44.85 95.65 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.737 0.815 . . . . 1.29 112.002 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 16.3 t -66.49 -35.2 79.68 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 113.012 0.745 . . . . 1.78 113.012 175.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.1 -41.3 96.41 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.009 0.744 . . . . 3.1400000000000001 113.009 174.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.54 -38.1 86.41 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 118.53 -0.748 . . . . 1.26 111.468 174.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -63.05 -28.17 69.91 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 120.011 1.278 . . . . 2.73 114.059 176.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -60.55 -52.04 66.85 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.869 1.213 . . . . 2.1699999999999999 110.919 170.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -73.11 -30.42 63.62 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.063 1.345 . . . . 3.3900000000000001 112.107 -175.136 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.77 -54.03 51.1 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.7 1.6 . . . . 3.3599999999999999 110.132 168.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -55.76 -38.12 69.43 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.29 1.436 . . . . 2.54 112.489 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 85.5 mt -70.66 -16.07 62.78 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.879 1.066 . . . . 1.8600000000000001 113.879 177.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -109.89 2.52 19.88 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.156 1.782 . . . . 3.25 113.621 175.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -118.36 -55.25 2.24 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 126.539 1.936 . . . . 2.9900000000000002 112.311 -174.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -82.49 37.52 0.52 Allowed 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.531 1.533 . . . . 4.0099999999999998 112.422 175.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.9 ptmt . . . . . 0 C--O 1.249 1.042 0 C-N-CA 128.43 2.692 . . . . 4.4199999999999999 115.898 -172.679 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 34.4 mmt . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 107.705 -1.22 . . . . 6.4100000000000001 107.705 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -105.01 -51.85 2.96 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 125.132 1.52 . . . . 5.1799999999999997 112.398 -148.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . 0.5 HG23 ' H ' ' B' ' 6' ' ' GLU . 3.9 t -173.53 154.79 2.52 Favored Pre-proline 0 N--CA 1.472 0.631 0 C-N-CA 124.912 1.285 . . . . 2.73 110.727 -166.042 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -65.77 -24.52 54.38 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 122.079 1.853 . . . . 1.49 113.065 164.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 14.0 tp -65.69 -63.48 1.08 Allowed 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 121.135 1.788 . . . . 2.7200000000000002 111.451 -176.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . 0.5 ' H ' HG23 ' B' ' 3' ' ' THR . 14.2 tp10 -57.99 -37.85 75.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.234 1.016 . . . . 5.3200000000000003 110.646 178.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . 0.445 ' HA ' ' HE2' ' B' ' 7' ' ' LYS . 0.2 OUTLIER -63.92 -31.53 72.75 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 120.361 -1.462 . . . . 5.21 112.997 174.994 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -79.38 -27.74 41.9 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.58 1.152 . . . . 1.22 112.862 178.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 56.8 mt -60.31 -32.55 71.33 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 120.864 -1.148 . . . . 1.8600000000000001 111.799 168.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.7 m -60.35 -40.57 91.2 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.074 -1.016 . . . . 1.78 111.722 167.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 5.9 m -57.74 -38.82 76.01 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.175 0.898 . . . . 1.45 111.261 177.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 13.7 ttm -59.53 -37.42 78.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.447 0.906 . . . . 3.1099999999999999 113.447 173.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -75.06 -27.26 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 CA-C-N 119.911 1.232 . . . . 2.3399999999999999 112.092 172.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 85.5 m -71.94 -46.75 56.41 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.708 1.603 . . . . 0.84999999999999998 110.24 -171.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 38.1 p -69.9 -39.12 76.42 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 123.538 0.735 . . . . 1.76 109.68 170.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -62.37 -53.63 52.14 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-O 118.455 -0.783 . . . . 2.29 111.966 -175.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -19.44 62.62 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 120.269 1.395 . . . . 2.98 112.328 -178.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -72.63 -49.36 32.43 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.698 -1.251 . . . . 4.5 112.519 168.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -74.54 -39.6 62.24 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.688 -1.258 . . . . 2.2799999999999998 112.886 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 18.2 m -55.96 -42.0 75.58 Favored 'General case' 0 C--O 1.245 0.831 0 C-N-CA 124.299 1.04 . . . . 1.76 112.337 166.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.94 -9.03 86.86 Favored Glycine 0 C--N 1.343 0.928 0 C-N-CA 127.237 2.351 . . . . 1.3400000000000001 113.999 -176.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -56.75 -67.52 0.3 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.184 1.794 . . . . 3.7799999999999998 109.373 174.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -138.01 168.61 19.36 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 124.167 0.987 . . . . 3.5699999999999998 113.025 -168.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.2 -132.18 48.84 Favored Glycine 0 C--N 1.341 0.839 0 C-N-CA 125.785 1.66 . . . . 2.0899999999999999 111.816 176.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -50.51 121.78 6.21 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.176 0.991 . . . . 3.96 110.227 158.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -85.17 -16.22 41.12 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 120.657 -1.277 . . . . 7.9000000000000004 114.411 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 60.8 tp -72.72 -36.62 67.83 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.504 1.121 . . . . 2.7400000000000002 112.226 168.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 3.2 p -119.23 166.5 12.91 Favored 'General case' 0 C--O 1.252 1.236 0 C-N-CA 126.283 1.833 . . . . 1.29 114.553 -172.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.81 129.46 47.04 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 113.663 -1.608 . . . . 2.25 113.83 176.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.64 175.51 5.47 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.712 1.605 . . . . 2.2599999999999998 110.698 175.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . 0.486 HH11 ' HG2' ' B' ' 31' ' ' ARG . 14.9 ttt-85 -44.77 -33.04 1.74 Allowed 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 116.738 2.125 . . . . 5.4500000000000002 116.738 -170.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -79.99 -36.49 35.92 Favored 'General case' 0 CA--C 1.549 0.931 0 O-C-N 120.337 -1.477 . . . . 4.0099999999999998 114.076 176.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -70.27 -48.2 57.85 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 108.831 -0.803 . . . . 1.8400000000000001 108.831 173.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.43 HD11 ' CG1' ' B' ' 67' ' ' ILE . 15.7 mt -52.09 -45.88 65.0 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.714 1.605 . . . . 3.1499999999999999 113.498 175.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -52.77 -41.95 64.54 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.373 0.533 . . . . 3.0 111.518 178.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -71.91 -38.75 69.86 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.498 0.925 . . . . 3.2400000000000002 113.498 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 7.2 tt -57.13 -59.6 4.85 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.473 0.709 . . . . 1.9199999999999999 109.876 173.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 41.8 mt -54.84 -54.57 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.957 0.903 . . . . 1.03 109.974 -172.077 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -72.61 -22.64 60.93 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 118.507 -1.277 . . . . 6.4000000000000004 114.135 -171.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -83.31 -34.89 25.61 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 117.457 -1.258 . . . . 4.4000000000000004 113.531 173.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 80.7 mt-10 -72.43 -58.12 3.64 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.736 1.153 . . . . 3.7400000000000002 111.143 172.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mp -91.97 91.47 7.87 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.72 -0.844 . . . . 3.4399999999999999 108.72 175.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 89.0 m -55.75 -37.61 68.74 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 121.599 -0.688 . . . . 3.46 112.526 174.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.46 -156.93 0.29 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 127.492 2.317 . . . . 3.6400000000000001 114.354 -171.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.11 162.07 33.57 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.186 1.85 . . . . 3.8199999999999998 113.547 177.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -79.47 43.81 0.57 Allowed 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 122.498 1.142 . . . . 6.2000000000000002 109.995 165.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 4.2 tpt -80.49 65.55 5.68 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.519 1.527 . . . . 2.04 112.533 -157.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -71.16 164.79 24.93 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.089 1.755 . . . . 3.8500000000000001 111.646 175.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -45.15 -53.53 7.97 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.789 1.636 . . . . 4.7599999999999998 112.581 175.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -66.32 -29.3 69.47 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.2 -0.938 . . . . 2.6499999999999999 113.104 -178.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 24.4 t -76.66 -18.06 58.78 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 118.089 -0.958 . . . . 2.5600000000000001 112.201 175.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 81.2 mt -86.39 -36.5 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 126.451 1.9 . . . . 1.3799999999999999 109.834 173.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -59.01 -58.4 8.82 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.704 2.002 . . . . 4.1399999999999997 111.248 168.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -67.63 -26.42 66.23 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.305 0.957 . . . . 2.9199999999999999 113.58 176.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.19 -56.59 19.66 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.209 0.913 . . . . 2.5299999999999998 110.282 165.278 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -69.26 -29.57 67.5 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 117.75 -1.119 . . . . 2.23 112.108 -172.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 18.5 mtpt -64.48 -36.64 84.84 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 120.397 1.453 . . . . 3.7400000000000002 113.076 164.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 22.7 t -69.18 -31.76 70.6 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.868 -1.145 . . . . 2.8599999999999999 112.599 175.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . 0.462 ' HB3' HD12 ' B' ' 67' ' ' ILE . 10.4 mp -69.93 -55.62 9.19 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 120.666 -1.271 . . . . 2.75 110.79 167.061 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -79.21 61.59 3.36 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 129.029 2.932 . . . . 1.3600000000000001 113.079 -173.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 22.8 mttp -54.85 -18.75 5.25 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 115.117 1.525 . . . . 3.25 115.117 -172.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -105.79 -3.57 21.86 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.003 1.721 . . . . 2.3700000000000001 115.106 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 15.0 t 68.79 25.36 6.3 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 114.678 1.362 . . . . 2.0800000000000001 114.678 177.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 13.6 p30 -78.27 -14.31 59.48 Favored 'General case' 0 CA--C 1.552 1.022 0 O-C-N 120.682 -1.261 . . . . 2.2999999999999998 112.001 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 75.79 -6.13 2.04 Favored 'General case' 0 CA--C 1.543 0.705 1 C-N-CA 133.243 4.617 . . . . 4.6500000000000004 115.052 177.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -97.43 152.86 18.53 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 127.347 2.259 . . . . 2.73 109.304 169.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.462 HD12 ' HB3' ' B' ' 59' ' ' LEU . 29.6 mm -115.22 97.07 5.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-O 122.322 1.058 . . . . 1.8899999999999999 109.816 171.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.92 153.4 43.63 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.297 1.839 . . . . 2.8300000000000001 110.771 159.433 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.97 -33.91 39.97 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.298 1.222 . . . . 2.4900000000000002 114.298 -174.312 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -25.83 61.77 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.778 -1.202 . . . . 3.6099999999999999 112.09 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -78.87 -47.58 16.26 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.892 1.277 . . . . 1.6799999999999999 109.342 169.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -52.92 -48.53 67.21 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 127.61 2.364 . . . . 2.8999999999999999 114.228 -174.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 97.2 p -61.17 -25.64 67.16 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.236 -0.915 . . . . 1.71 113.149 -172.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 37.3 t -65.56 -21.74 29.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 123.784 0.834 . . . . 2.4300000000000002 111.964 178.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -57.48 -58.44 8.28 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.487 1.115 . . . . 2.7000000000000002 111.595 168.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . 0.4 HD22 ' H ' ' B' ' 76' ' ' LEU . 2.9 mm? -61.62 -40.6 95.41 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.788 0.835 . . . . 3.3599999999999999 111.037 179.054 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 52.3 m -53.39 -52.55 58.96 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 118.191 -0.909 . . . . 1.52 112.358 172.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 74.6 mtm -57.74 -49.94 74.9 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 119.808 1.186 . . . . 1.8300000000000001 112.452 177.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 84.5 mt -62.49 -37.93 87.88 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.724 0.41 . . . . 1.5 111.598 -179.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 8.5 t -69.22 -31.64 70.36 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.02 0.928 . . . . 1.96 112.921 175.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 67.3 mtp -61.46 -46.43 90.09 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 119.029 0.831 . . . . 1.9199999999999999 110.73 167.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.31 -45.63 90.42 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 118.728 0.695 . . . . 0.73999999999999999 112.836 177.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -59.12 -27.03 65.23 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.651 -0.656 . . . . 2.4199999999999999 112.759 176.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -72.86 -35.55 67.21 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.337 1.426 . . . . 2.0 112.685 176.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.79 -39.89 72.89 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.81 0.844 . . . . 2.8399999999999999 110.261 175.127 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.56 -50.87 68.9 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.167 1.387 . . . . 2.0299999999999998 110.812 170.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -58.04 -29.85 65.69 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.175 1.39 . . . . 2.3700000000000001 113.123 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 24.8 mt -73.65 -24.44 60.0 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.324 1.05 . . . . 2.0699999999999998 113.547 177.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -97.74 -32.48 11.72 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 114.388 1.255 . . . . 4.1699999999999999 114.388 175.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -74.33 -27.42 60.69 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.365 1.466 . . . . 4.2800000000000002 113.568 -170.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -88.13 -1.85 58.25 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.898 0.879 . . . . 4.8799999999999999 112.853 176.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.042 0 C-N-CA 126.277 1.831 . . . . 6.1100000000000003 114.25 -159.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.6 mtt . . . . . 0 N--CA 1.479 1.017 0 CA-C-O 117.67 -1.157 . . . . 6.54 110.073 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.4 mp0 56.4 -141.1 0.83 Allowed 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.279 1.832 . . . . 3.2200000000000002 109.145 177.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.4 p -118.27 163.99 22.41 Favored Pre-proline 0 C--O 1.238 0.481 0 C-N-CA 125.059 1.344 . . . . 2.21 108.954 172.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -64.38 -12.75 34.59 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 121.985 1.79 . . . . 1.8799999999999999 113.516 175.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.8 tt -79.7 -35.09 39.53 Favored 'General case' 0 C--N 1.347 0.492 0 CA-C-N 120.238 1.381 . . . . 3.1899999999999999 112.512 170.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -52.69 52.68 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.339 1.427 . . . . 3.8599999999999999 108.7 167.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.521 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -57.5 -26.14 60.86 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 113.096 0.776 . . . . 4.2000000000000002 113.096 -179.137 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.64 -53.62 44.68 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-O 118.335 -0.841 . . . . 1.29 111.844 168.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 47.5 mt -54.45 -48.36 71.82 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 120.041 1.292 . . . . 1.71 111.597 177.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.7 p -67.52 -36.31 80.79 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 117.636 -1.174 . . . . 2.8500000000000001 113.289 177.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -69.42 -29.12 66.77 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 121.149 1.795 . . . . 2.1299999999999999 112.078 170.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.96 -55.97 18.58 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.378 1.071 . . . . 3.77 110.815 -178.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.7 m -62.56 -25.13 37.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 113.021 0.749 . . . . 2.2799999999999998 113.021 177.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.1 m -70.17 -49.22 52.63 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.697 1.599 . . . . 1.3899999999999999 112.512 175.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -48.13 81.22 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.054 0.843 . . . . 2.25 109.68 167.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -62.85 -50.96 68.9 Favored 'General case' 0 N--CA 1.465 0.319 0 O-C-N 124.222 0.951 . . . . 2.5299999999999998 111.1 -166.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 24.0 m170 -68.21 -34.81 76.95 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 118.394 -0.812 . . . . 2.79 112.42 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -70.81 -43.02 69.49 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 120.056 1.298 . . . . 4.4800000000000004 113.315 177.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -70.53 -23.16 62.58 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.312 0.96 . . . . 2.0800000000000001 112.045 170.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.0 p -69.88 -36.67 75.66 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.326 -1.484 . . . . 2.7000000000000002 111.181 169.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.47 -15.37 75.17 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 125.871 1.7 . . . . 1.6000000000000001 113.516 175.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -64.11 92.94 0.08 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 106.999 -1.482 . . . . 4.6699999999999999 106.999 157.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 60.63 178.08 0.1 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.764 2.026 . . . . 6.7800000000000002 115.635 169.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.36 -140.3 44.79 Favored Glycine 0 C--N 1.343 0.938 0 C-N-CA 126.294 1.902 . . . . 2.21 112.522 166.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.5 t -54.14 132.38 42.92 Favored 'General case' 0 C--O 1.241 0.613 0 O-C-N 121.817 -0.813 . . . . 2.7200000000000002 110.343 156.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.5 ptmm? -86.31 16.79 4.14 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.063 0.945 . . . . 4.0999999999999996 113.546 171.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.2 mt -128.85 -39.6 1.59 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.561 1.144 . . . . 4.3099999999999996 111.475 178.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 12.5 p -101.0 162.33 12.96 Favored 'General case' 0 C--O 1.248 0.995 0 C-N-CA 124.996 1.318 . . . . 1.3700000000000001 111.508 174.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 92.6 mt -90.48 98.17 11.62 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 112.304 -2.225 . . . . 1.72 109.127 172.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.2 t -63.0 166.15 6.11 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 121.59 0.709 . . . . 1.8300000000000001 112.242 170.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.65 -40.61 1.99 Allowed 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 127.008 2.123 . . . . 3.6400000000000001 115.419 -175.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -79.71 -36.87 36.82 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.06 1.133 . . . . 6.3899999999999997 114.06 176.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -66.09 -47.72 73.29 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.533 1.533 . . . . 1.54 109.615 -175.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 38.1 tp -53.93 -50.41 66.48 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.569 1.148 . . . . 1.8400000000000001 111.049 175.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -57.46 -44.74 85.04 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 112.958 0.725 . . . . 3.46 112.958 176.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -58.31 -38.8 77.81 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 119.264 0.938 . . . . 3.77 112.488 174.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.7 -57.84 5.08 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.482 1.113 . . . . 2.6600000000000001 110.734 177.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.6 mt -58.27 -49.37 82.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 118.517 0.599 . . . . 0.79000000000000004 110.107 -175.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.62 -8.18 53.99 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 120.818 -1.176 . . . . 4.6699999999999999 111.874 -173.181 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -95.42 -39.03 10.21 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.998 1.319 . . . . 3.3599999999999999 113.455 166.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -72.72 -64.94 0.86 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.761 1.225 . . . . 4.5300000000000002 109.637 177.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -82.33 72.99 9.39 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 123.177 1.465 . . . . 2.3300000000000001 107.399 165.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.9 t -65.58 7.56 0.23 Allowed 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 114.877 1.436 . . . . 2.9900000000000002 114.877 178.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -49.71 157.19 0.59 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 129.452 3.101 . . . . 4.4299999999999997 114.322 -177.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -83.1 -19.64 62.43 Favored Glycine 0 N--CA 1.474 1.222 0 C-N-CA 124.313 0.959 . . . . 3.5499999999999998 112.165 168.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -69.47 -29.45 67.12 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 128.806 2.842 . . . . 5.5 111.34 170.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.7 85.35 2.72 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.578 1.551 . . . . 2.2799999999999998 110.943 173.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.6 mmtp -111.53 170.71 7.94 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.728 2.411 . . . . 4.21 110.081 176.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -57.01 -42.11 79.73 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.637 -0.664 . . . . 4.3600000000000003 112.477 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -70.92 -4.2 23.31 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.824 1.416 . . . . 3.3500000000000001 114.824 173.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.4 m -101.56 -39.07 7.67 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.586 1.154 . . . . 2.1299999999999999 110.715 172.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 34.8 mm -71.3 -36.24 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 125.213 1.405 . . . . 2.04 112.242 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -66.55 -33.92 76.76 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.82 1.044 . . . . 4.04 113.82 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -83.57 -34.2 25.24 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 113.201 0.815 . . . . 2.8799999999999999 113.201 176.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.9 tt -54.51 -50.96 66.6 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.816 0.846 . . . . 2.23 109.313 169.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.2 ttt -60.34 -40.42 90.62 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.254 1.022 . . . . 1.4399999999999999 113.009 172.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.2 ttmm -58.74 -35.25 72.41 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.206 1.002 . . . . 4.4000000000000004 112.553 176.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 68.1 m -80.44 -23.2 40.45 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.529 1.931 . . . . 1.8600000000000001 113.442 177.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.2 mt -73.66 -54.03 9.05 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.018 -1.051 . . . . 1.8600000000000001 113.5 176.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -88.03 143.96 26.79 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.562 1.074 . . . . 1.9299999999999999 113.843 -167.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -115.83 7.08 14.45 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 125.252 1.421 . . . . 2.8500000000000001 113.424 -177.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -118.8 -23.44 6.99 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.95 1.3 . . . . 2.8700000000000001 114.224 -170.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 54.3 m 58.77 39.55 24.05 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.448 2.299 . . . . 2.8799999999999999 112.577 -157.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.6 p30 -87.73 -26.02 23.14 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.018 1.327 . . . . 2.75 112.93 -173.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 75.35 4.4 4.09 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 130.693 3.597 . . . . 3.73 114.346 -170.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -116.38 121.6 42.4 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.386 2.274 . . . . 2.7400000000000002 109.599 -179.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 29.0 mm -78.83 106.4 9.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 115.36 -0.836 . . . . 1.02 109.431 177.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -58.67 147.99 30.81 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.037 1.335 . . . . 4.0999999999999996 109.468 169.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -57.29 -35.39 69.74 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 120.062 -1.649 . . . . 2.8900000000000001 111.726 173.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -50.38 -44.15 54.76 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.989 1.716 . . . . 3.9100000000000001 113.142 167.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -79.41 -40.96 28.78 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.284 1.834 . . . . 1.7 111.275 -177.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -58.16 -28.21 64.53 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.558 1.143 . . . . 2.0099999999999998 112.625 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 53.2 p -53.34 -33.23 52.72 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 121.025 -1.047 . . . . 2.8799999999999999 113.676 168.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.4 t -67.16 -41.63 87.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.298 1.039 . . . . 1.8999999999999999 109.725 -178.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -55.51 -57.15 13.12 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.648 0.779 . . . . 2.2599999999999998 111.202 171.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.31 -33.91 73.05 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 113.06 0.763 . . . . 1.5700000000000001 113.06 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 63.7 m -70.32 -44.38 68.37 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.554 0.742 . . . . 0.68999999999999995 111.481 -179.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 79.5 mtm -55.56 -41.01 72.67 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.482 0.583 . . . . 1.3300000000000001 111.556 172.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.5 mt -73.23 -41.49 63.66 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.777 0.831 . . . . 1.29 113.177 -179.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 3.5 p -67.75 -31.84 72.03 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 119.29 0.95 . . . . 3.1200000000000001 112.643 175.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 70.8 mtp -71.57 -37.73 71.03 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.791 -0.568 . . . . 1.6799999999999999 111.919 170.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.88 -36.6 83.87 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.461 1.028 . . . . 0.76000000000000001 113.213 176.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -66.76 -18.1 65.2 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.254 -0.904 . . . . 2.3999999999999999 113.347 170.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.474 HD22 HG13 ' B' ' 13' ' ' VAL . 5.0 t-20 -74.57 -39.85 62.0 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 119.938 1.245 . . . . 2.1800000000000002 112.915 174.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -58.53 -48.98 79.05 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.115 0.966 . . . . 4.3300000000000001 110.103 171.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.82 -46.09 64.19 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.468 1.507 . . . . 2.1000000000000001 112.876 174.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -67.09 -22.92 65.8 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.994 1.318 . . . . 2.4199999999999999 112.943 -179.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.1 mt -86.45 -24.99 25.45 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.425 1.09 . . . . 1.6299999999999999 112.232 172.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -89.23 -20.8 23.71 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 115.479 1.659 . . . . 2.7599999999999998 115.479 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -79.58 -34.97 40.38 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.55 1.14 . . . . 2.9199999999999999 112.39 167.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -91.55 60.21 4.0 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 123.397 1.57 . . . . 2.5499999999999998 112.163 -169.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 50.4 mmtt . . . . . 0 C--O 1.251 1.172 0 C-N-CA 128.286 2.634 . . . . 3.6499999999999999 114.661 172.608 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.443 ' SD ' ' HE2' ' B' ' 7' ' ' LYS . 67.9 mtm . . . . . 0 N--CA 1.476 0.861 0 N-CA-C 108.233 -1.025 . . . . 6.4100000000000001 108.233 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -92.45 -17.86 23.99 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.71 1.204 . . . . 4.5599999999999996 113.639 -148.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 2.6 t -174.47 150.34 1.45 Allowed Pre-proline 0 N--CA 1.47 0.557 0 C-N-CA 127.58 2.352 . . . . 3.1499999999999999 108.022 -172.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -60.39 -11.51 16.83 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.186 1.924 . . . . 1.8 113.677 175.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.21 -33.19 59.26 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 119.356 0.98 . . . . 2.7599999999999998 112.574 171.02 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -58.97 -46.28 88.47 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 121.144 -0.973 . . . . 4.8399999999999999 109.484 167.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . 0.443 ' HE2' ' SD ' ' B' ' 1' ' ' MET . 8.5 mmtm -65.43 -29.95 70.69 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.134 1.161 . . . . 4.3300000000000001 114.134 175.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.46 -43.99 79.73 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.661 0.784 . . . . 1.0 111.795 170.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 48.8 mt -62.7 -41.63 99.22 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.014 0.926 . . . . 1.6399999999999999 112.057 174.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -55.7 24.34 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 118.814 0.734 . . . . 1.26 109.845 167.313 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 42.0 m -54.91 -38.8 68.08 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.202 1.801 . . . . 1.29 112.623 -174.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 88.4 mtp -53.37 -43.49 67.84 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.973 0.806 . . . . 3.0099999999999998 111.602 175.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.474 HG13 HD22 ' A' ' 84' ' ' ASN . 19.5 t -71.36 -34.81 55.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.824 1.249 . . . . 2.2799999999999998 111.47 176.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.9 m -62.3 -47.37 84.61 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 121.123 -0.986 . . . . 1.05 112.387 174.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 p -62.55 -28.53 69.93 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.404 1.082 . . . . 2.0699999999999998 112.065 170.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -63.56 -59.53 4.5 Favored 'General case' 0 C--O 1.225 -0.202 0 O-C-N 124.001 0.813 . . . . 2.4100000000000001 109.63 -178.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -74.67 -27.96 60.64 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 117.426 -1.273 . . . . 2.9399999999999999 114.139 -177.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 24.8 mtpt -41.05 -47.75 3.16 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.773 1.229 . . . . 6.6399999999999997 112.322 167.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -108.09 -36.64 6.27 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.786 1.234 . . . . 2.0600000000000001 113.06 -175.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 29.2 t -58.47 -26.57 63.52 Favored 'General case' 0 C--O 1.246 0.874 0 O-C-N 120.824 -1.173 . . . . 1.9099999999999999 112.95 173.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.7 -7.25 87.3 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 127.61 2.529 . . . . 1.76 115.402 175.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 11.7 mmp_? -57.92 -73.33 0.07 Allowed 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 120.118 1.959 . . . . 4.3700000000000001 110.362 168.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -127.06 161.92 27.27 Favored 'General case' 0 C--O 1.246 0.909 0 C-N-CA 126.546 1.938 . . . . 3.7799999999999998 110.65 -156.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.06 -136.26 48.44 Favored Glycine 0 C--N 1.338 0.686 0 C-N-CA 125.709 1.623 . . . . 2.1699999999999999 110.978 174.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 46.1 t -63.09 141.21 58.85 Favored 'General case' 0 C--O 1.248 1.011 0 CA-C-O 123.207 1.48 . . . . 3.8799999999999999 110.828 162.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 55.4 mttm -85.86 1.29 50.41 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.902 1.281 . . . . 8.1099999999999994 112.695 173.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 76.3 mt -88.96 -33.85 17.08 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.662 1.585 . . . . 4.8700000000000001 112.083 164.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 65.5 p -109.2 152.05 25.68 Favored 'General case' 0 C--O 1.249 1.032 0 C-N-CA 125.292 1.437 . . . . 1.73 112.686 -176.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.7 pp -105.47 112.88 26.14 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 114.932 -1.031 . . . . 1.95 111.492 170.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 2.3 p -77.74 171.01 15.6 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.853 1.261 . . . . 2.0099999999999998 112.229 170.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 -41.19 -32.69 0.29 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 117.026 2.232 . . . . 3.77 117.026 174.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.65 -41.78 15.99 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 120.161 -1.587 . . . . 4.7199999999999998 112.196 179.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -57.85 -38.4 75.62 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.561 1.544 . . . . 1.9099999999999999 109.821 169.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 tt -68.47 -50.66 50.78 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.019 1.728 . . . . 3.0299999999999998 113.129 176.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 7.6 ptpt -71.19 -15.57 62.48 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 120.085 1.311 . . . . 3.02 114.27 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -72.99 -56.46 5.1 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.925 0.89 . . . . 3.8999999999999999 110.974 163.108 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.1 tt -52.21 -58.99 4.94 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 126.197 1.799 . . . . 2.1200000000000001 112.598 -175.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 33.1 mt -56.55 -50.06 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 N-CA-C 109.084 -0.71 . . . . 0.88 109.084 -172.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -71.24 -13.24 61.84 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 124.047 0.939 . . . . 3.96 113.482 -171.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -99.59 -33.28 10.7 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 114.195 1.183 . . . . 4.0599999999999996 114.195 174.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -79.95 -50.04 11.0 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.011 0.823 . . . . 4.8600000000000003 110.29 173.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 39.6 mt -81.07 64.31 5.76 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 122.955 1.359 . . . . 2.4500000000000002 109.606 160.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 8.2 p -65.64 37.19 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.034 2.534 . . . . 3.8799999999999999 112.772 164.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 98.5 mt -121.41 172.38 8.09 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 126.689 1.996 . . . . 4.2999999999999998 111.178 -171.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -75.39 22.44 1.67 Allowed Glycine 0 CA--C 1.535 1.312 0 CA-C-O 117.738 -1.59 . . . . 3.5299999999999998 114.666 176.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.19 -128.65 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 126.005 1.722 . . . . 9.4299999999999997 112.181 -171.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 14.3 ptp -62.85 146.07 53.57 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.813 1.642 . . . . 3.3700000000000001 114.494 -172.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -121.59 161.21 22.82 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.547 1.139 . . . . 4.3200000000000003 109.364 -173.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -66.79 -12.83 60.36 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 117.783 2.512 . . . . 3.2799999999999998 117.783 -155.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 12.9 t -72.75 -12.16 60.9 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 120.617 1.553 . . . . 2.6099999999999999 114.199 167.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 7.7 m -103.73 -16.21 15.51 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.055 1.342 . . . . 2.4300000000000002 112.534 175.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 10.7 mm -64.53 -34.28 68.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.793 1.237 . . . . 1.6299999999999999 111.757 177.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.25 -18.97 57.21 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.195 0.998 . . . . 2.9100000000000001 112.646 176.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -80.47 -42.63 22.23 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.272 -0.893 . . . . 3.0299999999999998 110.802 166.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -57.25 -46.9 82.59 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.931 1.293 . . . . 2.71 109.967 175.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 6.9 tpt -48.31 -57.73 5.59 Favored 'General case' 0 C--O 1.217 -0.648 0 C-N-CA 125.782 1.633 . . . . 1.75 111.134 167.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.04 -25.44 67.83 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.25 1.42 . . . . 4.2000000000000002 114.017 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 15.1 m -82.11 -39.6 23.12 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.44 1.896 . . . . 1.9199999999999999 111.764 -178.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 12.4 mt -57.33 -59.06 5.69 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.116 1.366 . . . . 2.8599999999999999 111.044 158.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -80.77 47.92 1.02 Allowed 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 127.574 2.349 . . . . 1.7 112.103 -173.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -51.57 -24.42 5.34 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.31 1.844 . . . . 5.3799999999999999 112.954 170.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 52.5 p30 -88.74 -6.88 57.13 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 115.616 1.709 . . . . 2.0800000000000001 115.616 172.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 19.1 m 69.42 25.22 5.53 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.258 1.823 . . . . 2.8799999999999999 115.417 163.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 p30 -100.71 -2.87 31.39 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.818 1.647 . . . . 2.48 113.048 -177.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 63.99 -7.64 0.2 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 131.154 3.782 . . . . 4.25 115.989 -174.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -92.83 145.78 24.13 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 123.706 0.802 . . . . 3.6200000000000001 108.965 174.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 42.6 mm -117.63 113.14 41.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 125.313 1.445 . . . . 1.54 108.875 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.28 173.23 9.31 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.615 1.166 . . . . 2.73 110.571 161.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -54.39 -38.4 66.12 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.933 1.086 . . . . 2.9199999999999999 113.933 175.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 18.1 mtpp -71.47 -25.2 62.18 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.492 0.717 . . . . 4.5 112.447 -177.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -75.66 -53.45 8.54 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.073 0.949 . . . . 1.6799999999999999 110.188 161.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -51.58 -37.49 50.05 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.498 1.919 . . . . 2.3300000000000001 114.874 -173.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 4.8 m -59.44 -26.49 65.24 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 117.791 -1.1 . . . . 2.2400000000000002 113.848 173.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 68.0 t -62.46 -47.12 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 CA-C-N 120.679 1.581 . . . . 1.6399999999999999 110.277 178.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -57.89 -50.75 72.27 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.488 1.115 . . . . 1.6299999999999999 112.219 172.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 82.9 mt -67.85 -29.0 68.03 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 118.693 -0.67 . . . . 1.73 112.31 -176.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 31.5 m -65.16 -50.75 64.77 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.219 1.008 . . . . 0.82999999999999996 110.538 167.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 72.8 mtp -55.78 -41.61 74.32 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.207 1.003 . . . . 1.9399999999999999 113.197 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 39.8 mt -69.16 -50.56 46.56 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 118.531 0.605 . . . . 1.54 112.094 174.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -65.84 -26.7 67.78 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 121.513 -0.742 . . . . 1.6899999999999999 111.984 -177.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 60.7 mmm -63.19 -44.49 95.22 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.554 1.142 . . . . 2.27 112.553 165.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.1 -36.92 80.99 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.863 1.21 . . . . 0.90000000000000002 112.455 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -69.96 -23.31 63.16 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.966 1.099 . . . . 2.25 113.966 171.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -63.26 -48.59 77.55 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.463 1.029 . . . . 2.4300000000000002 111.452 175.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -63.27 -43.71 97.17 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.764 1.225 . . . . 3.1400000000000001 112.214 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -54.36 -50.93 66.33 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.363 1.465 . . . . 2.79 111.649 176.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -63.76 -27.44 69.2 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.121 0.968 . . . . 2.5 111.882 -176.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 82.3 mt -81.17 -14.27 57.77 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 117.749 -1.12 . . . . 1.8300000000000001 112.834 177.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -92.96 -21.45 19.78 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.405 1.261 . . . . 4.3499999999999996 114.405 166.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -73.99 -36.5 64.52 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.372 1.469 . . . . 3.9900000000000002 112.816 175.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -99.25 47.06 0.97 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.745 1.218 . . . . 2.7799999999999998 112.655 -167.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt . . . . . 0 C--O 1.249 1.052 0 C-N-CA 127.752 2.421 . . . . 4.9900000000000002 114.797 -174.864 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.548 ' HA ' ' OE2' ' A' ' 6' ' ' GLU . 3.7 mmt . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 117.492 -1.242 . . . . 11.73 109.476 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -145.64 -101.41 0.1 Allowed 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 113.884 1.068 . . . . 6.3499999999999996 113.884 -139.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.445 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 9.9 p -107.19 178.19 1.14 Allowed Pre-proline 0 N--CA 1.48 1.069 0 C-N-CA 127.169 2.187 . . . . 1.5900000000000001 113.059 -159.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.445 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 56.7 Cg_endo -72.34 -24.9 19.03 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 122.201 1.934 . . . . 1.6499999999999999 113.986 170.196 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.2 tt -75.12 -41.37 58.61 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 119.645 1.112 . . . . 2.9100000000000001 111.173 173.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.548 ' OE2' ' HA ' ' A' ' 1' ' ' MET . 1.6 tm-20 -59.29 -43.8 92.55 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.654 0.782 . . . . 4.4100000000000001 110.772 173.667 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.3 mttp -68.34 -32.86 73.27 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.453 -1.404 . . . . 3.3199999999999998 113.224 173.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.538 ' HB1' ' HB1' ' B' ' 8' ' ' ALA . . . -60.96 -50.25 74.17 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.81 0.732 . . . . 1.04 112.016 174.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.5 mt -69.75 -33.49 72.5 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.179 0.9 . . . . 2.3599999999999999 111.873 178.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 88.7 m -57.84 -45.34 86.37 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 118.055 -0.974 . . . . 1.5600000000000001 111.111 169.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.4 m -58.16 -40.08 80.5 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.742 1.156 . . . . 1.3300000000000001 111.648 175.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 16.3 mtp -62.67 -52.37 63.59 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 118.65 0.659 . . . . 3.3999999999999999 110.779 174.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.0 t -58.0 -37.24 60.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 121.217 -0.927 . . . . 2.21 112.725 176.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.4 m -67.15 -57.0 7.58 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.587 1.555 . . . . 1.26 110.73 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.4 p -58.79 -41.08 85.86 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.329 0.651 . . . . 1.9199999999999999 109.976 176.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.43 -65.61 0.66 Allowed 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 118.687 -0.673 . . . . 2.2000000000000002 109.241 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -58.07 -36.21 72.48 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 120.078 1.308 . . . . 2.7200000000000002 112.446 -177.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -63.37 -56.11 19.02 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 120.52 -1.363 . . . . 4.9400000000000004 113.348 174.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -70.95 -31.24 67.75 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.188 0.995 . . . . 2.9500000000000002 111.459 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.412 ' HA ' ' OE1' ' A' ' 33' ' ' GLU . 13.0 t -58.23 -37.64 75.26 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 124.908 1.283 . . . . 2.02 111.017 169.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.98 6.88 11.01 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 127.906 2.67 . . . . 1.8 116.379 175.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -94.48 123.25 37.78 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 105.332 -2.099 . . . . 5.1900000000000004 105.332 150.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 60.77 169.42 0.09 Allowed 'General case' 0 CA--C 1.559 1.303 0 N-CA-C 116.069 1.877 . . . . 5.7199999999999998 116.069 161.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.25 -106.33 1.56 Allowed Glycine 0 N--CA 1.472 1.078 0 N-CA-C 108.39 -1.884 . . . . 2.5699999999999998 108.39 -175.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.7 m -129.63 -179.85 5.41 Favored 'General case' 0 C--O 1.24 0.592 0 O-C-N 121.741 -0.858 . . . . 3.48 111.946 141.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.2 ttmm -66.87 -9.62 39.72 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 127.973 2.509 . . . . 4.4199999999999999 113.326 174.142 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.9 mt -84.5 -43.62 14.39 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.698 1.599 . . . . 3.7599999999999998 111.302 170.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.7 p -101.51 134.6 44.37 Favored 'General case' 0 C--O 1.243 0.712 0 C-N-CA 125.862 1.665 . . . . 1.55 112.241 -168.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 68.4 mt -88.02 96.04 10.36 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.354 1.462 . . . . 1.6200000000000001 108.848 162.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.429 ' H ' ' CD ' ' A' ' 33' ' ' GLU . 2.4 m -66.87 157.62 32.66 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.227 -0.921 . . . . 2.6099999999999999 112.133 171.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 45.5 ttt-85 -50.63 -9.88 0.06 Allowed 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 128.115 2.566 . . . . 3.3300000000000001 117.527 -177.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.43 -44.0 7.04 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 119.895 -1.753 . . . . 4.8399999999999999 113.259 167.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.429 ' CD ' ' H ' ' A' ' 30' ' ' SER . 17.2 mt-10 -54.42 -45.95 73.1 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.084 1.354 . . . . 1.5600000000000001 109.711 170.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.3 tp -67.28 -40.41 86.13 Favored 'General case' 0 C--N 1.344 0.368 0 C-N-CA 123.203 0.601 . . . . 2.2000000000000002 112.307 -179.505 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -59.51 -44.54 93.09 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.88 0.764 . . . . 3.27 111.658 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.511 ' HG2' ' HE2' ' A' ' 40' ' ' LYS . 53.3 tt0 -63.92 -52.19 60.98 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-O 119.035 -0.507 . . . . 3.8999999999999999 112.096 173.329 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -61.69 -47.39 85.53 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.843 1.257 . . . . 2.8599999999999999 112.647 -174.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 48.0 mt -49.77 -47.39 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 119.378 0.99 . . . . 1.25 109.291 170.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.3 tptt -74.08 -12.7 60.68 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 112.995 0.739 . . . . 5.5 112.995 -173.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.511 ' HE2' ' HG2' ' A' ' 36' ' ' GLU . 68.1 mmtt -79.69 -40.32 29.26 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.894 1.224 . . . . 2.7799999999999998 112.573 163.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -67.06 -71.76 0.19 Allowed 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 108.973 -0.751 . . . . 4.71 108.973 175.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.5 mt -76.45 65.5 2.33 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.956 1.302 . . . . 3.0499999999999998 111.824 172.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 14.9 t -79.63 -27.02 40.98 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.885 1.674 . . . . 3.5299999999999998 112.942 174.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -54.7 1.63 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 130.159 3.384 . . . . 4.5599999999999996 120.086 -161.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 104.8 -23.49 30.96 Favored Glycine 0 N--CA 1.473 1.118 0 C-N-CA 125.861 1.696 . . . . 3.7999999999999998 113.465 -175.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -80.87 171.36 15.11 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 117.475 0.637 . . . . 5.0899999999999999 112.19 160.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 31.1 tpp 72.6 106.3 0.07 Allowed 'General case' 0 C--O 1.235 0.328 0 C-N-CA 129.165 2.986 . . . . 2.5499999999999998 112.49 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -131.1 157.3 43.48 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.429 1.892 . . . . 5.5099999999999998 111.129 -174.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -26.46 -74.88 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 128.34 2.656 . . . . 4.6699999999999999 114.921 -168.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.1 m -65.14 -17.0 64.11 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.543 1.312 . . . . 2.71 114.543 -169.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -76.17 -15.69 60.01 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.246 -0.909 . . . . 2.6299999999999999 112.919 173.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 81.0 mt -75.11 -30.15 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.1 0.96 . . . . 1.55 110.482 -178.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.2 -22.09 36.12 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.543 0.942 . . . . 2.6299999999999999 113.543 -179.643 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -68.75 -44.13 74.39 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 121.188 -0.945 . . . . 3.2400000000000002 109.886 157.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 17.1 tp -62.57 -39.03 92.36 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 117.684 -1.15 . . . . 1.78 110.958 -176.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.6 mmm -51.95 -56.79 12.01 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 126.022 1.729 . . . . 1.8200000000000001 112.113 167.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.4 tmmm? -58.91 -31.34 68.54 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.567 1.547 . . . . 3.2599999999999998 112.874 177.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 20.6 m -88.72 -26.86 21.56 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.82 1.648 . . . . 1.8999999999999999 112.775 -175.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.6 mp -66.52 -44.0 83.71 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.099 0.863 . . . . 3.2599999999999998 110.76 160.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -58.69 147.07 34.24 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 123.134 1.445 . . . . 2.5699999999999998 113.617 174.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.38 15.24 13.87 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.852 1.261 . . . . 2.9199999999999999 111.876 161.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 27.7 p-10 -137.85 -48.63 0.56 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.099 1.759 . . . . 3.3199999999999998 112.851 -177.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 2.9 t 95.62 104.18 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 129.163 2.985 . . . . 2.8900000000000001 108.383 -173.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.8 p30 -145.64 -139.31 0.1 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.736 1.215 . . . . 4.1799999999999997 109.349 -178.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -141.38 24.56 2.09 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.085 0.954 . . . . 4.2999999999999998 111.068 164.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -144.89 136.78 25.73 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 126.026 1.73 . . . . 3.2999999999999998 112.683 -173.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 39.8 mm -120.94 124.31 72.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 125.515 1.526 . . . . 1.0900000000000001 110.274 -173.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.4 -176.23 3.33 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.967 1.707 . . . . 2.9700000000000002 111.794 168.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -57.44 -37.5 72.92 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 116.326 1.973 . . . . 3.2999999999999998 116.326 175.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 43.5 mtmt -74.58 -31.95 62.22 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.835 0.854 . . . . 3.6600000000000001 111.964 -178.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.407 ' O ' HG12 ' A' ' 74' ' ' VAL . 77.4 mt-10 -69.76 -65.04 0.77 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.63 0.772 . . . . 2.2200000000000002 109.337 162.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -47.34 -36.45 9.49 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.996 2.119 . . . . 2.29 115.224 -174.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.5 m -70.0 -19.38 63.33 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 120.314 -1.491 . . . . 2.1699999999999999 111.97 -177.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.407 HG12 ' O ' ' A' ' 71' ' ' GLU . 0.8 OUTLIER -74.05 -22.29 18.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 O-C-N 121.292 -0.88 . . . . 2.0499999999999998 112.696 173.845 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -65.28 -66.5 0.54 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.449 1.5 . . . . 2.6600000000000001 110.477 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.418 ' H ' HD23 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -53.75 -33.2 55.01 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.316 1.446 . . . . 2.3700000000000001 112.523 170.101 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.6 m -59.57 -44.72 93.2 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.854 1.206 . . . . 0.94999999999999996 112.139 173.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 51.4 mtp -60.23 -42.94 96.28 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.933 0.788 . . . . 1.8700000000000001 111.234 178.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 44.0 mt -66.57 -50.04 64.41 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.332 1.053 . . . . 1.22 110.87 178.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 3.2 t -64.31 -27.26 68.91 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.269 1.428 . . . . 1.4099999999999999 113.051 -177.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 71.8 mtm -72.63 -39.39 67.25 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.051 1.13 . . . . 3.6699999999999999 114.051 165.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.6 -44.37 82.29 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.612 1.096 . . . . 1.3999999999999999 112.036 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -60.9 -24.75 66.22 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.669 0.618 . . . . 2.3100000000000001 112.669 173.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -65.93 -51.98 53.83 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 118.978 0.808 . . . . 2.4199999999999999 112.083 175.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -58.8 -51.05 71.63 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.207 1.803 . . . . 2.9199999999999999 111.581 174.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -50.93 -47.14 61.02 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.62 1.568 . . . . 2.8199999999999998 111.439 178.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -64.41 -33.76 76.62 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.913 0.885 . . . . 2.5600000000000001 112.852 -178.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.3 mt -74.61 -18.39 60.57 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.819 0.848 . . . . 2.1200000000000001 112.745 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -96.96 -13.91 22.05 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.742 1.386 . . . . 4.8499999999999996 114.742 172.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -93.37 -52.1 4.68 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.343 1.457 . . . . 3.1499999999999999 112.668 179.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -83.46 43.88 0.92 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.066 1.346 . . . . 2.52 112.113 179.068 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.6 mmtm . . . . . 0 C--O 1.251 1.145 0 CA-C-O 114.737 -2.554 . . . . 4.8799999999999999 115.08 171.721 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 108.97 -0.752 . . . . 5.2599999999999998 108.97 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -115.06 -171.5 1.96 Allowed 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 130.907 3.683 . . . . 4.9500000000000002 109.644 -179.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 74.1 p -94.16 164.88 18.96 Favored Pre-proline 0 N--CA 1.47 0.552 0 C-N-CA 124.689 1.195 . . . . 1.8899999999999999 110.225 165.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -64.72 -6.62 12.74 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 123.04 2.493 . . . . 1.3899999999999999 114.692 175.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 10.6 mp -76.91 -55.52 5.4 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.907 1.231 . . . . 3.5699999999999998 111.165 174.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -59.62 -29.85 68.29 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-O 122.297 1.046 . . . . 4.3099999999999996 111.82 170.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.74 -37.15 65.17 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 119.411 -2.055 . . . . 4.7999999999999998 113.869 170.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.538 ' HB1' ' HB1' ' A' ' 8' ' ' ALA . . . -62.02 -45.46 93.47 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.507 1.123 . . . . 0.97999999999999998 112.467 170.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 58.8 mt -58.45 -44.64 89.31 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 124.758 1.223 . . . . 1.55 111.425 173.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 64.7 m -53.48 -56.17 19.2 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 118.272 -0.871 . . . . 1.47 110.711 169.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 94.9 m -58.86 -37.1 75.73 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.144 1.378 . . . . 1.6100000000000001 111.811 -178.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.2 mmm -59.06 -51.81 68.45 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.304 1.042 . . . . 3.23 112.674 171.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 85.6 t -68.79 -31.67 51.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 121.126 -0.984 . . . . 1.8899999999999999 111.909 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 31.8 m -59.02 -59.86 4.8 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.131 1.373 . . . . 1.1899999999999999 110.178 175.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.7 -31.48 71.47 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 124.743 1.217 . . . . 2.7799999999999998 110.046 -174.093 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -63.06 -46.73 86.13 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.892 0.701 . . . . 1.8600000000000001 112.892 174.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -61.99 -39.32 91.82 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.996 -1.065 . . . . 2.3500000000000001 112.408 175.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.475 ' HE2' ' CZ ' ' B' ' 19' ' ' TYR . 4.9 tttt -53.65 -33.44 55.24 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 125.501 1.52 . . . . 5.4900000000000002 113.468 171.341 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.475 ' CZ ' ' HE2' ' B' ' 18' ' ' LYS . 67.1 m-85 -96.02 -37.25 10.72 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 115.614 1.709 . . . . 2.1499999999999999 115.614 176.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 62.8 m -66.66 -22.69 66.09 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 116.661 2.097 . . . . 1.9099999999999999 116.661 -172.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.02 -17.18 63.56 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-O 118.43 -1.206 . . . . 2.0600000000000001 113.982 179.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 28.7 ttt-85 -58.07 -26.99 63.23 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.408 2.283 . . . . 3.79 114.107 -175.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -151.33 144.41 24.62 Favored 'General case' 0 C--O 1.243 0.76 0 C-N-CA 128.617 2.767 . . . . 3.79 108.382 178.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.18 -12.76 0.58 Allowed Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.318 1.437 . . . . 2.2200000000000002 114.766 -172.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 63.72 -159.66 0.3 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.56 1.944 . . . . 5.8300000000000001 110.747 -161.173 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 31.5 mmtm 73.62 -176.28 0.16 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.306 2.242 . . . . 8.8000000000000007 113.193 163.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -72.82 -9.3 58.51 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.79 1.236 . . . . 2.8100000000000001 113.521 168.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . 0.435 ' HB ' ' HB3' ' B' ' 66' ' ' GLU . 5.9 p -90.43 135.21 33.83 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.974 1.309 . . . . 1.3400000000000001 110.954 -171.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -114.93 108.42 16.69 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.42 1.888 . . . . 2.0499999999999998 110.691 -159.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.487 ' HA ' ' HA ' ' B' ' 66' ' ' GLU . 0.9 OUTLIER -76.17 162.29 28.1 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 119.394 -2.066 . . . . 2.6400000000000001 115.364 -171.278 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -44.23 -38.28 3.71 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.728 0.811 . . . . 3.6499999999999999 112.176 169.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.66 -41.51 26.76 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.773 -1.204 . . . . 4.6799999999999997 114.055 177.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -58.31 -40.16 81.3 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.139 0.575 . . . . 1.76 109.978 173.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 18.3 tp -65.68 -41.86 91.93 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.818 1.247 . . . . 2.0099999999999998 112.669 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 20.7 mtpt -49.73 -53.06 27.08 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 120.305 1.411 . . . . 3.4399999999999999 111.483 176.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -67.14 -41.61 85.79 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 117.959 -1.02 . . . . 3.1200000000000001 113.305 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 6.6 tt -54.87 -54.21 45.41 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.618 1.099 . . . . 1.9399999999999999 110.471 175.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 29.1 mt -57.88 -48.57 83.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 118.186 -0.911 . . . . 1.3200000000000001 109.856 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -75.65 -8.12 56.01 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 115.205 1.557 . . . . 5.0700000000000003 115.205 -172.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -108.29 -45.24 3.95 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.162 1.385 . . . . 3.6499999999999999 112.353 174.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -80.23 -19.83 46.01 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.122 0.569 . . . . 5.5099999999999998 111.357 -178.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mp -128.66 174.14 9.68 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.351 1.861 . . . . 3.71 108.77 156.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 27.0 p -150.91 4.17 0.47 Allowed 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 116.755 2.132 . . . . 3.1400000000000001 116.755 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.422 ' H ' HD12 ' B' ' 44' ' ' LEU . 4.5 mp -43.16 -32.34 0.72 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 117.405 2.372 . . . . 3.0699999999999998 117.405 -168.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.64 -26.98 2.6 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 124.82 1.2 . . . . 2.9300000000000002 113.515 -178.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -61.03 -25.82 67.18 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.471 1.135 . . . . 5.7599999999999998 113.007 167.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.92 72.97 0.18 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 122.839 1.304 . . . . 2.7400000000000002 110.622 147.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.1 mppt? -66.13 159.23 26.64 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.05 -0.977 . . . . 4.9199999999999999 108.742 166.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -52.2 -37.66 55.55 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 113.359 0.874 . . . . 4.96 113.359 -177.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 35.2 t -62.37 -16.7 56.18 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 115.021 1.489 . . . . 4.1100000000000003 115.021 174.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 3.3 t -106.33 -3.38 21.22 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.419 1.488 . . . . 3.0800000000000001 112.264 173.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 19.6 mm -80.2 -44.0 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 O-C-N 120.025 -1.672 . . . . 1.8799999999999999 110.839 175.088 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -70.98 -42.58 69.48 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.55 0.574 . . . . 3.3700000000000001 112.55 -178.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.95 -35.08 69.48 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 120.43 -1.419 . . . . 2.4300000000000002 112.483 -177.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -54.42 -47.88 72.28 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.324 1.049 . . . . 2.5299999999999998 110.285 164.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.49 -44.33 89.35 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.849 1.26 . . . . 1.7 112.378 177.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -69.6 -27.22 64.91 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 120.832 -1.167 . . . . 4.1299999999999999 113.597 176.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 23.0 t -71.71 -36.13 70.44 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 121.125 -0.984 . . . . 2.8599999999999999 111.523 170.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 8.7 mp -62.78 -50.33 71.47 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-O 118.352 -0.833 . . . . 2.71 112.102 168.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -87.57 82.4 7.46 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 122.086 0.946 . . . . 1.6699999999999999 113.293 -169.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -21.65 58.74 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.121 1.156 . . . . 3.8100000000000001 114.121 -177.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -84.69 -22.89 29.62 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.28 0.945 . . . . 2.3700000000000001 112.101 175.599 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 32.2 t 58.5 38.92 25.44 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.576 1.151 . . . . 2.21 112.138 -167.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -88.54 -119.24 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.478 1.511 . . . . 3.04 107.152 176.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -148.6 -3.82 0.46 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 117.447 2.388 . . . . 4.5499999999999998 117.447 166.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . 0.487 ' HA ' ' HA ' ' B' ' 30' ' ' SER . 16.8 mt-10 -118.5 146.69 44.33 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 123.175 1.464 . . . . 3.25 112.702 166.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.432 HG22 ' HB2' ' B' ' 72' ' ' TYR . 79.1 mt -103.07 115.62 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 126.958 2.103 . . . . 1.77 109.405 -175.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.74 161.73 25.57 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.808 2.043 . . . . 2.6299999999999999 111.2 169.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.2 -31.93 67.79 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 119.982 -1.699 . . . . 2.4300000000000002 114.749 -174.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.9 mtmp? -83.11 -16.98 44.7 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.222 1.409 . . . . 3.5099999999999998 113.151 177.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -70.66 -61.85 1.61 Allowed 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 107.389 -1.338 . . . . 1.99 107.389 156.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . 0.432 ' HB2' HG22 ' B' ' 67' ' ' ILE . 32.0 t80 -58.45 -29.86 66.49 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 127.975 2.51 . . . . 2.48 117.3 -171.117 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 60.2 p -58.29 -24.01 58.15 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 120.777 1.626 . . . . 2.3399999999999999 113.745 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.9 p -67.56 -22.82 28.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 O-C-N 121.529 -0.732 . . . . 2.0099999999999998 112.578 174.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -63.73 -51.15 66.21 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.233 1.013 . . . . 3.0800000000000001 110.397 174.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 39.5 mt -60.74 -44.56 96.52 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 124.183 0.993 . . . . 2.1000000000000001 110.39 176.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 43.4 m -54.69 -54.35 42.94 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.743 0.817 . . . . 1.03 111.423 176.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 48.5 mtm -60.32 -45.15 94.43 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.403 0.681 . . . . 1.78 112.124 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 82.4 mt -63.17 -43.71 97.5 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 118.467 0.576 . . . . 2.04 112.354 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 93.3 m -67.76 -33.82 75.6 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 122.742 0.417 . . . . 1.6899999999999999 112.073 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 64.5 mtp -68.56 -38.76 81.04 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 118.777 0.717 . . . . 2.04 112.847 172.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.23 -38.19 66.13 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.482 1.037 . . . . 0.89000000000000001 112.351 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -68.31 -25.66 65.24 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.403 1.001 . . . . 2.04 113.362 177.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 17.7 t30 -59.54 -46.09 89.89 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.358 0.981 . . . . 2.27 111.499 169.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.89 -34.69 44.55 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.307 1.443 . . . . 3.1400000000000001 111.973 -175.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -53.32 -54.49 35.77 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.331 1.452 . . . . 2.9500000000000002 110.019 166.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -54.11 -36.28 63.05 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.895 1.278 . . . . 2.7400000000000002 112.757 177.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 55.1 mt -74.16 -19.16 60.65 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.916 1.08 . . . . 2.1800000000000002 113.916 178.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -101.83 -14.94 17.07 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.567 1.321 . . . . 3.5699999999999998 114.567 171.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -96.47 -48.45 5.56 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.312 1.845 . . . . 4.7599999999999998 112.548 -176.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -87.83 46.75 1.41 Allowed 'General case' 0 CA--C 1.548 0.866 0 CA-C-O 122.903 1.335 . . . . 4.2699999999999996 111.316 173.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm . . . . . 0 C--O 1.25 1.107 0 CA-C-O 114.903 -2.475 . . . . 5.5700000000000003 114.894 168.874 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.6 tpt . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 107.244 -1.391 . . . . 6.9299999999999997 107.244 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -110.88 -64.87 1.22 Allowed 'General case' 0 C--N 1.327 -0.38 0 O-C-N 124.505 1.128 . . . . 3.8300000000000001 108.648 -153.554 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.407 HG21 ' O ' ' B' ' 41' ' ' GLU . 7.9 t 174.13 150.76 0.25 Allowed Pre-proline 0 C--O 1.236 0.386 0 C-N-CA 127.331 2.253 . . . . 2.3999999999999999 107.612 -163.498 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -73.51 -24.25 16.38 Favored 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 121.925 1.75 . . . . 1.6399999999999999 112.437 175.564 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -69.54 -43.05 73.79 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.141 -0.933 . . . . 3.48 112.584 -171.557 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -53.08 -34.52 56.96 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 122.137 0.97 . . . . 4.2400000000000002 112.563 171.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 46.9 mttt -80.68 -25.52 38.16 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.67 -1.269 . . . . 4.2000000000000002 111.455 -179.037 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.47 -42.23 62.16 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.027 0.931 . . . . 1.05 111.198 169.461 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 83.7 mt -64.3 -43.02 96.04 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.185 0.994 . . . . 1.4099999999999999 111.224 171.741 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 87.2 m -55.35 -42.84 74.41 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.136 -0.977 . . . . 1.53 111.664 167.912 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.5 m -61.63 -38.34 87.3 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 119.763 1.165 . . . . 1.3700000000000001 111.387 178.73 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 33.1 ttm -56.34 -53.88 52.06 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 118.473 0.579 . . . . 3.0 111.388 169.924 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 93.2 t -62.39 -37.07 77.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-N 118.798 0.727 . . . . 1.8999999999999999 112.498 178.685 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 76.0 m -57.43 -59.17 5.55 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.907 1.283 . . . . 0.79000000000000004 110.408 177.315 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.21 -34.28 70.7 Favored 'General case' 0 CA--C 1.521 -0.167 0 C-N-CA 123.789 0.836 . . . . 2.5800000000000001 110.599 -170.109 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -57.59 -40.35 78.84 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.344 0.658 . . . . 2.2999999999999998 110.976 174.612 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 36.6 m170 -78.81 -28.17 44.45 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.931 1.086 . . . . 2.5299999999999998 113.931 176.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.1 mtmp? -60.27 -55.72 30.33 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.366 1.439 . . . . 4.6200000000000001 111.438 166.553 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -71.24 -32.28 68.57 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.516 -0.74 . . . . 2.1299999999999999 111.96 -177.485 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.0 t -73.04 -6.43 45.49 Favored 'General case' 0 C--O 1.247 0.948 0 N-CA-C 116.465 2.024 . . . . 2.4300000000000002 116.465 -178.389 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.7 -12.62 74.34 Favored Glycine 0 CA--C 1.539 1.551 0 CA-C-O 119.061 -0.855 . . . . 2.2400000000000002 113.02 166.338 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -60.98 -31.35 70.94 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.507 1.523 . . . . 6.7999999999999998 113.652 -177.315 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 173.13 -149.95 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 129.662 3.185 . . . . 4.2199999999999998 111.706 164.337 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.04 -149.44 21.8 Favored Glycine 0 N--CA 1.476 1.352 0 O-C-N 120.351 -1.468 . . . . 2.2200000000000002 111.973 -175.229 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.7 m -78.48 -177.49 5.31 Favored 'General case' 0 CA--C 1.55 0.975 0 O-C-N 121.007 -1.29 . . . . 2.2799999999999998 112.072 158.351 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.48 ' HZ2' ' C ' ' B' ' 92' ' ' LYS . 38.1 ttmt -84.54 -32.99 23.58 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.191 1.397 . . . . 4.4299999999999997 111.726 169.579 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.424 ' H ' HD23 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -82.07 6.84 14.99 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.923 1.689 . . . . 3.1800000000000002 114.711 178.022 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 24.1 p -146.95 150.9 36.09 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.843 1.657 . . . . 1.1499999999999999 110.554 -170.141 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 79.1 mt -116.82 109.36 16.99 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.248 1.019 . . . . 1.5 112.331 174.603 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.0 t -77.46 151.93 34.47 Favored 'General case' 0 CA--C 1.549 0.924 0 O-C-N 121.325 -0.859 . . . . 2.1499999999999999 111.886 173.316 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.42 -46.19 4.63 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 126.087 1.755 . . . . 5.5899999999999999 115.604 -172.169 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.38 -18.06 61.21 Favored 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 115.051 1.5 . . . . 4.8700000000000001 115.051 178.996 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -90.73 -45.57 8.77 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 128.77 2.828 . . . . 2.1299999999999999 109.837 175.276 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.19 -31.04 72.01 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.281 1.033 . . . . 2.7999999999999998 112.906 175.318 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.95 -17.72 65.05 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.754 1.39 . . . . 5.4000000000000004 114.754 177.097 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.22 -58.2 3.42 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.38 1.072 . . . . 3.6899999999999999 108.894 171.529 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.9 tt -50.03 -56.02 12.44 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.729 1.611 . . . . 1.8799999999999999 112.121 -179.145 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.5 mt -53.69 -60.19 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 CA-C-N 118.85 0.75 . . . . 0.82999999999999996 109.937 -175.142 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.4 tptt -72.39 -9.64 58.77 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 113.264 0.839 . . . . 5.8200000000000003 113.264 -174.794 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 46.0 mmtt -91.69 -35.91 13.91 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.82 1.648 . . . . 3.4300000000000002 114.988 173.702 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -104.25 -44.38 4.98 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.652 0.781 . . . . 5.1399999999999997 112.094 -175.04 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -104.47 61.4 0.72 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.434 1.894 . . . . 3.0099999999999998 107.92 175.131 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 59.1 m -45.8 -64.94 0.62 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.537 1.535 . . . . 3.6400000000000001 113.066 -166.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 95.9 mt 65.19 152.17 0.05 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 127.862 2.465 . . . . 4.5099999999999998 115.974 168.426 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.57 -25.29 63.35 Favored Glycine 0 N--CA 1.474 1.199 0 O-C-N 121.378 -0.826 . . . . 2.9300000000000002 111.336 171.513 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.48 -160.2 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 129.484 3.114 . . . . 6.7000000000000002 110.894 173.312 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 17.8 mmt 43.5 93.38 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.22 1.808 . . . . 2.9100000000000001 115.187 -179.729 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.53 126.96 50.99 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.131 -1.062 . . . . 4.2199999999999998 108.131 164.076 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -12.73 -83.7 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 127.705 2.402 . . . . 4.9299999999999997 114.951 -157.652 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.5 t -60.08 -11.44 5.98 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.884 1.809 . . . . 4.3600000000000003 115.884 -172.009 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.9 t -61.53 -13.88 24.97 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 120.749 -1.219 . . . . 1.96 113.513 164.684 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 88.9 mt -77.03 -21.35 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 126.585 1.954 . . . . 1.3500000000000001 111.828 171.156 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -70.66 -53.53 15.41 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.858 0.754 . . . . 3.0099999999999998 111.3 -169.462 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -67.47 -34.01 76.29 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 121.51 -0.744 . . . . 3.2999999999999998 111.889 172.467 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.6 tp -54.73 -59.37 4.8 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 118.52 -0.752 . . . . 1.9399999999999999 110.186 174.11 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -67.4 -33.02 74.32 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.465 0.575 . . . . 1.8100000000000001 112.161 -179.323 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.5 tmtm? -65.78 -22.25 66.56 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 120.782 -1.198 . . . . 6.1600000000000001 112.885 169.455 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.2 t -86.89 -28.33 22.88 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.352 1.861 . . . . 1.9099999999999999 112.637 170.054 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.7 mt -65.83 -33.71 76.48 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.436 -0.79 . . . . 1.97 111.335 167.444 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -68.32 99.14 0.89 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 122.636 1.208 . . . . 2.3999999999999999 111.818 176.925 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -67.42 -23.6 65.56 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.691 1.196 . . . . 5.0999999999999996 113.697 -176.764 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -83.9 -29.81 26.86 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.322 1.449 . . . . 2.98 112.079 167.81 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.7 t 72.25 41.67 0.61 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 128.707 2.803 . . . . 3.3700000000000001 112.143 -167.569 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -94.9 -117.82 0.1 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.736 1.615 . . . . 3.8599999999999999 106.775 -179.656 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -153.04 -9.12 0.17 Allowed 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 116.394 1.998 . . . . 4.4500000000000002 116.394 173.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -101.41 128.97 47.37 Favored 'General case' 0 C--O 1.242 0.665 0 N-CA-C 106.857 -1.534 . . . . 2.6000000000000001 106.857 171.788 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.413 HG22 ' HB2' ' A' ' 72' ' ' TYR . 20.1 mm -96.54 89.74 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 124.451 1.1 . . . . 1.25 109.586 174.086 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -56.68 151.95 13.02 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.698 1.199 . . . . 2.98 111.3 165.106 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -46.95 -39.92 13.31 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.356 1.243 . . . . 2.2999999999999998 114.356 -175.831 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.58 -10.04 58.53 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.708 1.203 . . . . 3.4100000000000001 113.906 -179.544 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -73.1 -63.2 1.23 Allowed 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 106.633 -1.617 . . . . 2.04 106.633 155.599 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.413 ' HB2' HG22 ' A' ' 67' ' ' ILE . 24.0 t80 -49.04 -30.84 6.75 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 128.375 2.67 . . . . 2.0800000000000001 115.74 -173.931 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.5 m -53.45 -30.54 41.15 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.597 -1.314 . . . . 1.9099999999999999 113.229 173.158 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.0 m -68.98 -27.01 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 CA-C-N 119.903 1.229 . . . . 2.6699999999999999 112.935 179.816 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -59.47 -55.09 39.06 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.11 0.964 . . . . 1.75 109.968 173.416 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 52.3 mt -71.12 -25.91 62.79 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.015 -0.993 . . . . 2.3799999999999999 111.481 -179.599 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 41.5 m -64.48 -51.53 62.56 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.154 0.888 . . . . 0.93999999999999995 111.33 169.582 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 29.3 mtm -58.1 -45.57 87.02 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.455 1.025 . . . . 1.6499999999999999 111.909 179.121 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 72.6 mt -67.15 -38.18 85.08 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.905 -0.497 . . . . 1.28 112.085 178.563 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 33.5 t -63.28 -31.6 72.8 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.248 0.619 . . . . 1.8400000000000001 112.387 172.541 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 71.1 mtp -68.39 -40.19 81.46 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 119.701 1.137 . . . . 1.6599999999999999 112.324 167.448 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.15 -42.52 99.47 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.762 0.71 . . . . 0.77000000000000002 112.654 -179.112 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -60.69 -26.68 67.3 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.876 1.065 . . . . 3.0699999999999998 113.876 173.354 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -69.96 -37.7 75.88 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.466 1.03 . . . . 1.9199999999999999 112.796 176.402 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -73.04 -38.5 66.48 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.687 0.795 . . . . 3.2000000000000002 111.253 176.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -53.16 -51.47 61.9 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.131 1.372 . . . . 2.3900000000000001 110.959 172.198 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -55.54 -27.35 48.38 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.387 1.475 . . . . 2.3399999999999999 113.156 178.2 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 44.3 mt -84.03 -12.21 55.55 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.589 1.156 . . . . 1.73 113.496 178.776 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.422 ' CD ' ' HZ3' ' A' ' 92' ' ' LYS . 82.0 mm-40 -90.88 -38.34 12.99 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.266 1.026 . . . . 2.79 113.147 165.882 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -62.71 -34.57 77.43 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.975 2.11 . . . . 3.4300000000000002 114.637 -178.245 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -99.11 22.21 10.7 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.061 1.134 . . . . 2.8100000000000001 114.061 -168.498 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.422 ' HZ3' ' CD ' ' A' ' 89' ' ' GLU . 52.8 mttp . . . . . 0 C--O 1.248 0.993 0 N-CA-C 115.623 1.712 . . . . 4.79 115.623 176.801 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 71.8 mtm . . . . . 0 N--CA 1.483 1.191 0 N-CA-C 108.777 -0.824 . . . . 5.6100000000000003 108.777 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -150.24 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 125.755 1.622 . . . . 5.0700000000000003 109.962 131.869 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 64.2 p -145.39 159.84 47.18 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 125.327 1.451 . . . . 2.1699999999999999 112.626 -168.681 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -67.32 -21.25 47.82 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.899 2.4 . . . . 1.79 112.855 172.404 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -63.49 -45.79 89.14 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-N 118.877 0.762 . . . . 2.4100000000000001 110.487 166.219 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.51 -48.19 82.18 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 118.594 0.634 . . . . 3.7599999999999998 110.579 173.233 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . 0.499 ' HE3' ' HA ' ' B' ' 7' ' ' LYS . 0.0 OUTLIER -58.09 -25.17 60.98 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 120.576 -1.327 . . . . 4.29 114.508 175.026 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.57 -41.69 99.09 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.498 0.59 . . . . 1.3999999999999999 110.924 176.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 29.2 mt -57.78 -48.62 79.15 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.251 1.02 . . . . 1.8100000000000001 111.324 172.963 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.1 -48.27 79.03 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.919 0.888 . . . . 1.1599999999999999 111.018 177.622 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -72.54 -32.54 66.17 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.163 -0.922 . . . . 2.3399999999999999 111.932 -177.817 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 7.6 mtp -64.42 -41.5 96.57 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.486 1.114 . . . . 2.9399999999999999 112.328 171.796 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.78 -36.89 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 119.629 1.104 . . . . 1.8600000000000001 111.422 169.328 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 88.7 m -63.77 -54.77 30.04 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 118.069 -0.967 . . . . 0.90000000000000002 110.89 -176.524 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.7 p -63.7 -44.64 93.09 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.056 0.942 . . . . 1.74 110.03 176.949 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -65.17 -47.12 78.1 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.484 -0.486 . . . . 2.3999999999999999 110.886 -174.472 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -67.51 -44.81 77.53 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 120.796 -1.19 . . . . 2.5699999999999998 111.968 177.719 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -65.34 -20.81 66.56 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 120.78 -1.2 . . . . 4.5300000000000002 113.839 178.727 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -98.73 -1.18 41.18 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.625 0.972 . . . . 2.3599999999999999 113.625 164.814 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 41.8 m -87.26 -48.93 7.61 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 120.702 1.592 . . . . 1.6799999999999999 113.173 175.535 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.28 13.0 57.06 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.376 1.941 . . . . 1.78 112.693 174.478 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 8.8 ttm-85 -65.11 -59.33 4.23 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.033 1.333 . . . . 2.9900000000000002 109.507 169.451 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -156.35 -172.43 4.08 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 126.263 1.825 . . . . 3.6600000000000001 110.461 -169.506 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.59 -135.69 47.24 Favored Glycine 0 N--CA 1.472 1.092 0 O-C-N 120.962 -1.086 . . . . 2.5499999999999998 110.667 -178.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 6.6 t -82.19 158.89 23.41 Favored 'General case' 0 C--O 1.247 0.931 0 CA-C-O 123.329 1.538 . . . . 3.5 111.2 154.723 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -84.52 155.75 22.0 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.993 1.317 . . . . 7.54 110.33 170.899 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 6.5 tt 71.42 -21.59 0.21 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.516 1.927 . . . . 3.21 112.868 -166.45 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.3 p -107.2 150.58 26.47 Favored 'General case' 0 C--O 1.253 1.237 0 C-N-CA 126.223 1.809 . . . . 1.01 115.099 174.337 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -98.48 108.51 21.22 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 129.784 3.233 . . . . 2.1099999999999999 111.712 173.045 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 9.5 t -85.51 161.94 19.14 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.282 1.033 . . . . 2.0699999999999998 113.279 174.773 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 33.5 ttt85 -50.2 -19.53 0.8 Allowed 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 117.293 2.331 . . . . 3.6099999999999999 117.293 -174.964 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.21 -25.35 12.02 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.286 1.217 . . . . 4.4900000000000002 114.286 170.702 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -62.12 -51.91 66.0 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 108.362 -0.977 . . . . 2.0499999999999998 108.362 169.485 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 8.1 tp -60.31 -38.79 84.77 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 125.172 1.389 . . . . 1.9199999999999999 112.651 179.173 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -55.74 -41.75 74.37 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 122.098 -0.376 . . . . 3.0600000000000001 110.851 175.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -65.34 -49.52 69.08 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 117.834 -1.079 . . . . 3.4100000000000001 113.293 169.631 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 tt -53.25 -48.9 67.85 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 120.155 1.343 . . . . 2.1200000000000001 111.671 -179.259 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 5.8 mt -65.35 -40.18 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 120.087 1.312 . . . . 0.91000000000000003 110.583 178.915 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -65.2 0.17 1.48 Allowed 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 114.572 1.323 . . . . 5.1900000000000004 114.572 171.566 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -119.78 -45.93 2.47 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.662 1.585 . . . . 3.5 112.971 177.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . 0.407 ' O ' HG21 ' A' ' 3' ' ' THR . 28.5 mt-10 -72.72 -29.34 63.27 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-O 117.418 -1.277 . . . . 4.29 112.785 175.367 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -125.24 -81.7 0.63 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.909 1.684 . . . . 2.5299999999999998 110.469 -175.978 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 7.5 t 64.07 -44.24 0.27 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 129.01 2.924 . . . . 4.79 115.745 -175.555 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 4.3 pp -61.92 -15.39 42.67 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 127.771 2.429 . . . . 3.3399999999999999 115.941 -167.707 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -79.92 13.17 26.32 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 124.346 0.974 . . . . 3.3799999999999999 114.148 171.757 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 61.43 56.07 2.69 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.205 2.202 . . . . 7.1799999999999997 111.811 -176.965 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.77 74.41 0.59 Allowed 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 115.624 1.712 . . . . 3.3100000000000001 115.624 -161.639 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -88.38 168.88 12.29 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 127.367 2.267 . . . . 5.2599999999999998 112.443 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -48.1 -53.61 15.96 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.789 1.236 . . . . 4.6200000000000001 113.146 -178.83 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 21.5 t -66.13 5.11 0.56 Allowed 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 115.652 1.723 . . . . 3.3500000000000001 115.652 -179.605 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 43.0 t -119.41 -40.63 2.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.17 1.388 . . . . 2.2200000000000002 111.765 166.732 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 26.0 mm -59.67 -33.93 53.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.612 1.565 . . . . 1.3200000000000001 112.507 174.307 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -70.67 -42.09 71.2 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.998 1.319 . . . . 4.1500000000000004 112.339 179.729 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -74.36 -42.23 59.69 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 124.362 1.065 . . . . 2.98 111.61 177.49 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 49.2 tp -58.73 -46.62 86.97 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.05 0.94 . . . . 2.3199999999999998 110.513 171.465 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 17.4 tpp -54.26 -49.18 70.13 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.059 0.943 . . . . 2.1000000000000001 110.773 174.334 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.65 -22.49 45.97 Favored 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 114.307 1.225 . . . . 4.1100000000000003 114.307 175.605 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 4.8 t -92.85 -28.25 16.64 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 120.744 -1.223 . . . . 2.6299999999999999 113.427 171.477 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.81 -42.44 27.75 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 127.924 2.49 . . . . 2.0 112.724 -179.127 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -99.34 128.4 45.45 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 124.776 1.231 . . . . 1.9299999999999999 110.24 166.546 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -95.27 -11.34 28.09 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.741 -0.599 . . . . 3.6699999999999999 112.606 173.794 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . 0.555 ' HB2' ' H ' ' B' ' 64' ' ' ASP . 5.2 m120 -94.32 -32.98 13.38 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.515 1.302 . . . . 1.8100000000000001 114.515 -169.502 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 9.2 t 72.91 15.87 4.57 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.161 1.384 . . . . 2.9300000000000002 112.462 -156.048 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . 0.555 ' H ' ' HB2' ' B' ' 62' ' ' ASN . 53.9 p-10 -71.94 -18.45 62.01 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.382 1.073 . . . . 2.1000000000000001 109.802 169.741 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 61.08 21.23 11.64 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 128.98 2.912 . . . . 4.4199999999999999 111.853 -178.758 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -126.23 144.9 50.61 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 128.375 2.67 . . . . 2.1200000000000001 109.657 171.811 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 16.0 mt -128.3 130.26 69.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 125.791 1.637 . . . . 1.3200000000000001 109.428 -171.325 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.34 173.01 6.49 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.915 1.686 . . . . 2.9700000000000002 111.516 168.868 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -47.25 -40.77 17.26 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.235 1.414 . . . . 3.1899999999999999 114.811 176.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 24.2 mtmm -70.28 -43.93 69.42 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.526 -0.734 . . . . 3.4300000000000002 110.986 -176.651 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -61.34 -47.22 86.89 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.185 0.994 . . . . 2.2400000000000002 110.642 173.773 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -58.89 -22.0 58.59 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 128.499 2.719 . . . . 2.5899999999999999 113.647 177.448 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 9.4 t -53.31 -35.26 59.95 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 120.982 -1.074 . . . . 2.6099999999999999 111.714 168.491 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 65.0 t -66.14 -31.89 55.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 O-C-N 121.248 -0.907 . . . . 1.6799999999999999 112.15 -179.868 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.434 ' CE1' HD11 ' B' ' 79' ' ' LEU . 36.0 t80 -67.53 -56.98 7.34 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.431 1.092 . . . . 2.6800000000000002 111.849 173.522 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 77.8 mt -55.43 -39.82 70.74 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.046 1.338 . . . . 1.71 111.397 179.309 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 58.6 m -65.39 -52.19 55.16 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.141 1.376 . . . . 0.96999999999999997 111.815 176.538 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 16.7 ptp -65.63 -38.0 88.16 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.426 1.012 . . . . 2.3900000000000001 112.677 -177.412 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.434 HD11 ' CE1' ' B' ' 75' ' ' PHE . 92.3 mt -65.78 -47.01 76.58 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.269 0.628 . . . . 1.53 111.101 175.73 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 94.0 m -65.61 -32.58 74.23 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.462 -0.774 . . . . 1.71 112.611 176.864 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 52.9 mtm -65.85 -37.04 85.12 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.923 1.238 . . . . 3.1899999999999999 112.715 172.238 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.28 -42.42 98.61 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.602 1.092 . . . . 0.96999999999999997 112.593 173.313 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -69.67 -32.9 71.8 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.533 0.938 . . . . 2.79 113.533 172.682 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -58.8 -48.97 79.43 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.175 0.898 . . . . 2.6499999999999999 112.062 172.282 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -59.26 -48.66 80.79 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.163 1.385 . . . . 3.1800000000000002 111.44 177.78 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.09 -45.44 68.2 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.448 1.499 . . . . 2.6099999999999999 112.326 175.242 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -71.21 -28.18 64.03 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.31 1.444 . . . . 2.2400000000000002 112.861 -177.665 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 78.9 mt -77.74 -8.95 58.69 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.883 1.068 . . . . 2.3399999999999999 113.883 177.677 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -92.69 -3.38 54.96 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 119.298 0.954 . . . . 5.1200000000000001 113.333 167.564 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -99.7 -74.84 0.58 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.237 1.415 . . . . 4.96 110.203 166.926 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.32 -7.78 54.9 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 116.311 1.967 . . . . 5.1100000000000003 116.311 -167.159 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . 0.48 ' C ' ' HZ2' ' A' ' 26' ' ' LYS 0.26 4.0 tttp . . . . . 0 C--O 1.248 0.976 1 C-N-CA 131.827 4.051 . . . . 9.0399999999999991 116.897 -158.704 . . . . . . . . 3 2 . 1 . 021 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.3 ttp . . . . . 0 N--CA 1.479 0.996 0 N-CA-C 107.277 -1.379 . . . . 7.1299999999999999 107.277 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 -115.9 -61.21 1.77 Allowed 'General case' 0 C--N 1.327 -0.372 0 O-C-N 124.862 1.351 . . . . 3.3100000000000001 107.711 -159.435 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 66.4 p -135.96 162.39 57.03 Favored Pre-proline 0 C--O 1.238 0.474 0 C-N-CA 124.96 1.304 . . . . 1.55 109.846 160.914 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -64.31 -22.78 66.22 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 121.826 1.684 . . . . 1.3400000000000001 112.091 166.551 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -69.68 -52.01 29.55 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.532 1.133 . . . . 3.5600000000000001 111.649 177.071 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -52.28 -44.22 64.86 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.563 1.145 . . . . 4.0599999999999996 111.041 175.196 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.537 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -77.35 -34.35 55.18 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 115.317 1.599 . . . . 5.8799999999999999 115.317 -178.936 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.39 -42.17 77.47 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 123.441 0.697 . . . . 1.23 112.001 165.039 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 74.0 mt -70.39 -34.19 72.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.264 0.938 . . . . 1.8400000000000001 112.37 173.911 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 5.1 m -60.56 -46.51 89.94 Favored 'General case' 0 N--CA 1.479 0.981 0 O-C-N 121.063 -1.023 . . . . 1.5800000000000001 110.937 167.463 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.5 m -57.86 -41.36 82.28 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.868 1.667 . . . . 1.6200000000000001 111.221 -179.003 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 19.0 tpp -52.93 -56.78 13.41 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 117.953 -1.023 . . . . 3.75 111.852 168.702 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -62.35 -32.8 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 CA-C-N 120.983 1.719 . . . . 2.3100000000000001 113.106 -176.425 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.4 m -60.83 -58.93 6.39 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.631 1.172 . . . . 1.1299999999999999 111.069 173.787 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 t -73.54 -30.03 62.82 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 117.332 -1.318 . . . . 3.1299999999999999 110.399 -171.141 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -53.82 -53.03 58.16 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 125.677 1.591 . . . . 2.4300000000000002 110.01 170.708 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -59.15 -29.04 67.13 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.123 1.157 . . . . 2.2799999999999998 114.123 175.141 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.9 tttp -64.67 -31.72 73.07 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 120.724 -1.235 . . . . 4.1699999999999999 112.57 176.258 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -94.84 -38.7 10.62 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.729 1.212 . . . . 2.1299999999999999 112.778 177.452 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.3 p -70.05 -25.97 63.8 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.109 1.322 . . . . 2.2599999999999998 113.343 174.304 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.24 40.74 2.94 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 126.807 2.146 . . . . 2.4100000000000001 113.871 171.729 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -96.27 -26.34 15.44 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 118.941 1.371 . . . . 5.0499999999999998 112.349 166.059 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.02 153.38 42.16 Favored 'General case' 0 C--O 1.245 0.856 0 C-N-CA 128.722 2.809 . . . . 5.4400000000000004 110.24 177.984 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 46.46 -108.52 0.27 Allowed Glycine 0 C--N 1.345 1.038 0 C-N-CA 127.255 2.36 . . . . 3.0 114.996 147.396 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 m -59.9 102.82 0.17 Allowed 'General case' 0 C--O 1.241 0.635 0 N-CA-C 108.77 -0.826 . . . . 2.7400000000000002 108.77 166.669 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.7 -15.47 56.41 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.04 0.755 . . . . 5.0 113.04 -176.381 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 10.7 mp -83.96 -49.23 9.17 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 126.012 1.725 . . . . 4.6299999999999999 110.986 177.098 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.4 p -111.31 170.36 8.17 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.939 2.096 . . . . 2.0800000000000001 113.331 -168.748 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 46.7 mt -116.55 103.73 10.7 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.456 1.502 . . . . 1.48 113.04 -162.796 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.94 172.47 10.87 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 121.18 -0.95 . . . . 2.1600000000000001 112.114 165.804 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.53 -48.64 2.86 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.593 1.957 . . . . 3.9500000000000002 114.594 -177.667 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -41.53 74.55 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.657 -0.652 . . . . 6.5199999999999996 112.239 -178.616 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 87.8 mt-10 -67.55 -44.38 78.41 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.369 -0.604 . . . . 1.96 109.369 -178.06 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.83 -52.31 66.0 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.728 1.211 . . . . 2.1499999999999999 112.156 177.264 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 15.5 ptmt -63.75 -25.81 68.36 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 120.288 1.404 . . . . 3.52 114.217 -176.204 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -81.84 -50.94 8.63 Favored 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 124.927 1.291 . . . . 3.27 110.634 -177.726 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.1 tt -46.68 -55.22 8.09 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 125.407 1.483 . . . . 2.1400000000000001 110.209 177.245 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.0 mt -51.59 -55.55 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 118.701 0.682 . . . . 1.3 110.689 -178.903 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -68.8 -23.45 64.29 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.984 0.735 . . . . 3.9700000000000002 112.984 -172.768 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.78 -14.99 22.85 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 126.81 2.044 . . . . 5.9500000000000002 113.258 -179.22 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -79.42 -54.82 5.55 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.977 1.311 . . . . 4.4800000000000004 109.487 161.374 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.0 mt -119.3 91.31 3.52 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.85 1.66 . . . . 3.2200000000000002 110.729 -179.167 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 4.6 t -84.74 71.18 10.86 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.282 -0.886 . . . . 3.0600000000000001 109.756 168.121 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 pp -171.41 -179.39 2.59 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 128.067 2.547 . . . . 3.8700000000000001 110.112 -172.222 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 65.12 13.4 57.59 Favored Glycine 0 N--CA 1.477 1.404 0 O-C-N 121.707 -0.621 . . . . 4.5700000000000003 112.339 -173.796 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 44.5 53.03 7.27 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 129.568 3.147 . . . . 6.0499999999999998 109.878 178.934 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.1 tpp -67.36 80.69 0.15 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.344 1.858 . . . . 1.95 113.962 -157.425 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -74.11 129.67 38.29 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.956 2.503 . . . . 5.2199999999999998 109.467 178.602 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -64.87 -10.29 27.46 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 116.348 1.981 . . . . 3.9199999999999999 116.348 -159.757 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.8 t -60.21 -28.81 68.29 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.245 -1.535 . . . . 4.2300000000000004 113.555 166.329 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.0 p -90.53 1.12 57.01 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.929 1.241 . . . . 2.5299999999999998 113.194 172.251 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 19.8 mm -82.18 -40.45 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 119.121 0.873 . . . . 2.0899999999999999 110.924 167.534 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -67.73 -52.47 37.26 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 118.649 0.658 . . . . 4.9699999999999998 112.751 -171.024 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -72.69 -26.47 61.63 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.929 -0.482 . . . . 3.2200000000000002 112.025 -179.173 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.32 -51.27 70.22 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 117.669 -1.158 . . . . 2.3700000000000001 109.551 165.771 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ttt -52.76 -46.26 67.42 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 119.932 1.242 . . . . 1.4299999999999999 111.838 174.132 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -68.69 -26.24 65.19 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 120.952 1.705 . . . . 3.52 113.442 177.651 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.1 t -71.69 -28.68 63.87 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 120.953 -1.092 . . . . 2.9399999999999999 111.741 172.239 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 11.8 mt -72.88 -58.82 3.05 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.915 -1.115 . . . . 1.8799999999999999 109.855 165.559 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -84.25 61.3 6.46 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.542 1.937 . . . . 1.5600000000000001 111.665 -177.253 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.0 mttp -52.01 -20.7 2.55 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 127.561 2.344 . . . . 3.1099999999999999 114.472 -171.253 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 35.1 p-10 -111.27 -0.85 16.28 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 129.074 2.95 . . . . 2.5099999999999998 114.125 -175.499 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.6 t 67.42 30.59 6.81 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.775 1.23 . . . . 2.2599999999999998 114.268 168.134 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -90.17 -9.13 49.32 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.42 1.488 . . . . 2.7400000000000002 112.826 -176.408 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.28 -9.64 1.43 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 129.69 3.196 . . . . 4.3200000000000003 116.9 178.088 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -106.51 142.0 36.89 Favored 'General case' 0 C--O 1.247 0.971 0 C-N-CA 125.701 1.6 . . . . 2.8300000000000001 112.205 173.738 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.5 mt -120.37 101.06 10.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-O 122.854 1.312 . . . . 1.5 111.867 -167.852 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.45 ' OD1' ' HE3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -74.27 158.45 34.04 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 129.053 2.941 . . . . 3.27 111.998 171.527 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.79 -25.8 67.41 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 120.636 -1.29 . . . . 2.5600000000000001 114.09 -174.425 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.455 ' HE2' ' SD ' ' B' ' 81' ' ' MET . 2.5 mtmt -81.55 -33.47 31.68 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 120.548 1.522 . . . . 3.3399999999999999 111.872 173.535 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -54.94 -53.59 53.67 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.027 0.831 . . . . 2.1699999999999999 109.003 165.27 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -66.01 -33.73 76.47 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 127.196 2.199 . . . . 2.1000000000000001 114.751 -175.943 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.33 -21.37 61.98 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 120.443 -1.411 . . . . 1.97 113.304 -175.348 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 p -60.13 -26.98 38.03 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 O-C-N 121.315 -0.865 . . . . 2.3300000000000001 112.477 171.697 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -68.0 -51.59 45.41 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 126.679 1.992 . . . . 2.4199999999999999 111.361 178.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.75 -46.85 67.65 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.178 0.991 . . . . 2.23 109.841 169.786 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 20.6 m -61.42 -55.53 30.33 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.974 0.909 . . . . 0.94999999999999996 111.238 -176.675 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 21.1 ptm -66.53 -36.33 82.43 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.814 0.672 . . . . 1.95 112.814 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.4 mt -66.54 -41.56 88.51 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.177 -0.916 . . . . 1.26 111.43 173.437 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.5 m -64.25 -36.73 85.05 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 120.051 1.296 . . . . 1.4099999999999999 112.731 175.57 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 38.1 mmm -61.17 -44.82 96.71 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.054 0.542 . . . . 2.0600000000000001 111.202 174.063 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.27 -38.5 81.8 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.772 0.829 . . . . 0.95999999999999996 112.236 -178.608 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -65.93 -27.46 68.2 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.319 0.859 . . . . 2.3700000000000001 113.319 175.036 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.14 -36.66 74.93 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 119.254 0.934 . . . . 2.5699999999999998 112.15 173.809 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -67.14 -43.58 82.0 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.885 0.874 . . . . 3.4500000000000002 110.847 175.926 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -52.6 -44.73 66.18 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.719 1.608 . . . . 2.9100000000000001 112.358 173.361 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -62.61 -27.23 69.06 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.069 1.748 . . . . 2.6800000000000002 112.541 178.892 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 45.3 mt -83.07 -18.6 39.06 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.403 1.081 . . . . 2.5699999999999998 112.84 177.156 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.42 ' CD ' ' HZ1' ' A' ' 92' ' ' LYS . 69.4 mm-40 -90.26 -10.32 44.68 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.718 1.377 . . . . 3.2200000000000002 114.718 171.854 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -84.16 -46.02 12.35 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.034 1.734 . . . . 3.0600000000000001 112.591 169.011 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -79.1 51.03 1.11 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.973 2.109 . . . . 3.48 113.204 -168.295 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.42 ' HZ1' ' CD ' ' A' ' 89' ' ' GLU . 46.6 mmtt . . . . . 0 C--O 1.251 1.169 0 C-N-CA 128.064 2.546 . . . . 4.7800000000000002 115.422 176.397 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.0 mmt . . . . . 0 N--CA 1.482 1.139 0 CA-C-O 117.359 -1.305 . . . . 7.2599999999999998 108.621 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.09 -177.59 4.02 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 124.062 0.851 . . . . 8.0600000000000005 110.929 163.633 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 9.6 t -45.32 143.16 2.8 Favored Pre-proline 0 CA--C 1.535 0.395 0 C-N-CA 128.105 2.562 . . . . 3.9500000000000002 112.256 174.48 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -66.95 -9.11 23.74 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.181 1.921 . . . . 2.4199999999999999 113.081 172.691 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.404 ' O ' HD13 ' B' ' 5' ' ' LEU . 0.3 OUTLIER -69.56 -37.7 77.11 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 117.098 -1.43 . . . . 2.8199999999999998 112.6 176.931 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 13.4 tm-20 -54.34 -42.04 69.78 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 121.427 1.921 . . . . 5.0 110.137 179.118 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 38.5 mtmt -55.05 -23.72 21.4 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.603 0.964 . . . . 7.3899999999999997 113.603 175.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.82 -49.03 61.87 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 120.731 -1.231 . . . . 0.94999999999999996 111.007 176.274 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -57.42 -48.91 77.88 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 119.393 0.997 . . . . 2.8900000000000001 109.886 178.858 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 13.9 p -64.15 -44.22 92.79 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.394 1.078 . . . . 2.0899999999999999 112.684 177.937 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 26.9 m -70.2 -32.16 69.94 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.64 1.109 . . . . 1.53 110.813 178.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -70.78 -50.26 37.7 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.12 0.968 . . . . 3.5699999999999998 111.045 176.682 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 6.3 p -59.83 -27.3 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-N 120.509 1.504 . . . . 2.2999999999999998 112.104 175.122 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 60.7 m -64.81 -57.8 7.93 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 116.921 -1.514 . . . . 0.92000000000000004 111.593 175.159 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.9 p -61.61 -41.48 97.53 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.147 1.34 . . . . 1.6100000000000001 109.07 175.317 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -64.45 -49.56 70.95 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 120.515 -0.474 . . . . 2.1299999999999999 111.604 -170.369 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 12.0 t60 -69.23 -44.69 71.5 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.774 -0.579 . . . . 2.4199999999999999 111.225 178.532 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -66.78 -39.47 87.83 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.015 -1.053 . . . . 4.2800000000000002 112.91 -175.289 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -80.18 -27.31 38.96 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.62 0.768 . . . . 2.29 112.424 173.016 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 57.0 m -68.91 -22.92 64.13 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.169 1.349 . . . . 2.4900000000000002 112.716 168.292 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.08 11.33 72.48 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 125.656 1.598 . . . . 1.77 115.45 178.127 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.478 HH11 ' HG3' ' B' ' 22' ' ' ARG . 7.9 mmt85 -80.77 -23.38 39.38 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.196 1.398 . . . . 4.29 114.181 177.994 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -164.01 149.64 10.86 Favored 'General case' 0 C--O 1.25 1.088 0 C-N-CA 126.481 1.913 . . . . 3.2400000000000002 108.738 -171.215 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.78 -142.32 16.6 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-O 121.702 0.612 . . . . 2.3100000000000001 111.855 -174.301 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 58.9 m -75.17 151.51 38.51 Favored 'General case' 0 C--O 1.242 0.661 0 O-C-N 121.331 -1.099 . . . . 3.8599999999999999 112.55 178.714 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -71.84 56.55 0.3 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.759 2.024 . . . . 5.9100000000000001 111.915 167.038 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 59.5 tp -160.2 -42.81 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.116 1.366 . . . . 4.0 110.0 -170.556 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.4 p -101.45 140.25 35.99 Favored 'General case' 0 C--O 1.251 1.15 0 C-N-CA 125.066 1.346 . . . . 1.77 110.297 173.842 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.45 ' H ' HD23 ' B' ' 29' ' ' LEU 0.263 1.8 pt? -98.58 94.72 6.83 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 122.334 1.064 . . . . 3.27 109.493 158.042 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 5.6 m -65.33 165.24 12.07 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 126.729 2.012 . . . . 3.0899999999999999 112.532 -176.004 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . 0.5 HH22 ' CG ' ' B' ' 53' ' ' ASP . 0.9 OUTLIER -30.07 -39.07 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 128.394 2.678 . . . . 5.25 117.14 -178.191 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.4 -37.9 11.22 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.793 1.405 . . . . 4.3300000000000001 114.793 174.115 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -53.44 -41.54 66.2 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.71 1.204 . . . . 2.0699999999999998 109.579 174.305 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.453 HD23 ' HB2' ' B' ' 56' ' ' MET . 24.7 tp -71.41 -40.89 70.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.108 0.963 . . . . 1.8200000000000001 113.473 179.7 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 24.1 ttmt -62.84 -45.09 94.21 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 120.837 -1.165 . . . . 3.1099999999999999 111.949 176.003 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -52.81 -56.83 12.86 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.378 1.471 . . . . 3.2200000000000002 111.993 167.006 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -60.05 -47.82 84.28 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.707 1.603 . . . . 2.5800000000000001 112.846 -174.71 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.8 mt -59.24 -48.27 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 CA-C-N 120.254 1.388 . . . . 1.05 109.547 175.485 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -62.53 -22.86 66.62 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.107 0.78 . . . . 4.0499999999999998 113.107 -179.489 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -82.06 -53.62 5.96 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 117.353 -1.308 . . . . 3.6899999999999999 113.383 168.806 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -67.45 -35.97 80.27 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.632 1.173 . . . . 4.2300000000000004 112.527 -172.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -92.03 -73.89 0.53 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.924 1.29 . . . . 3.1600000000000001 110.263 174.178 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 11.9 t 66.13 -40.76 0.35 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 127.908 2.483 . . . . 3.8399999999999999 113.616 -168.858 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 pp -62.5 174.31 1.02 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 128.063 2.545 . . . . 3.4900000000000002 113.787 172.087 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.04 -142.04 23.88 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 115.456 -0.793 . . . . 3.0699999999999998 111.836 167.131 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -119.32 57.47 0.89 Allowed 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 122.399 1.095 . . . . 5.1900000000000004 109.564 178.206 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.76 47.53 1.4 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 124.234 1.969 . . . . 2.5899999999999999 113.401 -175.059 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 37.5 mttp -81.42 152.56 27.35 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.121 2.168 . . . . 4.1299999999999999 112.169 172.192 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -47.44 -54.04 12.45 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.49 1.293 . . . . 3.3399999999999999 114.49 -163.155 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 9.0 t -61.25 -23.7 65.84 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 120.184 1.356 . . . . 3.1699999999999999 113.945 -176.292 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 9.8 t -86.71 -9.37 56.08 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.978 0.808 . . . . 2.1600000000000001 112.94 174.95 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 22.3 mt -97.52 -40.05 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 125.9 1.68 . . . . 1.3400000000000001 110.833 172.32 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.5 ' CG ' HH22 ' B' ' 31' ' ' ARG . 0.9 OUTLIER -67.52 -39.2 85.08 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 126.076 1.75 . . . . 4.0099999999999998 110.08 176.567 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -69.8 -44.92 69.07 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 118.559 0.618 . . . . 2.96 112.337 166.102 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 7.4 tt -57.85 -44.37 86.48 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.466 1.03 . . . . 2.2799999999999998 111.186 -177.893 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . 0.453 ' HB2' HD23 ' B' ' 34' ' ' LEU . 1.9 ppp? -67.06 -38.8 86.43 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.453 1.024 . . . . 2.1699999999999999 111.959 176.972 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 1.4 tmpt? -62.74 -23.39 67.16 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.905 1.282 . . . . 3.9700000000000002 112.812 169.317 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 22.1 m -92.31 -22.45 19.72 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.639 1.576 . . . . 2.6299999999999999 112.95 178.218 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 19.2 mt -67.09 -47.67 70.51 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 118.643 0.656 . . . . 1.9199999999999999 109.731 163.403 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -78.08 141.66 38.66 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.949 1.3 . . . . 2.5899999999999999 113.832 -173.266 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -115.5 3.31 14.04 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.018 1.327 . . . . 3.3999999999999999 112.2 178.523 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -117.37 -28.94 5.99 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.612 1.565 . . . . 2.7799999999999998 112.933 -162.378 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 46.0 m 67.83 29.37 6.74 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 129.227 3.011 . . . . 2.79 112.52 -161.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 37.2 p30 -85.31 -14.32 46.88 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 120.695 -1.253 . . . . 2.4700000000000002 112.383 -170.92 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 58.99 4.63 0.43 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 129.901 3.28 . . . . 4.7999999999999998 115.236 -168.2 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -105.22 122.34 45.73 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 127.472 2.309 . . . . 2.8399999999999999 110.589 176.535 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 32.1 mm -101.87 107.03 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 114.646 -1.161 . . . . 1.8100000000000001 109.823 175.391 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.48 158.29 32.22 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.829 2.051 . . . . 4.1900000000000004 112.516 173.243 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -50.39 -25.57 4.03 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.278 1.431 . . . . 3.1200000000000001 113.219 163.114 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm -91.72 -16.96 26.15 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 115.623 1.712 . . . . 5.1299999999999999 115.623 176.283 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -89.89 -44.18 10.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.586 1.154 . . . . 1.8899999999999999 109.725 172.703 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -54.42 -22.12 11.64 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.518 1.927 . . . . 1.8500000000000001 114.297 179.17 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 41.0 p -55.76 -29.57 59.82 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 119.869 -1.769 . . . . 2.2000000000000002 113.068 168.393 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 88.2 t -61.12 -34.83 61.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 CA-C-N 119.412 1.005 . . . . 1.7 111.034 173.497 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -66.56 -54.63 21.52 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.038 0.835 . . . . 2.4300000000000002 110.968 177.476 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 76.2 mt -56.86 -36.33 69.92 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.329 0.652 . . . . 1.4099999999999999 112.269 177.463 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 60.8 m -61.63 -46.63 88.99 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.185 0.994 . . . . 0.98999999999999999 111.072 177.087 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.2 mtm -61.26 -43.53 98.72 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 118.845 0.748 . . . . 1.74 112.252 178.32 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -57.6 -54.59 45.16 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 118.714 0.688 . . . . 2.6899999999999999 110.883 173.733 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 89.7 m -66.85 -30.43 70.61 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.298 1.221 . . . . 1.54 114.298 -176.676 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . 0.455 ' SD ' ' HE2' ' A' ' 70' ' ' LYS . 14.3 mtp -75.09 -33.56 61.65 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.777 1.171 . . . . 2.23 112.562 171.514 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.21 -50.21 66.73 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 119.333 0.97 . . . . 0.91000000000000003 111.376 172.158 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -60.67 -24.45 65.6 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.403 0.89 . . . . 3.0499999999999998 113.403 175.917 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -66.64 -46.92 74.23 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 117.955 -1.022 . . . . 2.7599999999999998 112.484 170.394 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -65.14 -30.16 71.07 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 120.429 1.468 . . . . 3.2799999999999998 112.108 177.626 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.443 ' HA ' ' HG2' ' B' ' 89' ' ' GLU . 0.5 OUTLIER -63.94 -46.64 83.82 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 127.407 2.283 . . . . 3.2000000000000002 111.953 175.15 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -81.13 4.24 20.71 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 119.704 -1.873 . . . . 2.3599999999999999 113.253 171.092 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 81.8 mt -109.57 -0.9 18.51 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 114.376 1.25 . . . . 2.0499999999999998 114.376 165.696 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.443 ' HG2' ' HA ' ' B' ' 86' ' ' PHE . 21.4 pt-20 -97.23 -27.3 14.59 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.59 1.541 . . . . 5.6200000000000001 113.601 170.869 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -46.33 -42.51 14.87 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.519 1.128 . . . . 5.9299999999999997 111.273 149.015 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -85.14 -0.95 56.21 Favored 'General case' 0 CA--C 1.559 1.306 0 N-CA-C 116.258 1.947 . . . . 5.3300000000000001 116.258 177.303 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 19.0 mttp . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 116.279 -1.82 . . . . 5.96 115.468 -172.301 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 31.0 mtt . . . . . 0 N--CA 1.478 0.956 0 N-CA-C 107.206 -1.405 . . . . 5.9500000000000002 107.206 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.3 mp0 -128.5 143.03 50.91 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 124.29 0.994 . . . . 4.04 108.758 -165.403 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -55.24 157.05 6.85 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 127.583 2.353 . . . . 2.54 112.852 172.454 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -65.21 -28.96 55.75 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.41 2.073 . . . . 2.0899999999999999 113.5 -168.174 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 27.9 tp -66.57 -47.79 71.67 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 120.042 1.292 . . . . 4.0199999999999996 110.974 174.321 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -60.15 -34.13 73.14 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.794 -0.566 . . . . 4.9400000000000004 110.819 174.192 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.514 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 5.4 mmpt? -72.84 -33.16 65.98 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 120.152 -1.592 . . . . 4.3399999999999999 113.988 173.478 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.64 -45.73 85.54 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 118.808 0.731 . . . . 1.3700000000000001 110.729 170.432 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 55.8 mt -67.02 -35.19 79.38 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.945 -1.097 . . . . 1.71 112.872 174.328 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 84.8 m -55.54 -46.75 77.05 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.479 1.112 . . . . 1.72 110.709 169.165 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 81.6 m -57.24 -48.53 78.6 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.746 0.818 . . . . 1.76 109.678 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.1 tpp -51.3 -55.66 17.11 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.09 0.956 . . . . 3.1499999999999999 113.563 179.554 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.76 -29.15 46.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 123.689 0.795 . . . . 2.52 112.489 -177.599 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.5 m -72.75 -46.28 54.3 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.184 1.394 . . . . 1.02 110.578 -179.372 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.44 -37.27 77.7 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 118.634 -0.698 . . . . 2.1699999999999999 111.084 165.371 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -66.81 -60.19 2.88 Favored 'General case' 0 C--O 1.222 -0.343 0 O-C-N 123.532 0.52 . . . . 2.1000000000000001 110.845 -170.116 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.9 m170 -72.12 -1.94 16.76 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.892 1.441 . . . . 2.2999999999999998 114.892 -178.322 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -88.56 -62.58 1.46 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.413 1.085 . . . . 4.3099999999999996 112.535 164.957 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -72.64 -39.3 67.31 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.795 1.18 . . . . 2.5899999999999999 113.261 -179.215 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.0 t -62.29 -22.74 66.26 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.498 -0.751 . . . . 2.25 111.818 -176.035 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -157.03 106.8 0.3 Allowed Glycine 0 C--N 1.343 0.924 0 N-CA-C 116.181 1.232 . . . . 2.3100000000000001 116.181 164.479 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -79.86 -13.55 59.31 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 114.736 -0.732 . . . . 5.0800000000000001 111.777 132.307 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -165.14 -167.94 1.3 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.0 2.12 . . . . 3.8500000000000001 109.022 -161.879 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 39.2 53.94 2.62 Favored Glycine 0 N--CA 1.474 1.184 0 C-N-CA 125.936 1.732 . . . . 3.4300000000000002 113.84 160.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.2 t 56.11 138.55 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.686 1.994 . . . . 2.96 114.186 -167.424 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.0 mmmt -70.32 -18.61 63.1 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 120.864 -1.147 . . . . 5.6900000000000004 113.983 172.751 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.5 mt -102.16 -6.61 23.04 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.518 1.127 . . . . 3.6000000000000001 113.076 -171.338 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.2 p -136.98 139.45 41.47 Favored 'General case' 0 C--O 1.247 0.962 0 C-N-CA 126.231 1.812 . . . . 1.03 109.771 -174.478 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -94.61 103.31 15.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.064 0.946 . . . . 1.8300000000000001 110.136 170.408 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -74.15 161.31 30.12 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 119.973 -1.704 . . . . 2.2599999999999998 111.113 165.7 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -39.57 -46.77 1.82 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.285 1.834 . . . . 4.2999999999999998 114.481 -167.605 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.478 ' H ' ' HD3' ' A' ' 32' ' ' LYS . 0.6 OUTLIER -69.36 -42.27 75.46 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.927 1.084 . . . . 4.3399999999999999 113.927 -179.108 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -60.56 -48.7 80.6 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.846 1.658 . . . . 1.5900000000000001 108.641 176.426 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.1 tp -61.4 -43.39 98.95 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.654 0.782 . . . . 1.8899999999999999 111.502 178.253 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -66.48 -37.91 86.15 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 118.363 -0.827 . . . . 3.6600000000000001 112.732 -173.049 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -56.86 -54.44 46.46 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 117.792 -1.099 . . . . 3.9100000000000001 112.543 166.376 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.6 tt -53.42 -60.81 2.82 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.907 0.883 . . . . 1.99 110.514 -179.214 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.9 mt -56.96 -51.65 65.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 N-CA-C 108.831 -0.803 . . . . 0.81999999999999995 108.831 -175.801 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -61.96 -35.79 79.5 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.172 0.896 . . . . 4.0 113.115 -175.328 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 60.8 mttm -66.28 -34.87 78.97 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.503 1.047 . . . . 2.96 112.956 172.116 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -72.47 -51.61 19.42 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.454 1.102 . . . . 4.6600000000000001 111.793 179.521 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -82.12 25.82 0.56 Allowed 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 126.45 1.9 . . . . 2.6899999999999999 113.025 -176.453 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.0 m -60.87 6.6 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 126.544 1.938 . . . . 3.1099999999999999 115.766 177.866 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.597 HD12 ' H ' ' A' ' 44' ' ' LEU . 5.0 mp -60.67 -21.51 62.9 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.417 1.887 . . . . 4.0199999999999996 112.8 162.333 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 119.26 14.87 5.75 Favored Glycine 0 N--CA 1.473 1.163 0 C-N-CA 126.335 1.921 . . . . 2.9100000000000001 114.552 175.929 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -88.06 -174.28 4.61 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.291 0.848 . . . . 5.54 113.291 -174.069 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 77.07 -8.05 1.75 Allowed 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.994 1.85 . . . . 3.1000000000000001 115.994 154.575 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.2 mptt -8.82 114.51 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 130.075 3.35 . . . . 6.0199999999999996 114.92 178.405 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -9.91 -56.12 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 130.656 3.582 . . . . 4.4500000000000002 119.891 -149.007 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.1 t -77.57 -17.35 57.95 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.855 1.057 . . . . 2.9399999999999999 113.855 -178.036 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.9 t -75.41 -10.65 59.64 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.0 1.273 . . . . 2.1600000000000001 112.08 173.554 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 70.3 mt -73.98 -27.41 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.693 1.197 . . . . 1.3700000000000001 111.483 161.095 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -91.98 -30.29 16.17 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.672 0.789 . . . . 3.6800000000000002 112.339 -174.384 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -68.44 -37.82 80.59 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.436 -0.79 . . . . 2.29 111.507 161.739 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 58.8 tp -57.49 -46.72 83.41 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 116.747 -1.596 . . . . 1.6899999999999999 110.574 168.706 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.8 mtp -51.35 -48.5 62.45 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 121.239 1.836 . . . . 1.8200000000000001 112.248 173.596 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.68 -21.26 62.64 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.413 1.485 . . . . 3.9199999999999999 113.005 175.975 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -82.22 -39.14 23.51 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 120.51 -1.369 . . . . 1.8200000000000001 113.476 167.326 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 84.4 mt -83.77 -37.43 22.63 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.4 1.48 . . . . 2.0899999999999999 114.771 -172.808 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.428 ' C ' ' HE2' ' A' ' 61' ' ' LYS . 7.2 t70 -79.1 129.04 34.03 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.605 0.717 . . . . 2.54 110.419 177.568 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.428 ' HE2' ' C ' ' A' ' 60' ' ' ASP . 0.8 OUTLIER -101.69 -17.52 16.26 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.6 0.76 . . . . 3.3799999999999999 112.741 178.125 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.7 m120 -95.27 -26.03 16.1 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 115.097 1.518 . . . . 2.3700000000000001 115.097 -170.745 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.6 m 61.61 36.42 16.73 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.735 1.614 . . . . 2.3599999999999999 111.48 -163.334 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 48.4 p30 -92.34 -11.93 33.73 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 127.134 2.174 . . . . 2.4100000000000001 111.828 178.039 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 65.4 18.46 11.33 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 128.758 2.823 . . . . 5.3899999999999997 113.053 -177.153 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -139.18 139.43 37.55 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 122.703 1.239 . . . . 3.0600000000000001 112.377 170.26 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 1.9 mt -98.19 97.82 6.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 124.074 0.95 . . . . 1.8 109.644 -171.531 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -47.64 143.56 3.74 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 127.814 2.445 . . . . 2.3900000000000001 110.665 162.393 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -47.08 -36.99 8.88 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 122.196 0.998 . . . . 2.5299999999999998 112.337 172.619 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -69.79 -29.59 66.93 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.088 1.755 . . . . 3.0800000000000001 114.346 175.965 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.416 ' O ' HG12 ' A' ' 74' ' ' VAL . 51.2 mt-10 -74.13 -54.73 7.19 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 108.324 -0.991 . . . . 1.8999999999999999 108.324 166.418 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -53.99 -25.61 21.86 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 127.063 2.145 . . . . 1.96 114.627 -178.552 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.3 t -62.07 -31.9 72.38 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.767 -1.208 . . . . 1.6299999999999999 111.714 173.027 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.416 HG12 ' O ' ' A' ' 71' ' ' GLU . 2.0 p -74.61 -23.83 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-N 119.635 1.107 . . . . 2.0499999999999998 112.123 -177.483 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -63.65 -50.74 68.08 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.131 0.972 . . . . 2.04 110.115 169.466 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 44.7 mt -59.38 -41.47 89.44 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.394 1.078 . . . . 1.8500000000000001 111.161 177.24 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 88.0 m -58.96 -52.51 65.47 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.314 1.046 . . . . 0.90000000000000002 111.72 171.726 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 36.1 mtp -56.53 -45.94 80.88 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.839 0.855 . . . . 1.8600000000000001 112.281 179.275 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 92.7 mt -62.63 -47.07 85.34 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 123.338 0.655 . . . . 1.3700000000000001 111.488 177.179 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 79.1 m -64.45 -34.88 79.22 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.543 0.942 . . . . 1.76 113.543 178.564 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.5 mmm -65.67 -42.51 91.24 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 118.009 0.368 . . . . 2.3700000000000001 111.065 174.598 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.24 -35.8 78.48 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.761 -0.638 . . . . 1.1599999999999999 112.308 179.769 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -76.98 -30.23 55.86 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.187 1.18 . . . . 2.5099999999999998 114.187 177.683 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -58.55 -49.44 77.42 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.987 0.812 . . . . 2.1200000000000001 110.926 167.936 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.44 -33.13 75.02 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.107 1.363 . . . . 4.5999999999999996 111.84 178.292 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -59.98 -45.51 92.47 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.86 1.264 . . . . 2.48 112.625 174.468 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -63.26 -34.13 77.0 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.867 1.267 . . . . 2.6600000000000001 111.922 177.058 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 71.2 mt -74.68 -7.84 54.51 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.222 1.409 . . . . 2.5699999999999998 113.477 178.166 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -101.38 -1.09 34.22 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.217 1.407 . . . . 3.5699999999999998 114.139 170.518 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -121.03 -65.02 1.18 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.844 1.658 . . . . 3.5699999999999998 111.977 179.13 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -79.72 48.12 0.91 Allowed 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 126.768 2.027 . . . . 3.6499999999999999 111.047 172.316 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.6 ptmt . . . . . 0 C--O 1.249 1.035 0 C-N-CA 128.402 2.681 . . . . 6.1600000000000001 115.237 -170.279 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mmt . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 107.813 -1.18 . . . . 6.1900000000000004 107.813 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 20.3 mp0 -115.69 -90.63 0.54 Allowed 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 107.57 -1.27 . . . . 4.8200000000000003 107.57 -153.875 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . 0.552 HG23 ' H ' ' B' ' 6' ' ' GLU . 4.7 t -163.17 152.98 13.08 Favored Pre-proline 0 C--O 1.236 0.362 0 C-N-CA 126.732 2.013 . . . . 3.2400000000000002 108.01 -179.68 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -63.74 -16.68 56.18 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 121.726 1.618 . . . . 1.7 112.22 167.58 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 24.8 tp -68.38 -50.65 51.48 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.64 1.109 . . . . 2.8999999999999999 112.204 -177.111 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . 0.552 ' H ' HG23 ' B' ' 3' ' ' THR . 2.6 tm-20 -47.95 -54.58 12.33 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.055 1.342 . . . . 4.0300000000000002 110.63 167.303 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -70.34 -26.33 63.7 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.496 -0.752 . . . . 4.8499999999999996 112.278 -171.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.61 -38.93 74.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.894 1.278 . . . . 0.93000000000000005 111.933 170.623 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.93 -44.24 81.18 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.897 1.226 . . . . 1.8899999999999999 110.388 171.906 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 59.1 m -55.6 -43.46 76.05 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.616 1.566 . . . . 1.8799999999999999 111.991 172.232 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.15 -32.12 58.93 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 121.036 -1.04 . . . . 1.77 113.17 175.949 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -55.98 -49.07 74.62 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.959 1.254 . . . . 3.2799999999999998 110.218 167.755 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 29.9 t -59.21 -30.6 44.26 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 C-N-CA 124.938 1.295 . . . . 2.25 112.906 172.152 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 29.8 m -71.39 -45.49 62.66 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 120.881 -1.137 . . . . 0.82999999999999996 111.785 175.483 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.22 -32.29 64.29 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.923 0.783 . . . . 1.8899999999999999 110.248 167.604 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -64.06 -58.24 7.25 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 118.473 -0.775 . . . . 2.0499999999999998 110.563 179.632 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 47.2 m-70 -57.23 -43.94 83.35 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 120.589 1.54 . . . . 4.5499999999999998 112.184 178.494 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -56.71 -36.8 70.08 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.086 1.354 . . . . 5.21 113.961 -177.794 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -108.87 -34.11 6.75 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.725 1.009 . . . . 2.3100000000000001 113.725 -179.308 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -67.96 -27.5 66.65 Favored 'General case' 0 C--O 1.249 1.067 0 C-N-CA 125.251 1.42 . . . . 1.75 111.774 175.463 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.81 4.51 60.8 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 128.119 2.771 . . . . 1.8100000000000001 115.222 177.551 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 17.9 mtp180 -78.83 -113.1 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.117 1.459 . . . . 4.1600000000000001 110.575 172.496 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.51 -178.16 1.7 Allowed 'General case' 0 C--O 1.248 0.979 0 C-N-CA 124.954 1.302 . . . . 3.9199999999999999 113.018 178.144 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 62.97 -145.73 50.17 Favored Glycine 0 C--N 1.34 0.783 0 C-N-CA 125.036 1.303 . . . . 2.1600000000000001 111.531 171.412 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.6 m -66.51 153.37 43.09 Favored 'General case' 0 C--O 1.248 0.984 0 CA-C-O 123.723 1.725 . . . . 3.6600000000000001 110.31 155.28 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -82.71 -4.05 57.29 Favored 'General case' 0 CA--C 1.552 1.048 0 O-C-N 120.364 -1.46 . . . . 6.9100000000000001 113.555 175.593 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 4.9 mp -103.04 0.39 31.97 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 128.175 2.59 . . . . 3.5499999999999998 112.592 171.924 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 81.9 p -132.13 157.57 43.89 Favored 'General case' 0 C--O 1.245 0.846 0 C-N-CA 125.356 1.462 . . . . 1.1299999999999999 112.0 -178.562 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -95.29 128.45 42.14 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.395 1.478 . . . . 2.1299999999999999 110.552 167.229 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 23.0 t -101.1 171.99 7.28 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.27 1.428 . . . . 2.0 112.062 162.754 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 48.6 ttm-85 -58.87 -20.29 49.85 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.986 1.714 . . . . 3.8500000000000001 114.96 -165.143 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -95.74 -39.8 9.68 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.46 1.482 . . . . 5.7999999999999998 113.791 169.704 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -46.48 -44.87 17.92 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.224 1.01 . . . . 1.73 111.806 168.679 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 8.6 tp -77.67 -44.65 27.38 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 119.44 -0.314 . . . . 2.1200000000000001 111.687 -175.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . 0.465 ' HG2' HG21 ' B' ' 52' ' ' ILE . 52.3 mttm -54.87 -46.38 74.71 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 118.858 0.754 . . . . 3.1299999999999999 111.662 172.837 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -56.54 -53.92 51.95 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 123.852 0.72 . . . . 2.9300000000000002 111.469 174.379 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 64.0 tp -56.6 -57.67 11.36 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 125.26 1.424 . . . . 2.2999999999999998 112.375 -177.109 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 34.5 mt -56.95 -39.24 64.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.87 0.868 . . . . 1.53 110.268 179.225 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -68.62 -9.25 48.68 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 120.689 -1.257 . . . . 4.0700000000000003 113.768 -176.387 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -104.8 -60.72 1.56 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.067 0.947 . . . . 3.7799999999999998 109.219 164.107 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -82.6 67.3 8.6 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 127.473 2.309 . . . . 5.6600000000000001 110.543 -176.578 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -173.73 29.58 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 127.861 2.465 . . . . 2.6899999999999999 111.075 166.878 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 33.5 t -50.96 -16.25 0.41 Allowed 'General case' 0 CA--C 1.557 1.246 0 N-CA-C 117.71 2.485 . . . . 3.46 117.71 -159.688 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.482 HD23 ' H ' ' B' ' 44' ' ' LEU . 1.9 pt? -96.93 -7.4 33.32 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 116.226 1.936 . . . . 3.4700000000000002 116.226 174.459 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -110.35 105.96 2.04 Favored Glycine 0 N--CA 1.469 0.882 0 C-N-CA 125.148 1.356 . . . . 3.71 112.547 -175.751 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -75.4 84.95 2.53 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-O 122.247 1.023 . . . . 6.0099999999999998 111.218 179.17 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 8.0 mmt -84.93 117.87 24.19 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 126.378 1.871 . . . . 3.2799999999999998 113.093 -178.289 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -70.71 140.94 51.55 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.892 1.277 . . . . 3.1600000000000001 110.126 171.431 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -53.21 -47.94 68.54 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 114.333 1.235 . . . . 3.8700000000000001 114.333 -168.147 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 15.4 t -70.83 -19.31 62.67 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.025 1.12 . . . . 4.2400000000000002 114.025 178.835 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 38.0 m -76.12 -18.92 58.93 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 120.884 -1.135 . . . . 3.9399999999999999 111.884 172.35 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . 0.465 HG21 ' HG2' ' B' ' 35' ' ' LYS . 11.9 mm -66.28 -34.22 68.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 118.828 0.74 . . . . 1.75 110.908 167.531 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -78.31 -21.88 48.99 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.044 0.838 . . . . 3.75 113.13 -177.83 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.636 ' HA ' ' HE3' ' B' ' 57' ' ' LYS . 9.8 t70 -77.78 -41.19 38.28 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 118.438 0.563 . . . . 2.71 111.357 166.23 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 50.7 tp -59.98 -48.31 82.21 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-O 118.411 -0.804 . . . . 2.3599999999999999 111.227 173.143 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 2.5 ppp? -59.93 -40.46 89.0 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.203 0.91 . . . . 2.1600000000000001 110.187 -179.493 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . 0.636 ' HE3' ' HA ' ' B' ' 54' ' ' ASP . 11.7 ttpp -61.51 -36.06 79.47 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.099 1.76 . . . . 3.3599999999999999 113.227 172.6 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 5.6 t -75.16 -34.06 61.55 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.844 -1.16 . . . . 1.97 111.581 176.417 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 70.9 mt -69.09 -34.26 74.83 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 117.437 -1.268 . . . . 1.8500000000000001 111.389 170.568 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -96.8 90.34 5.22 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.474 1.51 . . . . 1.99 113.919 -179.339 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . 0.412 ' H ' ' HD2' ' B' ' 61' ' ' LYS . 3.8 mptt -67.18 -19.8 65.63 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.904 1.281 . . . . 3.6600000000000001 113.28 -178.732 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . 0.4 ' HB2' ' H ' ' B' ' 64' ' ' ASP . 1.7 m120 -78.7 -31.76 46.67 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.161 0.892 . . . . 2.3100000000000001 112.886 173.065 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 12.5 t 63.51 24.03 13.89 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.951 1.3 . . . . 2.8900000000000001 113.637 -159.29 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . 0.4 ' H ' ' HB2' ' B' ' 62' ' ' ASN . 54.3 p-10 -81.57 -18.43 44.89 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.496 1.518 . . . . 2.5899999999999999 112.52 176.477 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 76.88 1.53 3.23 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 131.504 3.921 . . . . 4.3600000000000003 113.186 179.066 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -92.77 112.8 24.88 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 125.465 1.506 . . . . 2.4199999999999999 107.109 164.503 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 2.7 mt -97.65 107.46 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 O-C-N 121.045 -1.035 . . . . 1.5 109.816 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -56.71 154.04 9.64 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.487 1.115 . . . . 3.7400000000000002 110.272 173.691 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -49.4 -46.11 47.0 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 120.727 -1.233 . . . . 2.4199999999999999 110.842 163.176 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -53.28 -31.18 42.54 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 127.958 2.503 . . . . 4.0599999999999996 115.319 173.054 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -87.19 -53.69 4.71 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.476 1.511 . . . . 1.75 109.371 176.84 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -58.42 -31.28 67.57 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 129.12 2.968 . . . . 2.3399999999999999 113.982 -177.54 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 23.3 t -56.74 -23.16 40.72 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 120.703 1.592 . . . . 2.3900000000000001 112.837 178.786 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 78.2 t -64.79 -25.71 38.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 124.051 0.94 . . . . 1.47 112.011 176.423 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -57.2 -53.16 61.29 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.489 1.516 . . . . 2.3999999999999999 110.803 169.206 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 25.7 mt -57.93 -43.48 86.32 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.18 1.392 . . . . 1.3500000000000001 109.985 179.387 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 65.3 m -58.26 -53.08 62.36 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 117.807 -1.092 . . . . 0.84999999999999998 111.478 176.654 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 78.6 mtm -57.1 -47.76 80.28 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.602 1.092 . . . . 1.6000000000000001 112.019 -179.536 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 84.0 mt -68.68 -39.45 80.58 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.786 0.834 . . . . 1.6200000000000001 112.677 -178.174 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.8 t -73.16 -31.83 64.49 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.645 -0.659 . . . . 1.6499999999999999 111.877 177.66 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 47.6 mtt -63.77 -43.74 95.48 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.787 0.721 . . . . 2.8399999999999999 110.994 169.637 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.2 -37.53 85.68 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.412 0.523 . . . . 0.68999999999999995 112.412 176.349 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -70.07 -35.77 74.47 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.612 0.967 . . . . 2.3100000000000001 113.612 172.645 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -65.88 -37.4 86.03 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 119.306 0.957 . . . . 2.6200000000000001 112.28 175.199 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -68.19 -42.37 80.01 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.337 1.055 . . . . 2.6499999999999999 111.983 173.028 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -52.51 -43.97 65.42 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.912 1.285 . . . . 2.3500000000000001 112.185 175.758 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -63.08 -25.74 68.51 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.809 1.643 . . . . 2.4300000000000002 112.438 179.023 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 39.4 mt -85.3 -12.33 52.6 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.638 1.175 . . . . 2.1499999999999999 113.072 178.158 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.485 ' CD ' ' HZ2' ' B' ' 92' ' ' LYS . 14.3 mm-40 -93.19 -8.11 43.35 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.277 1.831 . . . . 3.6000000000000001 114.234 169.307 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -89.44 -46.93 8.34 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.836 2.055 . . . . 4.1299999999999999 111.425 169.801 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -71.17 0.27 8.17 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.433 1.493 . . . . 3.8100000000000001 114.848 -172.003 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . 0.485 ' HZ2' ' CD ' ' B' ' 89' ' ' GLU . 16.7 pttm . . . . . 0 C--O 1.249 1.033 0 N-CA-C 117.186 2.291 . . . . 5.2000000000000002 117.186 -168.464 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.6 mtm . . . . . 0 N--CA 1.475 0.789 0 N-CA-C 107.829 -1.175 . . . . 6.1699999999999999 107.829 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -110.1 -98.34 0.4 Allowed 'General case' 0 CA--C 1.536 0.415 0 O-C-N 125.467 1.729 . . . . 3.52 109.541 -153.218 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.455 HG21 ' HA ' ' B' ' 41' ' ' GLU . 67.1 p -133.96 157.86 76.74 Favored Pre-proline 0 N--CA 1.471 0.619 0 C-N-CA 124.463 1.105 . . . . 1.49 111.1 -169.571 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.99 -21.54 32.27 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 122.305 2.004 . . . . 1.4199999999999999 112.216 176.7 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.24 -44.56 52.56 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.479 1.111 . . . . 2.2999999999999998 110.886 176.45 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -67.15 -33.63 75.84 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.451 -0.781 . . . . 4.0 111.7 170.134 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -62.97 -35.9 81.72 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 119.957 -1.714 . . . . 5.9400000000000004 112.037 168.765 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.59 -56.17 17.98 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 120.405 1.457 . . . . 1.1299999999999999 110.954 176.451 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 70.2 mt -57.58 -39.97 77.97 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.567 1.147 . . . . 1.48 112.847 -178.384 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 19.7 p -67.3 -39.17 85.9 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 117.83 -1.081 . . . . 2.4300000000000002 112.097 174.089 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.0 m -65.48 -32.51 74.17 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.375 0.989 . . . . 1.5 111.562 179.921 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -55.34 -57.12 13.13 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 118.227 0.467 . . . . 3.5499999999999998 110.016 168.91 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 74.9 t -60.93 -37.79 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.024 0.53 . . . . 1.9299999999999999 111.797 -176.573 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.7 m -56.26 -57.92 10.18 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.216 1.006 . . . . 1.0700000000000001 111.424 175.974 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.74 -28.45 55.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 118.688 -0.672 . . . . 2.9700000000000002 110.885 -170.749 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -63.05 -41.55 99.52 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.855 1.662 . . . . 1.8500000000000001 112.596 173.892 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 18.7 m170 -66.14 -20.93 66.3 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.756 1.021 . . . . 2.2200000000000002 113.756 175.873 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -65.34 -36.76 85.0 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.77 1.168 . . . . 5.1600000000000001 111.906 172.545 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -102.81 -38.46 7.41 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 114.176 1.176 . . . . 2.1899999999999999 114.176 -170.292 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.3 t -59.02 -32.87 70.12 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 120.106 1.321 . . . . 1.95 112.686 179.61 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -93.56 34.16 4.76 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 126.845 2.164 . . . . 1.3200000000000001 113.95 179.705 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.41 52.76 0.28 Allowed 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.202 1.501 . . . . 4.0899999999999999 110.089 162.912 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . 0.254 6.3 tp10 -6.53 -92.99 0.0 OUTLIER 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.854 1.057 . . . . 9.5399999999999991 113.854 -114.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 43.24 63.47 2.06 Favored Glycine 0 C--N 1.34 0.798 0 C-N-CA 124.71 1.148 . . . . 3.71 110.979 172.255 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.9 t 66.25 141.08 0.03 OUTLIER 'General case' 0 C--O 1.25 1.125 0 C-N-CA 125.745 1.618 . . . . 2.96 113.361 -175.309 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.4 tttp -127.59 117.5 22.15 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.133 1.373 . . . . 4.5599999999999996 110.608 -154.556 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 97.45 -17.27 0.06 Allowed 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 130.419 3.488 . . . . 4.1299999999999999 110.513 -163.27 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 47.3 p -109.74 156.63 20.06 Favored 'General case' 0 C--O 1.245 0.86 0 C-N-CA 125.939 1.695 . . . . 1.28 112.348 176.564 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -109.58 105.42 14.72 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 125.764 1.625 . . . . 2.4199999999999999 109.651 169.85 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.4 t -64.77 159.59 22.03 Favored 'General case' 0 C--N 1.318 -0.763 0 O-C-N 121.955 -0.465 . . . . 2.2999999999999998 111.304 168.749 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.4 ttp85 -45.34 -40.09 7.46 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.56 1.544 . . . . 4.0700000000000003 115.014 -175.305 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 24.6 tptp -52.7 -57.92 8.54 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 119.203 -2.186 . . . . 5.0800000000000001 115.217 163.791 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -61.76 -41.33 97.54 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.558 1.543 . . . . 1.8300000000000001 109.715 -167.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.37 -43.03 95.79 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.717 1.207 . . . . 2.54 111.668 177.443 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -63.57 -44.33 94.42 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.539 -1.351 . . . . 4.9400000000000004 111.61 176.989 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -59.17 -44.5 92.15 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.668 0.787 . . . . 4.3899999999999997 112.504 176.352 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.3 tt -58.16 -54.31 48.44 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.226 1.41 . . . . 1.8400000000000001 111.324 176.566 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 27.6 mt -58.78 -46.17 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 119.0 0.818 . . . . 1.21 109.87 -175.45 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -72.93 -3.33 25.16 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.987 1.106 . . . . 4.0300000000000002 113.987 -174.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 56.6 mmtt -99.22 -49.89 4.32 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.346 1.858 . . . . 3.1800000000000002 111.534 168.392 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.505 ' HA ' HG21 ' B' ' 3' ' ' THR . 1.1 mp0 -75.04 -48.44 23.99 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.162 0.985 . . . . 5.4500000000000002 112.244 -173.89 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -89.59 -48.46 7.28 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.966 1.306 . . . . 2.8100000000000001 110.202 176.329 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 9.7 t 75.66 -40.59 0.42 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 128.1 2.56 . . . . 4.4500000000000002 113.673 -175.314 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -38.97 135.19 0.92 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.183 1.793 . . . . 5.3099999999999996 114.598 -169.71 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -81.85 -23.04 58.54 Favored Glycine 0 N--CA 1.477 1.384 0 C-N-CA 125.273 1.416 . . . . 4.54 111.514 169.432 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -57.04 -16.65 7.64 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 127.923 2.489 . . . . 6.1200000000000001 112.563 169.041 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 9.9 tpt -66.57 -28.04 68.21 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.642 1.577 . . . . 4.96 113.377 169.683 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.42 109.51 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 130.078 3.351 . . . . 8.3499999999999996 112.382 -171.139 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -50.04 -52.32 35.28 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.985 1.714 . . . . 5.3099999999999996 114.147 -170.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.9 t -73.11 -15.35 61.48 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 120.098 -1.626 . . . . 3.46 114.005 177.643 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 20.1 t -75.5 -10.48 59.49 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.661 1.118 . . . . 3.27 112.393 169.391 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 82.2 mt -70.92 -29.49 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-N 119.103 0.865 . . . . 1.4099999999999999 111.278 172.795 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.25 -32.51 70.06 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 118.775 0.716 . . . . 3.2000000000000002 111.38 174.537 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -81.38 -40.07 24.05 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.862 1.265 . . . . 2.6099999999999999 112.862 176.366 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.4 tt -66.26 -42.57 88.3 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 117.767 -1.111 . . . . 2.0099999999999998 111.503 176.493 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.0 ppp? -65.04 -40.42 94.77 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.592 1.087 . . . . 2.04 110.084 177.013 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.48 -38.97 82.21 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.068 0.947 . . . . 3.52 112.375 172.173 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.3 t -57.98 -27.09 63.15 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.773 1.17 . . . . 2.4100000000000001 113.963 176.139 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 12.5 mt -74.27 -24.84 59.33 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.339 -0.85 . . . . 2.0 112.372 178.584 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -102.31 115.64 30.98 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.58 1.552 . . . . 2.3700000000000001 111.685 -154.702 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -81.5 -14.04 57.42 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.133 1.16 . . . . 3.8900000000000001 114.133 -169.585 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 36.9 p-10 -124.49 -10.56 7.4 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.519 1.528 . . . . 1.95 113.963 -178.097 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.3 m 58.57 42.27 21.01 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.516 1.527 . . . . 3.2000000000000002 111.861 -173.577 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.4 p30 -72.98 -29.24 62.9 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.073 1.749 . . . . 2.3599999999999999 111.347 -175.896 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 114.76 -6.2 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.456 1 C-N-CA 135.225 5.41 . . . . 4.4000000000000004 113.431 175.795 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -132.54 129.36 38.96 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.021 1.728 . . . . 4.1299999999999999 110.812 -168.506 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 10.6 mm -92.46 99.9 10.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 126.076 1.75 . . . . 1.0700000000000001 108.979 -173.02 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.92 161.91 6.07 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.727 2.011 . . . . 3.1600000000000001 111.467 165.624 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.404 ' CE1' ' HB3' ' B' ' 80' ' ' CYS . 0.3 OUTLIER -55.78 -43.0 76.35 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.658 -1.276 . . . . 2.2599999999999998 113.318 -177.537 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.558 ' HE2' ' SD ' ' B' ' 81' ' ' MET . 3.4 mtmt -73.3 -19.23 61.09 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 120.502 -1.374 . . . . 3.1000000000000001 112.964 176.415 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -69.25 -56.46 7.51 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 107.85 -1.167 . . . . 2.1000000000000001 107.85 166.074 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -58.03 -28.94 64.93 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 127.915 2.486 . . . . 2.1099999999999999 114.844 -177.976 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 53.1 m -53.04 -30.15 33.97 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 120.456 -1.402 . . . . 1.6799999999999999 113.048 168.122 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 97.8 t -65.58 -31.89 55.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 CA-C-N 120.251 1.387 . . . . 2.04 111.559 179.094 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -67.28 -51.56 51.4 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.122 0.969 . . . . 1.8300000000000001 109.473 176.396 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 59.9 mt -57.62 -37.1 72.7 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.859 1.264 . . . . 1.6200000000000001 111.647 174.253 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 28.0 m -66.48 -48.83 68.62 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.758 0.823 . . . . 0.87 111.023 176.082 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 19.4 ttp -62.93 -47.08 84.78 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.969 0.907 . . . . 2.4900000000000002 111.656 -177.038 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 97.4 mt -65.73 -43.41 89.13 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.318 0.647 . . . . 1.3200000000000001 112.203 177.385 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 7.7 t -65.21 -32.83 74.7 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 119.689 1.131 . . . . 1.8700000000000001 112.691 177.158 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 27.5 mtp -68.18 -34.62 76.63 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 118.689 -0.672 . . . . 1.78 112.546 170.864 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.63 -40.65 88.85 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.627 1.103 . . . . 0.94999999999999996 112.42 173.244 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -61.78 -24.6 66.94 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 113.56 0.948 . . . . 2.0099999999999998 113.56 172.002 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -72.95 -41.21 64.68 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.537 1.062 . . . . 2.0899999999999999 112.682 172.3 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -66.66 -37.57 85.07 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 118.569 0.622 . . . . 2.79 111.084 179.23 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.96 -55.43 23.55 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.968 1.307 . . . . 2.23 111.322 167.8 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -58.02 -26.73 62.8 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.263 1.425 . . . . 2.3500000000000001 113.127 -176.898 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 76.0 mt -75.64 -20.56 58.42 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.625 1.17 . . . . 1.51 113.657 175.454 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -91.52 -37.14 13.32 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.967 0.907 . . . . 3.52 113.359 169.067 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -62.75 -28.82 70.23 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.278 1.431 . . . . 3.5099999999999998 114.197 -175.845 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -88.91 -3.53 58.71 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.366 1.066 . . . . 2.9100000000000001 113.469 -176.596 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . 0.285 0.0 OUTLIER . . . . . 0 C--O 1.246 0.899 0 CA-C-O 116.055 -1.926 . . . . 3.9199999999999999 112.171 -155.709 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.911 0 N-CA-C 108.332 -0.988 . . . . 5.5899999999999999 108.332 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -138.61 148.15 43.76 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 126.957 2.103 . . . . 4.21 106.008 -164.735 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . 0.505 HG21 ' HA ' ' A' ' 41' ' ' GLU . 72.4 p -59.04 162.92 6.4 Favored Pre-proline 0 N--CA 1.474 0.738 0 C-N-CA 123.708 0.803 . . . . 2.29 111.999 170.889 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -71.69 -17.18 29.77 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 121.944 1.762 . . . . 1.4399999999999999 113.371 -178.43 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tt -65.02 -39.04 92.81 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.402 1.001 . . . . 3.1099999999999999 111.57 176.081 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -60.24 -42.73 95.87 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.694 0.759 . . . . 4.9199999999999999 111.424 174.178 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -67.15 -29.88 69.71 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.065 -1.022 . . . . 4.4000000000000004 112.626 175.631 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.33 -42.99 82.67 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.734 1.214 . . . . 0.81999999999999995 110.744 171.837 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.83 -38.45 90.8 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.267 -0.895 . . . . 1.4399999999999999 112.026 173.92 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.15 -43.46 95.72 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.075 -1.016 . . . . 1.3100000000000001 111.286 171.187 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 93.8 m -57.62 -38.78 75.55 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.783 1.233 . . . . 1.23 111.425 -178.702 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -59.75 -38.83 82.86 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.758 1.022 . . . . 3.7200000000000002 113.758 172.87 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 21.1 t -69.88 -31.81 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 CA-C-N 119.627 1.103 . . . . 2.23 111.259 175.559 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 44.6 m -77.85 -30.28 50.9 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 126.947 2.099 . . . . 1.29 113.327 -174.807 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 12.7 p -78.13 -29.58 48.92 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.164 0.893 . . . . 1.6699999999999999 110.612 162.502 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.77 -57.29 13.3 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 118.261 0.482 . . . . 2.0600000000000001 110.59 -175.872 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 14.0 m80 -68.7 -8.62 44.3 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.673 1.36 . . . . 2.25 114.673 174.986 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -75.42 -49.97 17.28 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 120.903 -1.123 . . . . 4.1900000000000004 111.332 169.55 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -93.77 -23.99 17.97 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.185 0.994 . . . . 2.0 113.67 -174.104 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 97.6 p -65.59 -11.65 46.13 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 115.865 1.802 . . . . 2.8799999999999999 115.865 -175.578 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.79 -0.2 83.98 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-O 117.457 -1.746 . . . . 2.7999999999999998 114.344 171.769 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -62.43 -31.36 72.05 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 120.496 2.148 . . . . 3.3300000000000001 112.66 178.733 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -177.51 -148.84 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 128.71 2.804 . . . . 3.2200000000000002 108.939 165.385 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 26.29 87.43 0.01 OUTLIER Glycine 0 N--CA 1.477 1.376 0 C-N-CA 128.459 2.933 . . . . 4.3499999999999996 113.551 167.464 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 6.0 m 43.58 150.17 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 129.331 3.052 . . . . 3.4399999999999999 117.104 -172.001 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 71.8 tttt -80.32 -12.38 59.61 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 119.503 -1.998 . . . . 6.9299999999999997 113.579 179.53 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 62.7 tp -71.85 -54.56 9.71 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 119.265 0.939 . . . . 3.2200000000000002 109.828 164.058 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 35.8 p -93.94 162.43 13.9 Favored 'General case' 0 C--O 1.254 1.301 0 C-N-CA 125.503 1.521 . . . . 1.3200000000000001 114.832 -159.059 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 24.6 mt -105.87 86.59 2.41 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.422 2.289 . . . . 1.76 111.024 173.401 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 7.9 t -71.72 -178.41 2.25 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 119.768 -1.832 . . . . 2.9300000000000002 112.288 170.353 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -41.06 -60.2 1.28 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.634 1.574 . . . . 4.6900000000000004 114.758 -163.794 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.69 -32.7 58.06 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 120.12 1.327 . . . . 4.46 112.147 -174.398 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -52.5 -52.2 55.65 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.558 1.543 . . . . 1.8600000000000001 111.539 172.458 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.65 -48.21 80.32 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.919 1.288 . . . . 2.3999999999999999 111.748 -178.663 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -57.25 -46.14 83.3 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 121.018 -1.051 . . . . 4.5300000000000002 112.892 177.842 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -57.41 -47.57 81.38 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 118.074 -0.965 . . . . 3.0699999999999998 113.03 175.287 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.47 -53.09 40.86 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.619 1.168 . . . . 1.79 111.654 175.227 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 38.6 mt -55.78 -52.49 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 CA-C-N 118.949 0.795 . . . . 1.0700000000000001 109.18 177.581 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -66.94 -10.57 50.49 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 114.043 1.127 . . . . 4.8399999999999999 114.043 -174.917 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 34.6 mmtm -95.68 -39.22 10.0 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.584 1.954 . . . . 3.7200000000000002 113.392 176.649 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . 0.455 ' HA ' HG21 ' A' ' 3' ' ' THR . 20.7 mt-10 -118.71 -35.2 3.76 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 118.163 -0.922 . . . . 5.5099999999999998 113.066 -166.34 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -109.19 57.76 0.61 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.528 1.931 . . . . 2.6000000000000001 108.975 171.243 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 76.8 m -54.59 -56.46 18.7 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.061 -0.971 . . . . 4.1299999999999999 113.523 -167.169 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 95.7 mt 59.09 -23.89 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 129.256 3.023 . . . . 4.9199999999999999 118.973 164.437 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.44 -55.92 4.67 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 125.679 1.609 . . . . 3.8500000000000001 112.28 177.914 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -66.83 1.04 2.04 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.989 1.107 . . . . 5.6799999999999997 113.989 171.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.08 57.02 1.72 Allowed 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 125.008 2.337 . . . . 2.46 112.593 172.248 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -87.39 162.62 17.22 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 129.997 3.319 . . . . 4.1900000000000004 110.652 174.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -56.94 -36.46 70.27 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 120.761 -1.212 . . . . 4.0999999999999996 113.5 -173.389 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 7.0 m -72.08 -5.56 36.14 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 116.245 1.943 . . . . 2.9700000000000002 116.245 175.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 62.0 p -107.8 -39.69 5.49 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 120.426 1.466 . . . . 2.0299999999999998 111.516 165.982 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 11.8 mm -56.88 -49.3 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 126.678 1.991 . . . . 1.5600000000000001 113.245 176.759 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -76.31 -22.96 54.35 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.282 0.845 . . . . 3.1800000000000002 113.282 -166.891 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -77.77 -39.66 43.38 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.124 0.569 . . . . 3.7999999999999998 111.494 167.285 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.92 -42.83 90.63 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 122.994 0.518 . . . . 2.3900000000000001 110.537 174.707 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 7.2 tpt -57.77 -53.01 63.06 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.76 2.424 . . . . 1.97 112.137 169.171 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -54.76 -43.81 73.08 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 120.675 -1.266 . . . . 4.7699999999999996 112.646 174.444 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 73.4 m -82.46 -24.63 34.17 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.923 1.289 . . . . 2.1200000000000001 112.35 -171.067 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 mt -60.77 -57.79 11.21 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 126.445 1.898 . . . . 2.7000000000000002 110.942 157.192 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -89.92 65.75 6.73 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.645 1.578 . . . . 1.53 111.508 -168.721 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . 0.465 ' HE2' HG21 ' B' ' 74' ' ' VAL . 55.7 mttm -58.08 -31.91 67.54 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 115.177 1.547 . . . . 3.1499999999999999 115.177 -160.772 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -88.86 -5.49 57.99 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.288 1.218 . . . . 2.04 114.288 176.394 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 11.2 t 61.22 25.64 15.6 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.544 1.938 . . . . 2.29 114.065 178.838 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 55.7 p-10 -72.48 -16.15 61.8 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.838 1.255 . . . . 2.98 111.572 178.675 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 63.97 7.53 3.39 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 130.904 3.682 . . . . 4.4900000000000002 114.815 -177.485 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -89.92 127.73 36.07 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 107.053 -1.462 . . . . 3.0600000000000001 107.053 158.454 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 97.5 mt -111.81 110.35 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 N-CA-C 108.8 -0.815 . . . . 1.3300000000000001 108.8 169.68 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -87.58 164.31 16.16 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 128.577 2.751 . . . . 4.1799999999999997 110.54 166.514 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -43.73 -38.81 3.36 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.704 1.601 . . . . 2.4700000000000002 114.746 171.076 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 tpmt? -65.91 -28.42 68.92 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.04 0.936 . . . . 6.1600000000000001 112.938 179.834 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -85.27 -53.13 5.43 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.83 1.252 . . . . 2.02 109.858 167.517 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -47.63 -38.26 14.34 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 126.802 2.041 . . . . 2.5 114.603 -175.487 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 1.1 t -62.27 -17.13 57.7 Favored 'General case' 0 CA--C 1.549 0.904 0 O-C-N 120.342 -1.474 . . . . 3.1499999999999999 114.345 176.824 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.465 HG21 ' HE2' ' B' ' 61' ' ' LYS . 76.0 t -59.33 -45.1 93.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 O-C-N 120.269 -1.519 . . . . 1.5 110.991 169.75 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -60.29 -51.45 69.49 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.551 0.74 . . . . 1.71 110.249 175.893 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 31.9 mt -55.96 -39.28 71.52 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.745 0.818 . . . . 1.3700000000000001 112.383 176.576 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 95.0 m -60.61 -53.53 56.37 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.759 1.223 . . . . 0.89000000000000001 111.87 176.715 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 33.1 mtm -63.78 -36.33 83.52 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 118.727 0.694 . . . . 1.73 112.399 -177.134 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 82.1 mt -67.77 -45.82 73.81 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.91 0.884 . . . . 1.4199999999999999 111.947 176.814 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . 0.404 ' HB3' ' CE1' ' A' ' 69' ' ' PHE . 61.7 m -59.79 -37.63 79.67 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 118.083 -0.96 . . . . 1.5 112.719 173.744 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . 0.558 ' SD ' ' HE2' ' A' ' 70' ' ' LYS . 21.9 mtp -66.44 -36.25 82.33 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.476 1.034 . . . . 2.5299999999999998 113.204 174.817 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.04 -47.65 73.67 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.856 0.753 . . . . 1.02 111.635 173.999 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -65.01 -30.46 71.44 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.429 0.9 . . . . 2.8100000000000001 113.429 176.354 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -61.84 -52.59 63.54 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 118.983 0.811 . . . . 3.0899999999999999 112.268 174.322 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -61.74 -47.22 86.21 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.229 1.411 . . . . 3.0 111.935 -179.774 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.27 -46.97 69.49 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.517 1.527 . . . . 3.4399999999999999 111.717 177.346 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -61.57 -29.93 70.33 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.347 1.059 . . . . 2.79 112.931 178.133 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 68.4 mt -77.19 -11.88 59.88 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.043 0.937 . . . . 2.3199999999999998 113.24 179.657 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.454 ' O ' ' HE2' ' B' ' 92' ' ' LYS . 24.4 mm-40 -106.13 0.84 25.75 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.54 1.536 . . . . 5.1500000000000004 114.72 170.992 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -110.64 -50.91 2.91 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.235 1.814 . . . . 2.9700000000000002 112.46 -178.406 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -90.38 14.74 12.1 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 125.358 1.463 . . . . 3.8999999999999999 113.623 -177.136 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . 0.454 ' HE2' ' O ' ' B' ' 89' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 115.814 -2.041 . . . . 5.0 115.974 -177.246 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.16 0 CA-C-O 117.606 -1.188 . . . . 8.5399999999999991 109.213 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.67 171.68 14.31 Favored 'General case' 0 C--O 1.239 0.525 0 O-C-N 124.031 0.832 . . . . 5.9400000000000004 109.332 156.365 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.765 HG23 ' H ' ' A' ' 6' ' ' GLU . 3.5 t -55.58 146.91 42.39 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.425 1.49 . . . . 2.2999999999999998 112.751 178.465 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -62.35 -14.75 40.65 Favored 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 122.084 1.856 . . . . 1.72 112.69 169.345 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.401 HD12 HG21 ' B' ' 15' ' ' THR . 1.1 tt -76.99 -34.64 57.52 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.387 0.994 . . . . 2.3500000000000001 111.705 173.313 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.765 ' H ' HG23 ' A' ' 3' ' ' THR . 2.8 tm-20 -59.77 -47.08 87.13 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.618 1.099 . . . . 4.7999999999999998 108.835 166.375 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.42 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -59.03 -27.26 65.3 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.916 -1.115 . . . . 4.0099999999999998 112.685 175.176 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -75.1 -48.56 23.21 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.798 1.239 . . . . 1.1299999999999999 112.589 172.992 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.4 mt -57.99 -42.67 85.62 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.693 1.133 . . . . 1.6200000000000001 111.538 172.479 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 8.2 m -57.36 -51.54 69.0 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.346 1.858 . . . . 1.8600000000000001 111.137 170.555 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.7 m -58.78 -44.22 90.64 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.272 1.396 . . . . 1.51 111.731 178.112 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 5.8 tmm? -55.95 -58.82 6.29 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.615 0.766 . . . . 3.6800000000000002 110.538 172.609 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.1 p -66.78 -26.6 37.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 CA-C-N 119.769 1.168 . . . . 2.1699999999999999 112.931 -177.75 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 98.7 m -60.86 -61.27 2.7 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.399 1.079 . . . . 0.89000000000000001 109.71 175.878 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.78 -31.87 65.19 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-O 118.383 -0.817 . . . . 2.9199999999999999 109.954 -173.746 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -65.11 -50.43 66.12 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.115 0.87 . . . . 2.27 112.547 171.854 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -68.28 -19.69 64.72 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.061 0.846 . . . . 1.98 111.887 -178.05 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.8 mtpp -68.93 -53.47 20.73 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 120.822 -1.174 . . . . 3.5499999999999998 111.928 163.48 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -73.53 -32.75 64.38 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.689 1.366 . . . . 2.5 114.689 -175.981 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.5 p -67.41 -22.37 65.54 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 121.298 1.863 . . . . 2.4100000000000001 112.439 172.736 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.53 -2.68 82.05 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.169 1.366 . . . . 1.7 114.959 171.425 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.415 ' HE ' ' CD ' ' A' ' 36' ' ' GLU . 49.6 tpt85 -64.0 -19.17 64.98 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.53 1.665 . . . . 4.3499999999999996 114.943 -172.222 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -155.68 -178.71 7.48 Favored 'General case' 0 C--O 1.247 0.938 0 C-N-CA 129.701 3.2 . . . . 3.8100000000000001 107.808 165.673 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 24.96 99.41 0.01 OUTLIER Glycine 0 C--N 1.346 1.133 0 C-N-CA 126.946 2.212 . . . . 2.8500000000000001 114.651 149.364 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t 60.28 136.78 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.822 1.649 . . . . 2.71 112.819 -176.931 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -80.5 -9.72 59.76 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.933 1.086 . . . . 5.1500000000000004 113.933 171.244 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 73.9 mt -79.91 -40.0 29.17 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 118.986 0.812 . . . . 3.77 110.597 174.523 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.7 p -121.94 150.18 42.37 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-O 122.877 1.322 . . . . 1.4299999999999999 112.545 -161.645 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.51 120.85 43.05 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 114.041 -1.436 . . . . 2.6299999999999999 111.706 176.888 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.5 p -68.85 169.43 11.5 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.911 1.285 . . . . 2.9199999999999999 113.202 167.636 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 46.2 ttt85 -50.35 -26.77 5.27 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 115.549 1.685 . . . . 4.3799999999999999 115.549 176.656 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.86 -28.71 14.59 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.575 1.324 . . . . 4.3499999999999996 114.575 174.455 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -58.37 -52.44 65.59 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.563 1.074 . . . . 1.6100000000000001 109.021 163.615 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.9 tt -57.01 -45.89 82.73 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 128.142 2.577 . . . . 3.8500000000000001 112.168 175.573 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.3 ttmt -70.38 -38.19 74.67 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 118.692 0.678 . . . . 3.79 111.63 -178.871 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.415 ' CD ' ' HE ' ' A' ' 22' ' ' ARG . 25.2 tt0 -60.1 -47.63 85.09 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 118.265 -0.874 . . . . 4.7800000000000002 111.729 169.097 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 tt -56.17 -59.87 4.31 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.46 1.104 . . . . 2.4399999999999999 110.652 179.289 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.7 mt -63.63 -54.37 33.15 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.523 0 CA-C-O 118.626 -0.702 . . . . 1.55 109.408 -177.843 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.1 ttpp -72.0 -8.24 53.4 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 120.978 1.717 . . . . 4.1900000000000004 114.097 -172.691 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -90.77 -54.28 4.04 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 120.288 1.404 . . . . 4.5599999999999996 112.874 165.365 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -71.91 -33.24 68.14 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.82 1.191 . . . . 5.1100000000000003 111.511 -177.362 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.4 mt -111.53 65.32 0.62 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.81 1.644 . . . . 2.8100000000000001 109.42 163.401 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 15.2 t -75.33 36.12 0.12 Allowed 'General case' 0 CA--C 1.55 0.975 0 O-C-N 120.68 -1.263 . . . . 4.5700000000000003 112.798 172.619 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 31.3 mt -96.23 169.88 9.63 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.488 1.515 . . . . 4.8600000000000003 111.466 -175.398 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.43 -25.44 74.8 Favored Glycine 0 N--CA 1.475 1.278 0 C-N-CA 123.929 0.776 . . . . 3.73 112.502 -179.481 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -59.09 -34.51 72.08 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.752 2.021 . . . . 5.2999999999999998 111.402 173.58 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.53 66.34 2.77 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 124.511 2.101 . . . . 2.6499999999999999 112.878 -172.376 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 ptpp? -72.78 161.95 30.09 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 112.315 -2.22 . . . . 4.6100000000000003 110.692 156.39 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -49.38 -44.91 45.32 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 118.916 0.78 . . . . 5.4000000000000004 112.518 -179.253 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.2 m -61.33 -19.31 61.66 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.797 1.406 . . . . 3.04 114.797 178.558 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.8 m -83.85 -27.18 28.89 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.555 1.071 . . . . 2.6400000000000001 112.675 170.219 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 88.4 mt -80.91 -32.94 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 126.195 1.798 . . . . 2.1099999999999999 111.113 -178.88 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -61.93 -55.84 25.4 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.555 1.142 . . . . 3.8100000000000001 112.028 176.875 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -66.67 -26.16 66.91 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.764 0.653 . . . . 3.3599999999999999 112.764 177.163 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.1 tt -69.95 -38.92 76.28 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.354 -0.841 . . . . 2.9399999999999999 110.657 172.261 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.4 ttt -59.72 -49.59 77.14 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-O 117.85 -1.071 . . . . 2.3799999999999999 111.83 165.515 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -66.08 -22.97 66.43 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 121.171 1.805 . . . . 5.1900000000000004 113.124 179.041 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 29.0 t -81.15 -38.9 26.41 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.035 1.334 . . . . 2.23 112.043 176.545 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 84.3 mt -81.8 -44.98 16.23 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 119.065 0.848 . . . . 1.8100000000000001 112.153 175.593 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -77.51 63.72 2.71 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.96 1.304 . . . . 2.73 111.327 -177.379 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -58.73 -22.31 57.33 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 125.813 1.645 . . . . 4.5800000000000001 113.936 -172.923 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -106.87 0.83 24.22 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 114.703 1.371 . . . . 2.4100000000000001 114.703 173.569 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.5 t 62.0 27.61 16.73 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.868 1.432 . . . . 3.2799999999999998 114.868 169.201 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.3 p-10 -86.69 2.6 48.01 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.171 1.788 . . . . 2.2400000000000002 111.914 -174.742 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.69 1.34 3.96 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 129.813 3.245 . . . . 4.3399999999999999 113.565 -173.802 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -119.59 131.99 55.62 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 123.691 1.71 . . . . 3.25 111.251 -179.392 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 3.6 mp -110.01 106.55 20.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 N-CA-C 107.653 -1.24 . . . . 2.3199999999999998 107.653 171.536 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -79.75 166.06 22.16 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.404 1.481 . . . . 3.4500000000000002 110.923 168.471 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -45.29 -38.26 5.49 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.556 1.142 . . . . 2.1499999999999999 112.817 171.77 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.87 -26.98 68.56 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 115.287 1.588 . . . . 5.29 115.287 177.012 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -90.74 -47.06 7.86 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.488 1.915 . . . . 2.5600000000000001 109.414 170.789 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -57.97 -34.35 69.86 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 126.825 2.05 . . . . 2.5600000000000001 114.399 -173.84 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.6 t -59.21 -18.74 39.43 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.878 1.217 . . . . 1.8799999999999999 112.884 -178.163 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 84.9 t -65.49 -25.35 36.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.804 0.841 . . . . 2.0099999999999998 112.024 172.135 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -63.21 -52.66 61.35 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.071 1.348 . . . . 2.6200000000000001 110.226 173.093 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.1 mt -58.28 -39.7 79.94 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.423 1.089 . . . . 2.2200000000000002 110.06 177.34 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.6 m -62.82 -52.44 63.14 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 117.707 -1.14 . . . . 1.2 112.045 174.254 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 70.2 mtm -55.66 -45.43 77.71 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.876 1.216 . . . . 1.97 111.754 -179.553 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 47.4 mt -76.68 -40.57 48.44 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.806 0.842 . . . . 1.49 112.444 -177.098 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 42.4 t -62.54 -36.66 83.33 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.53 1.059 . . . . 2.04 111.943 171.469 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 83.2 mtp -64.27 -39.46 93.98 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.223 0.92 . . . . 2.1000000000000001 112.149 170.408 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.11 -45.98 82.9 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 119.293 0.951 . . . . 1.0600000000000001 112.164 177.351 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -64.52 -36.12 83.18 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.248 0.833 . . . . 2.48 113.248 175.136 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.83 -46.33 89.94 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.016 0.825 . . . . 2.4900000000000002 112.079 174.542 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -67.33 -37.32 83.12 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.953 -0.467 . . . . 2.8500000000000001 111.163 -177.943 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.93 -54.98 26.96 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.027 1.331 . . . . 2.04 111.053 169.727 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -60.84 -30.66 70.24 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.318 1.047 . . . . 2.3999999999999999 112.612 -175.852 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 69.6 mt -74.56 -15.36 60.85 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.042 0.937 . . . . 2.0800000000000001 113.243 176.052 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -97.8 -23.99 15.64 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.295 1.221 . . . . 3.29 114.295 167.633 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -72.47 -30.54 64.64 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.446 1.499 . . . . 4.0099999999999998 113.79 179.966 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -100.65 34.51 2.41 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.89 1.276 . . . . 2.8599999999999999 113.212 -169.559 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt . . . . . 0 C--O 1.252 1.23 0 C-N-CA 127.815 2.446 . . . . 3.3599999999999999 115.809 -173.366 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 15.1 mmt . . . . . 0 N--CA 1.476 0.847 0 N-CA-C 109.042 -0.725 . . . . 8.1999999999999993 109.042 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -90.68 158.54 16.85 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 127.45 2.3 . . . . 6.5800000000000001 109.876 179.975 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.07 154.75 13.95 Favored Pre-proline 0 N--CA 1.471 0.617 0 C-N-CA 129.445 3.098 . . . . 3.0699999999999998 111.559 166.156 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -69.39 -31.59 21.85 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.489 2.126 . . . . 2.8799999999999999 115.237 -156.337 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 8.5 tt -68.67 -54.38 16.61 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 120.351 1.432 . . . . 3.9399999999999999 111.378 171.856 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -57.66 -43.6 85.08 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.718 0.807 . . . . 6.1799999999999997 111.241 -178.545 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.36 -38.03 40.2 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 125.449 1.5 . . . . 4.3300000000000001 112.926 175.371 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.08 -43.58 61.64 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.604 0.761 . . . . 1.1899999999999999 110.409 179.981 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 73.2 mt -60.54 -36.39 78.34 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 123.513 0.725 . . . . 2.0499999999999998 112.088 174.051 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.4 m -55.19 -45.31 75.82 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 118.61 0.641 . . . . 1.48 112.074 170.338 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.4 t -72.35 -29.82 64.16 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.084 -0.96 . . . . 2.04 112.612 179.352 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 43.3 mtp -61.32 -51.61 68.12 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 118.151 -0.928 . . . . 3.0699999999999998 111.529 176.02 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 26.3 m -62.65 -33.28 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 CA-C-N 119.037 0.835 . . . . 2.52 112.15 176.592 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 54.0 m -67.93 -37.94 82.24 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.19 1.396 . . . . 1.03 113.049 -178.224 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . 0.401 HG21 HD12 ' A' ' 5' ' ' LEU . 0.8 OUTLIER -70.59 -38.35 74.0 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 118.798 0.726 . . . . 1.6200000000000001 111.277 165.408 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -65.88 -49.68 67.21 Favored 'General case' 0 N--CA 1.462 0.139 0 O-C-N 123.929 0.768 . . . . 2.0600000000000001 111.439 -167.422 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -64.73 -23.49 67.27 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.903 0.774 . . . . 3.71 112.44 -179.095 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -78.81 -52.04 8.91 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.659 -0.651 . . . . 4.6200000000000001 111.45 178.187 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -66.86 -43.0 84.74 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.069 -1.019 . . . . 2.1200000000000001 112.137 178.181 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 83.8 p -74.9 -16.7 60.65 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.137 1.162 . . . . 1.4099999999999999 114.137 176.491 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.65 -23.56 49.74 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-O 117.683 -1.621 . . . . 1.54 113.748 170.881 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.92 -19.18 60.77 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 119.939 1.87 . . . . 4.6100000000000003 114.037 -165.442 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -124.49 122.67 38.26 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 119.096 0.862 . . . . 3.77 108.875 169.805 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.11 -1.23 2.87 Favored Glycine 0 N--CA 1.477 1.428 0 C-N-CA 127.968 2.699 . . . . 3.1899999999999999 117.793 -144.718 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 52.8 p -56.66 75.74 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.973 0 CA-C-O 121.463 0.649 . . . . 5.5999999999999996 109.885 141.986 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -75.87 118.98 19.23 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 119.657 -1.902 . . . . 6.2999999999999998 111.208 -173.0 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 86.3 mt 96.37 -8.2 0.08 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 130.376 3.47 . . . . 4.5800000000000001 112.751 -179.361 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 45.2 p -108.19 144.09 36.1 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 124.904 1.282 . . . . 1.8899999999999999 111.635 168.047 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 29.1 mt -97.73 114.21 26.16 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.388 1.875 . . . . 1.72 112.527 177.361 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 20.3 p -68.86 167.86 14.72 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.533 1.533 . . . . 3.5600000000000001 113.798 165.292 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -58.58 -0.62 0.11 Allowed 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 115.958 1.836 . . . . 4.0899999999999999 115.958 172.554 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.0 -44.79 3.24 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.577 1.551 . . . . 3.8700000000000001 112.819 169.693 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -54.08 -44.97 71.63 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.478 1.036 . . . . 1.9299999999999999 109.538 171.819 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 56.1 tp -67.6 -44.08 78.95 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.599 1.559 . . . . 2.4100000000000001 112.448 179.449 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -55.39 -43.7 75.44 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.856 -0.592 . . . . 3.3300000000000001 111.147 172.537 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -60.73 -52.92 63.07 Favored 'General case' 0 C--O 1.224 -0.279 0 O-C-N 123.824 0.702 . . . . 2.8399999999999999 110.761 178.085 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.6 tt -59.14 -58.89 6.65 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.668 1.187 . . . . 2.1600000000000001 110.565 -178.534 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 25.7 mt -54.56 -46.47 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 119.304 0.956 . . . . 1.05 110.073 179.159 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -74.32 -17.91 60.78 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 115.111 1.522 . . . . 6.1500000000000004 115.111 -177.354 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -93.15 -14.32 27.34 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.358 1.863 . . . . 3.4199999999999999 112.66 171.811 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -96.54 -37.09 10.53 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.13 1.772 . . . . 5.21 111.537 176.497 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -127.33 120.86 29.52 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.637 1.575 . . . . 2.04 109.446 174.152 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 4.7 t -131.58 -9.42 3.62 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 115.255 1.576 . . . . 3.4500000000000002 115.255 174.088 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -47.46 -16.19 0.06 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 128.654 2.782 . . . . 3.5499999999999998 118.432 175.878 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.88 169.05 12.62 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-N 120.106 1.321 . . . . 3.5699999999999998 114.711 178.295 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 26.0 tp10 62.98 -22.19 0.05 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 129.775 3.23 . . . . 5.5300000000000002 117.203 172.776 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 32.9 tpp -75.74 82.11 2.7 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.459 -1.401 . . . . 2.4700000000000002 111.332 -179.621 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 41.9 mttt -89.45 173.98 8.04 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.668 2.387 . . . . 3.7599999999999998 110.771 179.753 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 44.8 tp10 -48.79 -52.72 22.44 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.856 0.862 . . . . 3.8700000000000001 111.202 171.574 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 2.8 m -64.67 -27.61 69.04 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.372 1.249 . . . . 3.1699999999999999 114.372 177.417 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 3.8 m -74.0 -31.72 63.07 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.399 -0.813 . . . . 2.9399999999999999 111.479 176.828 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 28.9 mm -68.72 -38.47 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.66 0.784 . . . . 1.46 111.11 171.575 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -70.55 -43.68 69.03 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.654 0.983 . . . . 3.3599999999999999 113.654 -167.542 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.99 -27.43 26.45 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 113.474 0.916 . . . . 3.7799999999999998 113.474 175.748 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 60.6 tp -56.22 -48.42 76.49 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 118.661 -0.685 . . . . 2.0 110.199 167.82 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 1.9 ppp? -62.03 -32.17 72.64 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.605 1.093 . . . . 2.79 113.681 -177.154 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 44.9 mttp -65.59 -25.25 67.32 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.041 0.837 . . . . 5.8499999999999996 112.685 174.494 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 7.1 t -92.17 -32.29 15.15 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.928 1.291 . . . . 1.96 113.896 177.007 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 69.3 mt -74.43 -25.44 59.45 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.947 0.899 . . . . 2.1699999999999999 112.81 175.143 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -80.81 121.5 26.02 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 122.457 1.122 . . . . 1.3799999999999999 111.013 174.32 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -85.57 -13.77 47.83 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.059 1.133 . . . . 5.8799999999999999 114.059 -156.533 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 45.5 p-10 -141.95 -6.46 0.97 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.385 2.274 . . . . 2.52 115.324 -169.566 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 68.73 43.59 1.26 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.927 1.291 . . . . 2.27 113.098 -175.086 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 40.0 p30 -87.96 -16.86 32.62 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.941 1.297 . . . . 2.1899999999999999 112.004 165.027 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 70.47 14.78 7.33 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 130.258 3.423 . . . . 6.6900000000000004 114.819 179.099 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -124.26 143.79 50.34 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.362 1.065 . . . . 3.6099999999999999 110.665 161.36 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 6.3 mm -97.34 105.38 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 O-C-N 121.33 -0.856 . . . . 1.4299999999999999 110.143 179.135 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.02 155.69 39.93 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.998 1.319 . . . . 2.8999999999999999 111.437 166.355 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -46.44 -47.2 19.1 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.711 1.374 . . . . 3.4399999999999999 114.711 177.224 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . 0.301 0.3 OUTLIER -85.38 -1.15 56.7 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 120.329 -1.482 . . . . 4.6500000000000004 114.598 177.688 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -77.03 -53.85 7.29 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 108.866 -0.79 . . . . 2.2400000000000002 108.866 152.15 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -52.82 -29.84 30.0 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 127.579 2.352 . . . . 2.29 115.272 -173.827 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 26.8 t -57.14 -21.63 34.04 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 120.588 -1.32 . . . . 1.74 113.679 170.589 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 87.5 t -66.83 -45.88 86.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 120.109 1.322 . . . . 2.23 110.666 174.991 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.454 ' CZ ' HD11 ' B' ' 79' ' ' LEU . 30.1 t80 -56.38 -46.39 80.12 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.146 0.978 . . . . 1.7 111.512 172.532 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 33.7 mt -61.19 -41.88 97.59 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.426 -0.797 . . . . 1.79 111.533 178.231 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 93.7 m -56.53 -49.9 73.41 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.307 0.958 . . . . 1.3300000000000001 111.883 171.333 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 76.7 mtp -60.35 -46.4 90.05 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.838 0.744 . . . . 2.2999999999999998 111.922 -177.895 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.454 HD11 ' CZ ' ' B' ' 75' ' ' PHE . 82.3 mt -62.35 -50.67 70.65 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.064 0.546 . . . . 1.98 110.884 175.172 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 88.2 m -59.11 -33.02 70.36 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.151 0.887 . . . . 2.5499999999999998 113.279 179.942 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 63.8 mtt -74.45 -34.67 63.23 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.043 0.937 . . . . 3.9900000000000002 113.468 172.78 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.79 -41.35 71.76 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.737 1.153 . . . . 1.3200000000000001 111.662 176.446 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -57.52 -23.22 49.0 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.781 1.232 . . . . 2.8900000000000001 112.636 172.912 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -67.75 -42.72 81.36 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.178 -0.952 . . . . 2.0699999999999998 111.782 173.629 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -80.94 -32.63 34.51 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.291 1.036 . . . . 2.6400000000000001 111.563 -177.816 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -54.91 -37.28 66.16 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.255 1.822 . . . . 2.8900000000000001 111.644 166.56 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -74.27 -16.68 60.94 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.838 1.255 . . . . 2.0800000000000001 113.042 174.946 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 6.7 mp -79.29 -25.94 42.36 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 120.489 -1.382 . . . . 3.0 113.107 168.906 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -62.55 -22.03 66.03 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 113.187 0.81 . . . . 7.3300000000000001 113.187 169.87 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -85.33 -56.6 3.45 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.174 1.79 . . . . 4.1399999999999997 111.285 171.575 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.15 -8.24 29.58 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 115.472 1.656 . . . . 3.6099999999999999 115.472 -173.002 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.971 0 C-N-CA 126.608 1.963 . . . . 5.5899999999999999 115.691 -179.43 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.2 mmt . . . . . 0 N--CA 1.475 0.818 0 N-CA-C 109.732 -0.47 . . . . 6.1200000000000001 109.732 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -154.59 155.11 34.16 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 129.077 2.951 . . . . 6.0700000000000003 103.958 -166.233 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.41 162.71 13.57 Favored Pre-proline 0 N--CA 1.475 0.823 0 O-C-N 121.68 -0.638 . . . . 1.47 110.345 169.376 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.75 -21.22 21.88 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 121.447 1.431 . . . . 1.3300000000000001 111.569 173.731 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -77.08 -43.27 34.95 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.903 1.681 . . . . 3.1899999999999999 112.386 176.442 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -51.05 -49.36 60.72 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.887 0.875 . . . . 3.7400000000000002 109.249 168.015 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -64.44 -38.1 89.84 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 120.889 -1.132 . . . . 3.9100000000000001 113.781 174.952 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.04 -52.19 64.93 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.605 1.093 . . . . 0.96999999999999997 112.306 178.986 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.0 mt -66.64 -31.98 73.01 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.156 0.582 . . . . 2.0600000000000001 111.895 176.873 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.2 m -58.71 -52.05 67.36 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 117.899 -1.048 . . . . 1.6200000000000001 111.378 166.969 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 49.9 m -55.84 -41.27 74.05 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.918 1.235 . . . . 1.24 111.632 179.868 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 75.4 mmm -58.09 -54.43 47.08 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 122.951 0.501 . . . . 3.6800000000000002 111.495 174.521 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.4 t -63.96 -31.97 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 CA-C-N 119.019 0.827 . . . . 2.1699999999999999 112.083 179.03 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.7 m -64.0 -57.67 9.0 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.358 1.463 . . . . 0.75 111.244 -179.395 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 t -67.07 -36.1 81.26 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 118.854 -0.593 . . . . 2.9900000000000002 109.601 178.363 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -56.39 -48.07 77.64 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-O 117.746 -1.121 . . . . 1.8100000000000001 110.935 175.632 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.1 m80 -60.99 -43.65 98.56 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 120.816 1.643 . . . . 2.1800000000000002 112.584 173.283 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -62.69 -23.1 66.96 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.145 1.378 . . . . 4.1699999999999999 114.311 -176.069 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -95.38 -47.73 6.17 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.537 1.062 . . . . 2.7400000000000002 111.191 161.891 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.408 ' HA ' ' OE1' ' A' ' 33' ' ' GLU . 15.7 t -54.38 -39.25 67.03 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.461 1.904 . . . . 1.8500000000000001 115.286 -168.689 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.86 7.37 42.95 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 125.43 1.491 . . . . 2.48 115.472 179.747 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 -118.57 96.66 5.38 Favored 'General case' 0 C--O 1.221 -0.424 0 N-CA-C 106.854 -1.535 . . . . 4.21 106.854 174.994 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 88.26 148.67 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 127.897 2.479 . . . . 3.6499999999999999 111.623 -168.896 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 63.9 -145.44 49.76 Favored Glycine 0 CA--C 1.526 0.741 0 C-N-CA 124.182 0.896 . . . . 2.6499999999999999 112.168 177.155 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.4 m -88.35 164.53 15.5 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 122.085 -0.656 . . . . 3.0099999999999998 112.466 170.199 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -16.13 63.24 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 114.499 1.296 . . . . 7.9699999999999998 114.499 179.42 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.446 ' H ' HD23 ' A' ' 27' ' ' LEU . 2.5 pt? -117.13 10.95 14.02 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.496 1.919 . . . . 3.46 112.497 179.209 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.2 p -122.53 134.43 54.55 Favored 'General case' 0 C--O 1.249 1.043 0 N-CA-C 114.421 1.267 . . . . 1.0900000000000001 114.421 171.97 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 69.8 mt -95.62 104.27 16.18 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.413 1.085 . . . . 1.7 109.821 167.488 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.0 t -58.71 150.49 23.38 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.421 -0.799 . . . . 1.8500000000000001 109.965 161.284 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 34.3 ttp85 -45.47 -30.31 1.37 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 115.831 1.789 . . . . 3.1299999999999999 115.831 -172.56 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -36.9 38.87 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.029 1.122 . . . . 3.9500000000000002 114.029 176.012 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.408 ' OE1' ' HA ' ' A' ' 20' ' ' SER . 20.1 mt-10 -59.34 -50.63 73.22 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.827 0.851 . . . . 1.54 109.351 169.685 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.3 tp -57.84 -46.61 84.51 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.405 1.082 . . . . 1.8600000000000001 111.902 178.032 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -49.34 -50.88 37.76 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.395 1.078 . . . . 3.9900000000000002 112.92 -178.373 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -89.6 -11.96 41.12 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 115.25 1.574 . . . . 4.54 115.25 -178.678 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.4 tt -63.81 -60.93 2.67 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 120.063 1.301 . . . . 1.96 109.432 160.285 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.3 mt -58.03 -43.18 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 N-CA-C 110.215 -0.291 . . . . 0.95999999999999996 110.215 -175.353 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.8 mtpt -64.25 -12.15 38.37 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 114.15 1.166 . . . . 4.7000000000000002 114.15 -179.492 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -109.15 -24.02 11.35 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.186 1.794 . . . . 4.3899999999999997 112.335 -178.392 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 72.4 mt-10 -65.93 -48.07 72.63 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.793 1.178 . . . . 3.9900000000000002 111.372 163.056 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 77.3 mt -124.68 149.74 46.86 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.629 1.572 . . . . 2.4100000000000001 111.419 -163.516 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 1.7 t -156.01 11.86 0.3 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.149 1.38 . . . . 3.8300000000000001 112.713 179.184 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.97 28.79 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 126.382 1.873 . . . . 3.8700000000000001 116.005 178.034 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.5 -49.86 3.69 Favored Glycine 0 N--CA 1.474 1.201 0 C-N-CA 125.924 1.726 . . . . 2.9100000000000001 115.033 170.17 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.59 -35.3 80.56 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.841 1.257 . . . . 7.6600000000000001 112.7 -177.62 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 45.2 tpp -83.86 68.82 10.1 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 123.053 1.406 . . . . 2.3199999999999998 112.597 -179.025 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -66.14 163.27 17.98 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.227 1.411 . . . . 5.4299999999999997 112.726 174.59 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.59 -46.64 14.43 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.832 0.853 . . . . 4.7599999999999998 111.452 160.768 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.1 t -70.45 -37.71 74.38 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 114.852 1.427 . . . . 2.4100000000000001 114.852 175.077 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.0 m -62.91 -32.53 73.83 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 121.148 1.794 . . . . 1.9299999999999999 111.636 176.871 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.3 mt -63.85 -30.53 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 124.795 1.238 . . . . 1.6799999999999999 113.765 179.917 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -81.08 -24.45 37.77 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.813 1.188 . . . . 3.3900000000000001 112.64 -179.739 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -73.84 -42.15 61.25 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.406 -0.809 . . . . 3.0699999999999998 111.0 168.165 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 43.3 tp -57.75 -45.37 85.97 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.886 1.274 . . . . 2.0699999999999998 110.758 168.581 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -56.75 -47.2 80.59 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 125.543 1.537 . . . . 2.1200000000000001 110.886 175.315 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -26.34 64.75 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 121.205 -0.934 . . . . 3.9700000000000002 113.405 174.113 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 t -88.68 -32.8 17.81 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 120.714 -1.242 . . . . 2.23 113.468 176.917 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.441 ' CD2' ' HA ' ' A' ' 72' ' ' TYR . 7.1 mt -58.42 -50.59 73.16 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.815 1.246 . . . . 2.6400000000000001 110.938 165.06 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -102.57 76.47 1.53 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.375 1.87 . . . . 1.8899999999999999 112.791 -161.78 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -60.42 -21.33 62.12 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 113.67 0.989 . . . . 3.04 113.67 -167.689 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 51.6 p30 -100.5 -8.29 23.28 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.662 1.585 . . . . 2.2000000000000002 114.351 177.657 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 73.4 m 54.89 33.64 20.38 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.201 1.4 . . . . 2.5499999999999998 114.069 -174.687 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.4 p30 -71.02 -15.54 62.56 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.547 1.539 . . . . 2.1400000000000001 111.872 176.35 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 66.04 4.53 3.1 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 131.558 3.943 . . . . 4.0300000000000002 116.131 -174.9 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -103.99 126.86 51.43 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 127.193 2.197 . . . . 2.52 109.056 167.527 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 1.6 mm -104.3 100.74 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 O-C-N 120.953 -1.092 . . . . 1.05 111.024 -175.041 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -75.28 156.86 35.2 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 127.421 2.289 . . . . 2.54 111.275 170.561 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -45.41 -41.36 9.14 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.125 1.528 . . . . 3.5499999999999998 115.125 -179.994 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.6 pttm -80.14 -10.22 59.75 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 113.912 1.078 . . . . 3.23 113.912 -178.595 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -80.93 -53.67 6.24 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 108.043 -1.095 . . . . 1.79 108.043 158.278 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.441 ' HA ' ' CD2' ' A' ' 59' ' ' LEU . 30.9 t80 -54.48 -36.38 64.07 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.343 2.257 . . . . 2.79 116.178 -170.891 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.6 p -67.69 -23.12 65.26 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 120.725 -1.234 . . . . 2.29 112.79 -170.77 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 p -60.74 -28.13 42.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 CA-C-N 118.56 0.618 . . . . 2.2200000000000002 112.586 176.517 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -74.72 -58.9 3.0 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.921 0.889 . . . . 2.3100000000000001 110.469 -175.752 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.494 ' H ' HD23 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -61.83 -24.53 66.94 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 118.045 -0.978 . . . . 2.0299999999999998 113.126 172.452 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 53.7 m -58.59 -53.72 55.21 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.874 0.87 . . . . 0.84999999999999998 110.946 165.411 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 61.8 mtm -60.95 -40.18 92.31 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.822 0.737 . . . . 1.49 112.356 178.451 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 60.7 mt -60.09 -51.42 69.69 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.784 0.72 . . . . 1.48 110.729 174.698 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 82.0 m -63.84 -35.07 79.41 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.098 0.777 . . . . 1.8400000000000001 113.098 178.024 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 75.3 mtp -62.81 -44.35 96.38 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.892 1.224 . . . . 2.0800000000000001 111.325 171.57 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.44 -47.82 82.39 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.932 -0.556 . . . . 0.82999999999999996 111.452 177.249 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -62.85 -32.16 73.33 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.941 0.792 . . . . 3.1299999999999999 113.085 177.005 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -67.74 -39.98 84.17 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 119.88 1.218 . . . . 2.2599999999999998 111.358 177.133 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -72.69 -39.47 67.0 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.001 0.819 . . . . 2.98 110.965 178.465 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -53.62 -42.34 67.63 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.008 1.723 . . . . 2.3900000000000001 111.464 170.653 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -58.92 -29.31 66.99 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.23 1.012 . . . . 2.4199999999999999 112.886 -179.448 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.9 mp -74.7 -23.55 58.62 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.57 0.748 . . . . 2.23 112.916 174.494 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -91.82 -14.58 29.53 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.809 1.644 . . . . 2.6499999999999999 114.359 175.858 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -98.98 -30.08 12.55 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 128.045 2.538 . . . . 3.71 113.067 -170.475 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -98.54 20.5 12.7 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.316 1.446 . . . . 3.21 112.125 179.412 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 81.6 tttt . . . . . 0 C--O 1.25 1.11 0 C-N-CA 129.563 3.145 . . . . 4.21 115.873 -161.845 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 7.7 ttp . . . . . 0 N--CA 1.483 1.196 0 CA-C-O 119.893 -0.098 . . . . 7.4100000000000001 111.235 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 46.38 -90.81 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 128.062 2.545 . . . . 6.79 117.6 154.631 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 17.2 p -102.06 155.87 35.92 Favored Pre-proline 0 N--CA 1.469 0.476 0 C-N-CA 124.253 1.021 . . . . 1.8300000000000001 113.037 -153.002 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -62.75 -18.93 66.87 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.701 2.267 . . . . 2.3900000000000001 112.257 166.713 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 9.7 tt -68.39 -51.99 37.94 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-O 118.482 -0.771 . . . . 2.7400000000000002 110.387 166.477 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.05 -30.62 71.74 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.755 1.161 . . . . 3.79 111.974 176.973 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -33.54 68.18 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 119.523 -1.986 . . . . 5.3300000000000001 111.963 172.494 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.03 -40.03 94.23 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 119.691 1.132 . . . . 1.8100000000000001 112.648 169.76 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 68.2 mt -64.77 -35.55 81.45 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.287 0.949 . . . . 2.1800000000000002 111.872 171.018 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 36.5 m -60.96 -52.01 66.83 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 118.061 -0.971 . . . . 1.3500000000000001 110.182 170.416 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 93.1 m -50.93 -38.75 52.23 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.069 1.348 . . . . 1.6499999999999999 111.802 175.776 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 5.1 ttp -53.45 -51.52 62.41 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.585 0.754 . . . . 3.3900000000000001 112.022 174.229 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 34.5 m -74.66 -27.84 21.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 N-CA-C 113.251 0.834 . . . . 2.25 113.251 179.857 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 17.9 m -59.22 -54.84 42.37 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.656 1.182 . . . . 1.29 110.745 176.446 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.93 -32.12 51.41 Favored 'General case' 0 C--O 1.224 -0.252 0 O-C-N 123.62 0.575 . . . . 3.6499999999999999 110.463 -175.989 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -54.49 -44.52 72.72 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.312 0.505 . . . . 1.96 110.718 172.418 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.21 -27.32 63.79 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.821 1.415 . . . . 2.02 114.821 179.04 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -63.71 -45.6 89.26 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 120.833 -1.167 . . . . 5.0700000000000003 111.537 172.541 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.503 ' CD2' HD13 ' B' ' 37' ' ' LEU . 21.5 m-85 -87.7 -10.27 51.7 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.428 1.091 . . . . 2.0299999999999998 113.098 -178.383 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 68.2 m -58.05 -56.52 20.96 Favored 'General case' 0 C--O 1.241 0.624 0 O-C-N 120.883 -1.136 . . . . 1.8300000000000001 112.009 164.018 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.12 -20.31 53.24 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-O 117.407 -1.774 . . . . 2.52 114.77 -168.439 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -47.85 -46.51 31.2 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.402 1.481 . . . . 3.7799999999999998 113.118 -169.572 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 57.0 mp0 -130.74 153.53 48.92 Favored 'General case' 0 C--O 1.248 0.981 0 CA-C-O 124.014 1.864 . . . . 3.5899999999999999 111.912 167.744 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.92 -8.15 2.65 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.32 1.438 . . . . 2.3700000000000001 113.903 -172.309 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 15.1 m 57.1 -142.83 0.73 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.485 1.114 . . . . 6.1500000000000004 109.781 -159.782 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 24.1 mttt 68.25 -172.48 0.19 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.274 1.83 . . . . 11.44 112.541 172.522 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 mp -82.91 -0.8 50.1 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.829 1.251 . . . . 3.71 112.843 173.683 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 21.8 p -113.57 152.47 30.25 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 115.765 1.765 . . . . 1.1200000000000001 115.765 -155.578 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -101.43 108.39 19.97 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 127.205 2.202 . . . . 2.0899999999999999 113.022 -172.215 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 12.9 t -84.1 162.46 20.29 Favored 'General case' 0 C--N 1.315 -0.896 0 O-C-N 120.247 -1.533 . . . . 2.0899999999999999 112.16 176.835 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 24.0 ttt85 -45.14 -41.11 7.69 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.603 1.561 . . . . 4.0099999999999998 114.426 -178.17 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.82 -36.36 42.71 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.898 -1.126 . . . . 6.3099999999999996 113.277 174.279 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -60.5 -46.11 91.32 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 120.041 1.291 . . . . 1.8 110.393 176.349 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 8.2 tp -65.69 -36.78 84.61 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.008 1.723 . . . . 1.9399999999999999 113.076 178.7 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -64.91 -28.03 69.26 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.362 1.065 . . . . 5.2599999999999998 112.363 174.506 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.03 -77.19 0.08 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.061 -0.971 . . . . 3.2400000000000002 108.541 158.822 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . 0.503 HD13 ' CD2' ' B' ' 19' ' ' TYR . 23.3 tp -48.69 -43.2 36.79 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.276 1.83 . . . . 2.1000000000000001 114.502 -163.684 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 58.6 mt -57.15 -64.51 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 120.191 1.36 . . . . 1.3 107.49 174.474 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 25.4 mtpt -62.09 -26.37 68.25 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.398 0.888 . . . . 4.6100000000000003 113.398 -174.803 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.73 -36.48 50.8 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.113 1.765 . . . . 5.7699999999999996 113.308 -179.534 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -122.17 -29.48 4.19 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.145 1.165 . . . . 6.04 114.145 -170.189 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -118.36 79.44 1.38 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.168 1.787 . . . . 3.9199999999999999 107.098 169.446 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 93.4 m -68.53 -47.81 65.96 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.36 -0.836 . . . . 3.9500000000000002 112.448 -155.722 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 6.7 mp 61.84 -34.86 0.11 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 129.755 3.222 . . . . 5.2999999999999998 118.604 170.519 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.68 -51.22 4.39 Favored Glycine 0 N--CA 1.473 1.164 0 C-N-CA 126.598 2.047 . . . . 2.6899999999999999 112.788 174.411 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -68.72 -4.36 15.58 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.497 1.119 . . . . 5.2000000000000002 112.217 168.322 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.55 63.84 0.42 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 124.542 2.115 . . . . 2.29 111.063 163.698 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -76.46 147.89 37.59 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 127.269 2.228 . . . . 3.7799999999999998 109.147 174.457 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.16 -37.1 66.56 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.674 1.361 . . . . 4.8300000000000001 114.674 -157.348 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 8.5 t -74.74 -24.17 58.68 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.884 1.439 . . . . 2.6800000000000002 114.884 174.389 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 4.8 m -63.55 -18.23 63.63 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 120.06 1.3 . . . . 2.2999999999999998 111.957 173.895 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 42.7 mm -67.62 -25.7 33.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 C-N-CA 124.805 1.242 . . . . 1.5800000000000001 111.834 174.299 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -70.75 -34.45 71.85 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.958 0.799 . . . . 5.0599999999999996 111.944 173.391 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.61 -32.95 47.73 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.203 1.001 . . . . 3.54 111.732 174.821 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.87 -44.38 93.25 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 118.414 -0.803 . . . . 2.48 111.211 167.453 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 14.0 mtp -57.64 -49.35 76.76 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.86 1.209 . . . . 1.8 110.71 171.453 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -60.87 -29.32 69.47 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.303 1.441 . . . . 3.4700000000000002 113.142 -178.607 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 33.2 t -76.09 -22.03 56.05 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 115.086 1.513 . . . . 3.5299999999999998 115.086 172.021 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mp -109.21 -45.91 3.66 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.736 1.614 . . . . 3.0600000000000001 114.775 -172.401 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -85.11 88.49 7.47 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.485 1.514 . . . . 1.6000000000000001 111.26 -163.587 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -62.82 -29.36 70.66 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.614 1.565 . . . . 5.1100000000000003 114.634 -173.431 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -85.04 -16.31 41.15 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 117.83 -1.081 . . . . 2.0499999999999998 112.711 169.059 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 20.6 m 49.64 66.1 1.22 Allowed 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 126.261 1.825 . . . . 3.9199999999999999 112.28 176.224 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -136.69 -102.12 0.2 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.377 0.671 . . . . 3.29 110.804 -148.851 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -145.19 -10.17 0.57 Allowed 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 115.592 1.701 . . . . 6.1500000000000004 115.592 167.17 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -137.87 146.12 43.0 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 125.357 1.463 . . . . 2.3900000000000001 112.961 175.541 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 2.6 mt -100.02 109.3 24.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 C-N-CA 127.89 2.476 . . . . 1.4399999999999999 107.284 173.321 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.07 160.2 30.02 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.752 1.621 . . . . 2.4900000000000002 111.181 168.334 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -56.46 -31.26 63.81 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 121.078 -1.014 . . . . 2.3999999999999999 112.999 -174.463 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.6 -11.06 43.74 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.304 1.841 . . . . 3.5899999999999999 112.81 -179.465 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -75.02 -57.18 4.06 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 108.468 -0.938 . . . . 1.6899999999999999 108.468 153.494 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -54.84 -24.88 25.15 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.653 2.381 . . . . 1.8500000000000001 115.663 -174.607 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 1.8 m -49.54 -31.08 9.61 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 120.754 -1.216 . . . . 2.4700000000000002 112.689 170.121 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 95.4 t -74.21 -25.46 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.159 0.583 . . . . 1.6499999999999999 111.959 -179.777 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -61.31 -56.98 14.29 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-N 119.199 0.908 . . . . 2.7599999999999998 111.037 171.039 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . 0.524 HD22 ' H ' ' B' ' 76' ' ' LEU . 2.7 mm? -56.75 -45.57 81.95 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.51 0.724 . . . . 3.04 110.772 179.242 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 76.4 m -53.19 -54.5 35.02 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.118 1.367 . . . . 1.1899999999999999 112.154 176.707 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 12.7 tmm? -65.73 -43.99 87.39 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.948 1.299 . . . . 3.2799999999999998 112.412 -176.293 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -55.27 -50.4 69.62 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.631 0.772 . . . . 2.23 110.978 170.149 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 9.6 t -61.71 -36.11 79.98 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.117 0.784 . . . . 2.6800000000000002 113.117 -179.254 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 94.0 mtp -67.79 -35.95 79.59 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.244 1.017 . . . . 2.46 113.004 173.926 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.91 -30.27 50.53 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 119.453 1.024 . . . . 1.1599999999999999 112.969 175.623 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -74.75 -18.39 60.5 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.668 -1.27 . . . . 2.9199999999999999 111.719 -177.537 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -55.9 -32.97 64.21 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.527 1.531 . . . . 2.5699999999999998 114.055 161.262 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -105.9 -28.94 10.3 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 127.408 2.283 . . . . 3.04 112.126 -167.752 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.67 -41.14 61.16 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.382 1.073 . . . . 3.1099999999999999 110.369 159.336 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -65.94 -24.23 66.77 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.288 1.835 . . . . 2.54 113.218 173.099 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 75.1 mt -90.05 -3.68 57.81 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.453 1.501 . . . . 2.9199999999999999 113.935 178.306 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.454 ' CD ' ' HZ3' ' B' ' 92' ' ' LYS . 72.4 mm-40 -90.45 -4.72 56.8 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.085 0.954 . . . . 3.8900000000000001 112.685 162.014 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -119.02 -66.96 1.02 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.335 1.454 . . . . 3.0499999999999998 111.268 -174.798 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -81.75 47.83 1.13 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.401 1.481 . . . . 3.3300000000000001 111.372 169.544 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . 0.454 ' HZ3' ' CD ' ' B' ' 89' ' ' GLU . 22.2 tttp . . . . . 0 C--O 1.251 1.148 0 C-N-CA 129.748 3.219 . . . . 5.0199999999999996 115.839 -173.316 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.9 ttp . . . . . 0 N--CA 1.485 1.302 0 N-CA-C 111.498 0.184 . . . . 5.9100000000000001 111.498 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 57.63 -71.17 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 118.412 2.745 . . . . 7.0099999999999998 118.412 148.998 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 76.4 p -147.91 161.0 36.45 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 118.603 0.638 . . . . 2.04 112.146 -154.88 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -62.36 -23.86 75.4 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 121.933 1.755 . . . . 1.5600000000000001 111.836 165.384 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -69.87 -48.38 58.97 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.994 1.318 . . . . 2.5699999999999998 111.083 177.411 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -63.77 -44.01 94.69 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 122.522 1.153 . . . . 3.3900000000000001 110.611 177.363 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -66.04 -19.98 66.03 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.686 -1.259 . . . . 4.2300000000000004 112.282 175.105 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -81.94 -45.12 15.84 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.167 1.387 . . . . 1.29 112.379 171.54 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.4 pp -63.37 -30.14 71.32 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 121.999 2.182 . . . . 2.96 112.157 171.588 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 30.0 m -53.09 -56.75 13.8 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.223 1.009 . . . . 1.47 109.371 164.622 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.76 -34.72 73.35 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.926 1.291 . . . . 1.71 114.008 179.503 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -56.88 -44.46 82.28 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.335 1.054 . . . . 3.46 112.444 170.193 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.2 t -71.66 -32.03 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 CA-C-O 118.597 -0.716 . . . . 1.8999999999999999 112.178 173.235 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 54.3 m -57.34 -56.61 19.62 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 119.758 1.163 . . . . 0.93000000000000005 111.641 175.476 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -57.93 -43.12 86.12 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 123.344 0.657 . . . . 2.0699999999999998 110.068 173.537 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -64.5 -45.2 88.3 Favored 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 120.677 -0.409 . . . . 1.9099999999999999 111.99 -173.265 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.32 -45.59 92.56 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 120.379 -1.451 . . . . 2.1499999999999999 112.061 176.336 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.17 -41.36 67.15 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.948 0.721 . . . . 5.8600000000000003 112.948 -176.513 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -72.74 -43.4 62.98 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.083 0.856 . . . . 2.1899999999999999 112.99 173.096 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.2 m -72.45 -26.2 61.74 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 120.307 1.412 . . . . 2.8500000000000001 111.964 -179.407 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.02 -35.44 89.33 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 124.689 1.138 . . . . 2.04 113.164 173.891 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.3 ttt85 -45.55 -50.1 13.31 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 128.073 2.549 . . . . 5.1699999999999999 115.609 -168.775 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -138.6 161.95 35.83 Favored 'General case' 0 C--O 1.25 1.127 0 C-N-CA 126.167 1.787 . . . . 4.7199999999999998 111.465 -177.255 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.52 -87.81 0.27 Allowed Glycine 0 C--N 1.346 1.123 0 C-N-CA 127.234 2.349 . . . . 2.3500000000000001 109.62 179.678 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -146.36 -179.54 6.82 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 121.559 -0.965 . . . . 4.75 110.04 142.75 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.73 156.35 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.489 1.916 . . . . 6.4000000000000004 113.011 147.106 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.0 mt 78.85 -50.7 0.45 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 128.185 2.594 . . . . 3.0699999999999998 110.712 -169.857 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.6 p -86.18 136.6 33.13 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 113.243 0.831 . . . . 2.1200000000000001 113.243 -176.326 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 28.3 mt -90.7 107.4 19.15 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.56 -0.904 . . . . 1.54 108.56 149.394 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.0 t -71.01 161.22 31.52 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 120.646 -1.284 . . . . 1.8799999999999999 111.177 163.425 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 22.4 ttt180 -42.2 -35.34 0.93 Allowed 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.757 1.623 . . . . 3.48 114.209 179.819 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 mmmm -71.38 -55.74 7.35 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 116.071 1.878 . . . . 4.5599999999999996 116.071 173.507 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -49.9 -35.65 24.46 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.2 1.4 . . . . 2.0600000000000001 110.002 171.606 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.7 tp -81.57 -49.07 10.98 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.968 0.907 . . . . 1.8700000000000001 110.902 -174.814 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -55.34 -38.22 68.48 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.06 0.846 . . . . 6.3300000000000001 111.384 175.885 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -79.19 -8.61 59.14 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.83 1.419 . . . . 3.7599999999999998 114.83 -174.73 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 50.8 tp -92.27 -55.28 3.48 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.855 1.262 . . . . 2.8500000000000001 111.212 169.611 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 23.0 mt -57.86 -49.07 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 O-C-N 121.668 -0.645 . . . . 1.24 110.08 -174.133 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.09 -3.94 15.23 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 113.475 0.917 . . . . 4.3899999999999997 113.475 -178.008 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.6 mmtp -95.37 -45.82 6.97 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.948 1.299 . . . . 2.7000000000000002 110.88 167.942 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -64.82 -53.0 53.69 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.227 1.411 . . . . 5.2800000000000002 111.81 -177.131 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -82.47 41.5 0.71 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.029 1.332 . . . . 2.7799999999999998 112.245 -175.621 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 53.4 t -58.04 -33.52 69.09 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.17 1.388 . . . . 3.7799999999999998 112.646 177.916 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -71.42 -6.34 39.57 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.896 1.443 . . . . 4.5800000000000001 114.896 174.332 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -133.67 -8.96 2.09 Favored Glycine 0 N--CA 1.472 1.045 0 CA-C-O 118.195 -1.336 . . . . 3.7000000000000002 115.881 -178.173 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 52.32 41.38 30.47 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.157 1.783 . . . . 7.9100000000000001 113.509 -179.436 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.4 tpt -39.33 104.97 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.609 1.564 . . . . 2.3100000000000001 112.102 -173.509 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -73.53 158.79 34.22 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.393 0.516 . . . . 6.0199999999999996 112.393 -160.641 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.54 -47.02 73.68 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 119.761 1.164 . . . . 5.6299999999999999 111.822 175.447 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.8 t -65.34 -3.67 4.45 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 115.183 1.549 . . . . 2.7999999999999998 115.183 173.782 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -114.1 -18.46 11.67 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.833 1.253 . . . . 2.7599999999999998 113.086 170.317 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 24.8 mt -76.71 -31.15 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 125.908 1.683 . . . . 1.23 110.527 172.029 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -70.2 -41.22 73.96 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 118.127 -0.94 . . . . 2.8500000000000001 113.197 177.166 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -65.92 -44.59 84.7 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 120.385 1.448 . . . . 2.8700000000000001 110.348 168.316 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 49.1 tp -54.67 -48.45 72.35 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.109 -0.948 . . . . 1.96 110.403 179.847 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.6 ttt -55.9 -50.39 70.82 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.192 1.36 . . . . 1.5600000000000001 112.144 172.249 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.56 -18.56 30.72 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.549 1.54 . . . . 4.7400000000000002 113.322 175.345 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.5 m -101.17 -22.85 14.57 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 127.077 2.151 . . . . 2.3700000000000001 113.763 179.067 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.7 mp -72.9 -46.17 54.16 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.573 -1.33 . . . . 2.8700000000000001 110.79 162.328 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -78.48 63.13 3.25 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.826 2.05 . . . . 1.9399999999999999 112.577 -166.295 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -51.06 -39.62 56.41 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 125.804 1.642 . . . . 3.4300000000000002 113.962 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -82.02 -8.02 59.64 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.777 1.399 . . . . 2.6400000000000001 114.777 176.004 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.4 t 63.36 39.55 9.27 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.871 1.268 . . . . 2.3199999999999998 114.202 166.855 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 42.3 p-10 -109.45 1.96 20.23 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 127.946 2.499 . . . . 2.6000000000000001 112.976 -175.074 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 78.66 -7.35 1.8 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 128.157 2.583 . . . . 3.75 115.639 -178.385 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -116.0 141.94 47.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.049 1.34 . . . . 3.8500000000000001 109.895 -179.659 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 22.4 mm -100.22 103.82 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 O-C-N 120.514 -1.366 . . . . 1.1100000000000001 111.569 175.994 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.48 162.22 29.52 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 125.139 1.376 . . . . 2.3999999999999999 112.132 164.057 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.32 -40.72 74.86 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 120.544 -1.348 . . . . 2.0600000000000001 113.16 -174.818 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.63 -14.65 62.94 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 120.977 -1.077 . . . . 3.3700000000000001 112.744 174.855 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -84.88 -51.93 6.37 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.34 -0.85 . . . . 2.0699999999999998 110.789 168.682 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -52.97 -45.0 67.58 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 127.195 2.198 . . . . 2.1299999999999999 114.513 -171.571 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.0 t -54.09 -27.28 31.85 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.225 1.194 . . . . 1.9099999999999999 114.225 -171.214 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.3 m -68.24 -22.97 27.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 O-C-N 120.759 -1.213 . . . . 2.46 113.48 -179.556 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -60.54 -62.83 1.58 Allowed 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 123.704 0.802 . . . . 1.8700000000000001 110.542 171.712 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.408 ' H ' HD12 ' A' ' 76' ' ' LEU . 3.8 mp -60.91 -30.93 70.47 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.347 1.059 . . . . 2.3900000000000001 111.404 179.71 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.5 m -59.73 -58.93 6.42 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.958 0.903 . . . . 0.77000000000000002 111.318 172.167 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 13.6 ptp -65.32 -34.0 77.31 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 118.405 0.548 . . . . 1.6499999999999999 112.228 -178.493 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -54.18 46.42 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.489 1.116 . . . . 2.98 110.794 173.557 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 7.6 t -64.3 -33.76 76.57 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.024 0.53 . . . . 1.6399999999999999 112.08 179.741 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.8 mtp -61.46 -44.18 97.55 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 118.957 0.798 . . . . 2.5099999999999998 112.954 168.616 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.45 -40.84 89.65 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.176 0.898 . . . . 1.1299999999999999 111.293 178.66 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -64.27 -22.39 66.93 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 118.77 -0.633 . . . . 2.7000000000000002 112.705 175.098 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -67.44 -40.9 85.47 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 120.146 1.339 . . . . 1.9199999999999999 111.682 174.013 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -71.91 -40.54 68.76 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.976 0.911 . . . . 2.6899999999999999 110.463 178.806 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -52.89 -48.3 67.26 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.142 1.377 . . . . 2.96 111.871 170.068 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -58.37 -24.38 59.71 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.992 1.717 . . . . 2.7000000000000002 113.618 179.355 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.2 mp -72.27 -17.79 61.86 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.41 1.005 . . . . 2.54 113.37 171.998 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -112.58 6.26 18.31 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 126.889 2.076 . . . . 3.77 114.892 173.985 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -88.61 -46.44 9.06 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 120.262 -1.524 . . . . 4.4400000000000004 112.169 162.362 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.96 16.06 0.59 Allowed 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 117.123 2.268 . . . . 3.5099999999999998 117.123 -173.071 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.258 1.534 0 N-CA-C 118.953 2.945 . . . . 4.79 118.953 -129.041 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.421 ' SD ' ' HE3' ' B' ' 7' ' ' LYS . 30.2 mmt . . . . . 0 N--CA 1.474 0.77 0 N-CA-C 107.421 -1.326 . . . . 5.1699999999999999 107.421 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 17.9 mp0 -109.01 -94.4 0.41 Allowed 'General case' 0 CA--C 1.54 0.559 0 O-C-N 125.493 1.746 . . . . 4.8399999999999999 108.633 -150.813 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 71.8 p -135.99 159.38 71.3 Favored Pre-proline 0 N--CA 1.472 0.659 0 C-N-CA 124.626 1.171 . . . . 1.9199999999999999 110.938 173.224 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.01 -13.07 35.85 Favored 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 122.43 2.086 . . . . 1.4199999999999999 112.757 167.053 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -82.01 -44.14 17.05 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.638 1.175 . . . . 2.73 112.986 -179.58 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . 0.411 ' CD ' ' HZ3' ' B' ' 7' ' ' LYS . 1.4 tm-20 -57.56 -40.88 79.92 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 122.343 1.068 . . . . 4.3200000000000003 110.045 168.981 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . 0.421 ' HE3' ' SD ' ' B' ' 1' ' ' MET . 49.9 mttm -76.79 -27.84 55.4 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 121.125 -0.985 . . . . 4.5599999999999996 112.259 179.599 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.81 -43.08 80.5 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.876 0.762 . . . . 0.90000000000000002 111.532 169.257 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 42.9 mt -58.22 -39.02 77.96 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.576 1.15 . . . . 1.52 111.12 169.557 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 71.1 m -65.19 -42.59 93.45 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.006 0.922 . . . . 1.48 112.131 171.977 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 63.2 m -58.48 -46.45 86.64 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 120.328 1.422 . . . . 1.3700000000000001 111.047 171.152 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 82.3 mtp -57.24 -49.37 76.25 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.531 1.532 . . . . 3.2000000000000002 111.756 173.754 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.73 -27.36 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.188 0.904 . . . . 1.8999999999999999 112.647 177.279 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 94.1 m -67.96 -54.75 16.21 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.127 1.371 . . . . 0.97999999999999998 110.458 174.012 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.2 p -59.28 -35.95 74.66 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.346 0.975 . . . . 1.97 110.702 173.538 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . 0.448 ' CE1' HD23 ' B' ' 29' ' ' LEU . 27.8 t80 -67.79 -45.72 74.01 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 118.729 -0.653 . . . . 2.1800000000000002 110.96 179.801 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -69.75 -46.78 65.1 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 120.432 1.469 . . . . 2.1600000000000001 111.345 176.42 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -58.69 -44.78 90.37 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.22 1.408 . . . . 5.8799999999999999 113.71 179.306 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -81.14 -19.9 42.48 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 120.641 -1.287 . . . . 2.3100000000000001 112.094 171.235 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 26.9 m -67.79 -22.33 65.19 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 121.112 1.778 . . . . 1.71 112.94 170.207 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.15 7.58 81.78 Favored Glycine 0 CA--C 1.53 1.02 0 C-N-CA 126.467 1.984 . . . . 1.77 114.73 176.216 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 5.0 mmm-85 -76.46 -14.22 60.06 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.477 1.638 . . . . 4.6900000000000004 113.868 178.897 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 171.28 -174.16 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 129.713 3.205 . . . . 3.2799999999999998 110.852 -176.572 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 62.72 -139.1 44.94 Favored Glycine 0 N--CA 1.472 1.096 0 O-C-N 120.731 -1.231 . . . . 1.8600000000000001 110.651 -179.624 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 8.1 t -82.28 158.89 23.3 Favored 'General case' 0 C--O 1.245 0.819 0 CA-C-N 118.054 0.927 . . . . 4.1799999999999997 110.418 157.012 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.6 51.23 1.44 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.89 1.676 . . . . 6.9199999999999999 111.421 172.476 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 63.3 tp -168.07 -35.05 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 126.878 2.071 . . . . 2.9199999999999999 110.678 -170.431 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 25.6 p -102.98 152.75 20.97 Favored 'General case' 0 C--O 1.248 1.001 0 C-N-CA 126.794 2.038 . . . . 1.6000000000000001 111.622 173.801 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.448 HD23 ' CE1' ' B' ' 16' ' ' PHE . 0.0 OUTLIER -122.4 78.48 1.51 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.919 1.287 . . . . 2.21 110.214 -163.807 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.463 ' HA ' ' HA ' ' B' ' 66' ' ' GLU . 1.0 OUTLIER -54.96 150.51 10.09 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.536 1.935 . . . . 2.1400000000000001 112.967 177.738 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 23.5 ttp85 -40.34 -55.23 2.26 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.547 0.943 . . . . 3.2400000000000002 113.547 178.144 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.22 -27.35 61.93 Favored 'General case' 0 CA--C 1.554 1.116 0 N-CA-C 117.15 2.278 . . . . 4.2300000000000004 117.15 177.655 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -76.6 -52.95 8.72 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.181 1.792 . . . . 1.76 108.022 175.284 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.07 -31.59 69.26 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.095 0.558 . . . . 3.2599999999999998 112.314 -173.192 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.58 -15.06 63.41 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.154 1.168 . . . . 5.6699999999999999 114.154 175.777 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.57 -61.95 1.59 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 118.22 -0.895 . . . . 4.0800000000000001 112.555 156.625 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . 0.417 HD23 ' C ' ' B' ' 37' ' ' LEU . 3.6 tt -45.18 -54.0 7.47 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.449 1.499 . . . . 2.0899999999999999 111.577 -174.115 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 11.8 mt -58.6 -68.14 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 119.075 0.852 . . . . 1.22 110.448 -173.742 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -12.57 42.94 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 113.546 0.943 . . . . 4.1799999999999997 113.546 -176.513 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.12 -53.77 6.1 Favored 'General case' 0 N--CA 1.444 -0.763 0 O-C-N 120.479 -1.388 . . . . 6.7000000000000002 111.3 165.84 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -75.8 -32.33 59.81 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 120.461 1.482 . . . . 3.73 112.104 -172.998 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -126.1 110.99 14.15 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.985 2.114 . . . . 2.4100000000000001 110.106 168.578 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 29.4 p -99.26 2.43 45.58 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 121.375 -0.828 . . . . 4.21 112.706 164.821 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 7.2 mp -77.01 155.3 32.67 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.081 0.953 . . . . 4.6200000000000001 112.263 -160.825 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.52 -73.8 1.13 Allowed Glycine 0 N--CA 1.469 0.875 0 C-N-CA 124.709 1.147 . . . . 5.4699999999999998 110.774 -175.073 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -154.71 7.37 0.29 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.164 1.386 . . . . 5.5700000000000003 113.458 165.289 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 5.7 tpt -50.07 117.65 2.46 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.287 1.435 . . . . 3.2799999999999998 114.075 -156.231 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 ttmp? -164.09 162.56 23.04 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.344 1.457 . . . . 3.9900000000000002 110.162 -161.45 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.77 3.51 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 116.653 2.094 . . . . 4.2400000000000002 116.653 170.5 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 2.6 p -73.75 -42.9 60.45 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 119.834 -1.791 . . . . 6.0 113.666 159.25 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 2.8 p -103.92 -16.28 15.4 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.299 1.839 . . . . 2.4399999999999999 113.572 -176.284 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 30.1 mt -71.81 -34.17 50.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 N-CA-C 114.621 1.341 . . . . 2.0 114.621 -176.588 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.09 -29.99 65.97 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 120.464 1.484 . . . . 2.8599999999999999 112.301 -174.204 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -71.24 -45.16 63.87 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.421 1.489 . . . . 2.4700000000000002 112.142 169.829 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 53.4 tp -56.87 -51.09 70.4 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 124.251 1.02 . . . . 2.2000000000000002 109.977 173.093 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 8.6 tpt -52.66 -48.74 66.26 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 127.095 2.158 . . . . 2.1899999999999999 111.861 175.868 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.39 -27.28 62.19 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.741 0.816 . . . . 3.8100000000000001 113.186 172.206 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . 0.402 ' O ' ' HE3' ' B' ' 61' ' ' LYS . 9.3 t -87.8 -30.3 20.34 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.242 1.417 . . . . 2.1400000000000001 113.396 176.74 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 30.5 mt -67.94 -49.15 63.48 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 121.223 -0.923 . . . . 1.8700000000000001 110.605 171.555 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -81.51 81.05 7.74 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 122.895 1.331 . . . . 1.54 112.562 -173.523 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . 0.402 ' HE3' ' O ' ' B' ' 58' ' ' SER . 1.6 mptm? -61.36 -17.04 52.09 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 114.257 1.206 . . . . 3.1200000000000001 114.257 178.607 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -78.3 -33.27 49.46 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.097 0.862 . . . . 2.25 112.915 171.105 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 57.8 m 54.35 56.78 6.5 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.437 1.495 . . . . 2.3599999999999999 111.526 -159.662 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 9.3 p30 -101.21 -72.58 0.67 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.572 1.149 . . . . 2.3599999999999999 109.656 -172.042 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 167.62 -25.71 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.831 1 C-N-CA 133.386 4.674 . . . . 5.9800000000000004 113.854 -177.886 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . 0.463 ' HA ' ' HA ' ' B' ' 30' ' ' SER . 1.2 mt-10 -125.31 133.76 52.5 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 126.624 1.97 . . . . 2.5800000000000001 110.458 -171.091 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 34.1 mt -87.88 112.14 23.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 122.118 0.961 . . . . 1.3300000000000001 109.572 173.876 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.75 163.09 27.91 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.535 1.934 . . . . 2.5600000000000001 111.085 166.527 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -57.1 -37.76 72.4 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 120.866 -1.147 . . . . 2.3199999999999998 113.803 -176.871 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 5.0 mtmp? -77.9 -29.68 50.27 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 120.476 -1.39 . . . . 3.4100000000000001 112.343 177.257 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -60.86 -52.05 66.7 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-N 119.911 1.232 . . . . 1.8600000000000001 108.866 163.229 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -58.0 -29.36 65.22 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 119.61 -1.931 . . . . 2.1899999999999999 114.186 -179.436 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 32.7 p -58.27 -26.14 62.61 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.397 -1.439 . . . . 2.5800000000000001 113.802 171.851 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 47.3 t -64.74 -44.98 96.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.042 0.937 . . . . 1.8300000000000001 109.953 172.939 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -58.12 -54.88 41.94 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 119.103 -0.475 . . . . 1.6599999999999999 111.115 176.805 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 91.4 mt -52.99 -45.74 67.99 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.169 0.987 . . . . 2.04 111.791 -179.748 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 25.3 m -64.11 -51.1 65.58 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.107 0.563 . . . . 1.01 112.286 -179.206 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 67.9 mtm -62.69 -39.69 94.79 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 118.245 0.475 . . . . 2.0099999999999998 111.729 -179.367 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.38 -48.45 67.38 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.353 0.661 . . . . 2.6699999999999999 111.719 179.381 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 84.6 m -65.91 -28.47 68.96 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.079 0.77 . . . . 2.04 113.079 179.657 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 48.0 mtm -72.69 -31.46 65.04 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.034 1.124 . . . . 3.0099999999999998 114.034 169.205 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.67 -43.15 56.71 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.861 1.209 . . . . 0.96999999999999997 112.033 173.738 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.89 -15.64 23.02 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.531 1.308 . . . . 2.2599999999999998 114.531 172.877 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -66.12 -38.12 87.42 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.514 0.726 . . . . 2.54 112.099 172.228 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -90.09 -25.48 20.74 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.736 1.214 . . . . 3.5099999999999998 112.657 -179.12 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.97 -18.9 61.98 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 124.925 1.29 . . . . 3.6099999999999999 112.43 167.9 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -88.57 -16.49 32.44 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.387 1.875 . . . . 2.8399999999999999 112.801 168.903 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 87.7 mt -94.99 -32.15 13.29 Favored 'General case' 0 C--O 1.222 -0.395 0 CA-C-O 116.999 -1.477 . . . . 3.1600000000000001 112.792 -179.951 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -55.48 -25.31 36.19 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 120.297 1.408 . . . . 8.0899999999999999 114.022 168.158 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -81.38 -53.74 6.06 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 128.245 2.618 . . . . 3.3100000000000001 112.492 168.498 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -77.73 -16.9 58.12 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 116.701 2.112 . . . . 3.23 116.701 -170.444 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? . . . . . 0 N--CA 1.469 0.498 0 N-CA-C 119.818 3.266 . . . . 5.5499999999999998 119.818 -159.767 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 108.012 -1.107 . . . . 6.8700000000000001 108.012 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -144.35 -99.62 0.11 Allowed 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 106.15 -1.796 . . . . 3.9900000000000002 106.15 -165.631 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 72.9 p -152.19 169.77 9.02 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 128.264 2.626 . . . . 1.8899999999999999 108.829 -168.921 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.89 -37.46 3.67 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 CA-C-N 120.73 1.296 . . . . 1.8300000000000001 111.372 167.612 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 26.4 mt -62.87 -49.68 73.9 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-O 117.729 -1.129 . . . . 3.23 112.792 -174.916 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -38.34 66.76 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.955 1.252 . . . . 4.4500000000000002 111.057 -178.839 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -73.86 -42.79 60.28 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 120.361 -1.462 . . . . 3.4399999999999999 113.431 171.475 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.566 ' HB1' ' HB2' ' B' ' 8' ' ' ALA . . . -75.13 -30.81 60.92 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 114.717 1.377 . . . . 2.3100000000000001 114.717 -174.782 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.3 mt -67.49 -35.57 79.41 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.908 1.683 . . . . 1.8899999999999999 110.066 166.958 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 56.9 m -67.96 -36.2 79.66 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 118.139 -0.934 . . . . 2.1699999999999999 111.038 170.893 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.9 m -56.61 -41.4 76.98 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 120.004 1.274 . . . . 1.78 111.3 167.38 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.5 tpt -63.34 -44.6 94.41 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.586 0.754 . . . . 4.4800000000000004 112.465 172.835 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 37.5 t -61.83 -33.65 58.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 O-C-N 120.478 -1.388 . . . . 2.23 112.229 173.958 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.9 m -71.24 -41.63 69.88 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.828 1.651 . . . . 1.3500000000000001 112.183 -177.804 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.0 p -69.0 -37.61 78.79 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 117.966 -1.016 . . . . 1.98 109.193 167.904 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -59.69 -57.16 14.12 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.462 0.574 . . . . 2.02 111.147 -173.538 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -59.57 -50.0 75.57 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-O 122.274 1.035 . . . . 2.8300000000000001 111.594 178.097 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -57.8 -34.14 69.31 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.923 -1.111 . . . . 3.5899999999999999 113.683 -178.695 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -97.0 -19.81 18.5 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.992 1.317 . . . . 2.1000000000000001 112.472 177.137 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.4 p -71.11 -29.51 65.37 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-N 121.624 2.011 . . . . 2.1400000000000001 111.952 171.081 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.24 -8.99 80.7 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 126.854 2.168 . . . . 1.8700000000000001 115.217 173.657 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.3 ttm-85 -66.18 -23.38 66.45 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 119.194 1.497 . . . . 4.5199999999999996 113.574 -177.948 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -166.72 158.78 13.32 Favored 'General case' 0 C--O 1.247 0.95 0 C-N-CA 124.404 1.082 . . . . 4.9800000000000004 112.468 -174.672 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.71 -134.25 52.42 Favored Glycine 0 C--N 1.339 0.743 0 C-N-CA 125.268 1.413 . . . . 2.5499999999999998 111.234 172.201 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.9 m -62.52 139.71 58.61 Favored 'General case' 0 C--O 1.246 0.918 0 O-C-N 121.824 -0.81 . . . . 3.77 110.697 165.364 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -89.51 -20.12 24.22 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 115.332 1.605 . . . . 6.21 115.332 -171.065 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.48 ' H ' HD23 ' A' ' 27' ' ' LEU . 2.5 pt? -81.27 -18.76 44.82 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.285 1.034 . . . . 5.2699999999999996 112.793 168.091 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.84 157.1 34.92 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 125.262 1.425 . . . . 1.6299999999999999 114.25 -169.553 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 88.3 mt -99.44 112.91 25.02 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.283 1.833 . . . . 1.6299999999999999 110.606 -177.085 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.35 168.55 16.52 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.983 1.313 . . . . 2.3799999999999999 112.526 170.611 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -51.46 -22.85 3.36 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 127.53 2.332 . . . . 4.0700000000000003 116.316 -175.442 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.68 -39.68 8.55 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 121.178 -0.951 . . . . 4.0199999999999996 112.96 173.972 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -48.29 -48.07 36.01 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.134 0.973 . . . . 1.6200000000000001 110.912 168.011 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.4 -48.38 67.53 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.91 1.284 . . . . 2.3599999999999999 112.444 178.306 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -51.96 -43.91 63.75 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.479 -1.388 . . . . 3.6899999999999999 112.643 174.407 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -68.18 -43.28 78.49 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.706 1.203 . . . . 3.2799999999999998 111.719 177.705 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.6 mt -53.43 -53.68 47.84 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.783 1.174 . . . . 2.7400000000000002 112.926 175.17 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.2 mt -55.15 -48.97 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.137 0.88 . . . . 0.85999999999999999 110.686 -178.481 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -64.94 -27.31 68.76 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 112.586 0.588 . . . . 3.8500000000000001 112.586 -176.738 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -87.62 -48.66 7.72 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.922 1.689 . . . . 2.7999999999999998 112.518 -179.068 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -73.34 -50.59 21.2 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.482 1.513 . . . . 4.4800000000000004 111.946 -175.26 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -95.59 61.73 2.31 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.498 1.519 . . . . 2.8500000000000001 109.313 -177.458 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 6.6 t -63.64 5.17 0.21 Allowed 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 126.05 1.74 . . . . 3.8300000000000001 115.552 -173.927 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.479 HD12 ' H ' ' A' ' 44' ' ' LEU . 5.0 mp -69.87 -24.23 63.39 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.163 1.785 . . . . 4.4500000000000002 111.968 166.926 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.17 -108.39 3.67 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 125.013 1.292 . . . . 4.7800000000000002 112.211 171.706 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 62.27 -75.65 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.843 2.057 . . . . 5.3700000000000001 112.17 -167.526 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.44 107.44 0.11 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 127.124 2.17 . . . . 2.0800000000000001 115.318 -159.095 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -67.48 151.31 47.59 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.12 0.968 . . . . 5.1500000000000004 109.811 168.752 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -60.69 -33.7 73.24 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 116.027 1.862 . . . . 3.73 116.027 -159.757 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.4 t -84.23 -16.72 42.24 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 114.145 1.165 . . . . 3.1499999999999999 114.145 171.941 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.4 t -76.2 -21.32 56.6 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.259 1.39 . . . . 2.5099999999999998 112.074 174.606 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 21.9 mm -55.92 -40.7 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 124.056 0.943 . . . . 1.54 110.994 163.546 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -69.67 -39.55 76.93 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 123.423 0.689 . . . . 3.3999999999999999 110.609 -172.88 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.98 -33.86 68.47 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.167 0.987 . . . . 2.7200000000000002 113.331 171.935 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.9 -56.55 20.59 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-N 118.831 0.741 . . . . 2.6000000000000001 109.828 171.017 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.6 ptm -71.95 -25.52 61.91 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.918 1.081 . . . . 1.8999999999999999 113.918 -176.804 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.5 ttmp? -64.6 -24.96 67.76 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.316 1.046 . . . . 4.2300000000000004 111.939 168.657 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.3 t -78.29 -25.35 46.61 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.035 1.124 . . . . 2.3999999999999999 114.035 168.3 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.5 mp -73.95 -53.85 9.19 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.174 0.99 . . . . 2.5899999999999999 113.324 178.597 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -75.45 81.92 2.51 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 122.355 1.074 . . . . 1.8200000000000001 112.295 -169.881 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.7 tmtp? -62.19 -7.46 4.18 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 115.118 1.525 . . . . 5.4699999999999998 115.118 -171.141 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.13 -26.69 13.86 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.838 1.655 . . . . 2.79 112.913 172.365 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.1 m 57.84 32.46 21.95 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.322 1.049 . . . . 3.04 112.902 -160.9 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 p30 -75.55 -6.42 50.21 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.779 0.832 . . . . 3.4900000000000002 111.876 166.433 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.35 -3.9 2.46 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 129.505 3.122 . . . . 4.0999999999999996 113.425 171.977 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -106.85 121.4 44.33 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 123.484 1.612 . . . . 2.8100000000000001 110.123 166.565 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 49.9 mt -81.29 103.6 8.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 123.013 1.387 . . . . 1.4199999999999999 108.721 178.517 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.79 151.01 30.56 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 112.844 -1.98 . . . . 4.0300000000000002 109.45 178.979 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.19 -38.14 70.56 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 120.611 -1.306 . . . . 2.6800000000000002 113.375 -177.474 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -59.18 -22.22 60.63 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.335 2.254 . . . . 4.3899999999999997 115.787 172.256 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -94.83 -47.45 6.45 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.248 1.419 . . . . 3.46 109.81 173.091 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -51.36 -26.14 7.2 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 127.432 2.293 . . . . 2.2799999999999998 115.845 -170.853 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 47.3 p -64.18 -18.7 64.73 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 120.155 -1.591 . . . . 1.9099999999999999 113.295 175.839 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.5 m -63.95 -24.22 35.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 119.54 1.064 . . . . 2.52 112.822 170.385 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -60.05 -57.23 13.74 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.633 1.173 . . . . 2.1200000000000001 111.423 173.538 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.6 mp -55.59 -41.07 72.86 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 125.827 1.651 . . . . 3.04 110.56 173.332 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 44.3 m -61.14 -50.9 71.31 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 117.172 -1.394 . . . . 0.71999999999999997 111.742 178.826 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 2.5 mpp? -52.42 -45.89 66.12 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 120.865 1.666 . . . . 2.1200000000000001 111.562 174.735 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 46.5 mt -69.69 -49.25 55.23 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.624 0.77 . . . . 1.27 111.444 -175.716 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 99.3 m -65.37 -30.21 71.01 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.614 0.968 . . . . 1.6799999999999999 113.614 176.654 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 69.3 mtp -70.17 -37.0 75.07 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 120.01 1.277 . . . . 1.73 111.203 171.874 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.64 -37.05 84.01 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.181 0.901 . . . . 0.85999999999999999 112.616 173.102 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 6.0 m-30 -68.25 -23.33 64.77 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.987 0.915 . . . . 2.3100000000000001 112.575 174.6 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -68.0 -48.5 65.58 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.438 0.695 . . . . 2.3300000000000001 111.52 174.571 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -62.49 -43.11 99.62 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.968 1.707 . . . . 2.6600000000000001 111.643 178.673 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.43 -45.52 65.99 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.303 1.441 . . . . 2.3900000000000001 111.964 174.174 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -66.79 -27.76 67.83 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.803 1.241 . . . . 2.8700000000000001 112.533 178.69 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 84.4 mt -78.01 -17.65 56.85 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.581 1.152 . . . . 1.9399999999999999 113.511 175.829 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -101.35 1.44 38.54 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 114.485 1.291 . . . . 2.8199999999999998 114.485 173.725 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -97.82 -56.58 2.46 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.06 1.344 . . . . 4.1200000000000001 111.729 171.169 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -81.82 17.52 1.49 Allowed 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 115.127 1.529 . . . . 3.0600000000000001 115.127 -170.633 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.216 0 C-N-CA 127.5 2.32 . . . . 4.1200000000000001 115.871 -175.618 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.477 0.895 0 N-CA-C 107.331 -1.359 . . . . 6.0099999999999998 107.331 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -113.43 -96.13 0.45 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 106.443 -1.688 . . . . 4.3700000000000001 106.443 -156.796 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 80.4 p -122.86 159.88 51.65 Favored Pre-proline 0 C--O 1.238 0.486 0 C-N-CA 124.073 0.949 . . . . 2.04 109.351 152.839 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -71.65 -13.71 29.95 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.877 2.385 . . . . 1.8700000000000001 111.886 163.88 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 8.8 tt -76.34 -42.95 43.15 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 123.916 0.887 . . . . 2.9500000000000002 111.322 177.501 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -60.52 -30.29 69.64 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 118.617 0.644 . . . . 4.1500000000000004 111.28 177.032 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.48 -25.75 38.66 Favored 'General case' 0 CA--C 1.548 0.869 0 O-C-N 120.786 -1.196 . . . . 3.9199999999999999 114.166 169.334 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . 0.566 ' HB2' ' HB1' ' A' ' 8' ' ' ALA . . . -62.19 -42.58 99.42 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.012 -1.055 . . . . 1.3899999999999999 111.301 171.255 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 41.1 mt -69.71 -36.63 76.07 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.638 1.175 . . . . 1.55 111.441 -175.02 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.79 -47.01 67.21 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.821 0.848 . . . . 1.5600000000000001 112.002 168.268 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.3 t -65.44 -25.06 67.35 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 120.093 1.315 . . . . 2.6499999999999999 111.966 -178.571 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 85.9 mtp -59.2 -60.11 4.38 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.143 0.977 . . . . 2.8300000000000001 110.869 169.479 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 28.1 m -61.78 -22.95 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 120.378 -1.451 . . . . 2.1600000000000001 113.112 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 90.5 m -75.48 -40.15 57.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 126.269 1.828 . . . . 0.79000000000000004 113.185 178.7 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 10.7 p -75.33 -35.29 61.22 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.112 1.323 . . . . 1.72 109.923 169.25 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -54.28 -61.38 2.34 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.85 0.86 . . . . 2.0800000000000001 109.91 -179.273 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 42.4 m170 -71.15 -24.86 62.34 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 115.005 1.483 . . . . 2.6600000000000001 115.005 178.672 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -70.19 -33.92 72.32 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 122.026 2.194 . . . . 4.0999999999999996 113.657 174.199 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -92.0 -36.18 13.55 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.155 0.889 . . . . 2.0899999999999999 112.479 175.765 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t -64.83 -29.75 70.72 Favored 'General case' 0 C--O 1.247 0.963 0 N-CA-C 113.844 1.053 . . . . 1.98 113.844 171.355 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.29 -12.24 84.77 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 126.583 2.04 . . . . 1.6699999999999999 114.675 178.893 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -76.88 -44.6 31.35 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 118.783 1.292 . . . . 3.4399999999999999 112.361 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -123.65 144.57 49.55 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 118.768 0.713 . . . . 3.2000000000000002 111.888 -171.35 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.77 -129.69 30.66 Favored Glycine 0 C--N 1.341 0.845 0 C-N-CA 125.628 1.585 . . . . 2.2799999999999998 112.791 175.528 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 12.0 t -57.62 132.47 53.32 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.609 0.719 . . . . 3.6600000000000001 110.578 166.218 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -80.89 -12.75 59.36 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.575 1.15 . . . . 7.29 113.938 177.729 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 57.5 tp -84.17 -39.98 18.72 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.62 1.168 . . . . 2.7599999999999998 111.116 171.011 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 3.1 p -108.0 148.77 29.26 Favored 'General case' 0 C--O 1.253 1.256 0 C-N-CA 125.495 1.518 . . . . 1.5900000000000001 113.421 -173.208 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 2.4 pp -122.56 112.04 17.52 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 113.104 -1.862 . . . . 1.96 111.48 -174.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 79.9 p -97.12 -170.02 1.96 Allowed 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 122.144 0.973 . . . . 1.76 113.392 -178.989 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 25.6 ttt-85 -56.08 -8.12 0.43 Allowed 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 117.948 2.573 . . . . 3.5099999999999998 117.948 -172.349 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.89 -50.73 3.75 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 113.734 1.012 . . . . 4.2599999999999998 113.734 164.295 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -54.69 -34.06 61.77 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.771 1.228 . . . . 1.9199999999999999 112.029 178.015 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 54.6 tp -70.23 -49.4 50.43 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.28 1.032 . . . . 1.9399999999999999 112.335 174.548 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -78.83 -24.4 44.46 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.373 -1.454 . . . . 3.8599999999999999 114.65 -174.021 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -46.26 -71.68 0.07 Allowed 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 117.802 -1.094 . . . . 3.23 110.503 149.903 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.18 -57.75 6.18 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.612 1.165 . . . . 1.8300000000000001 113.215 -175.726 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 22.8 mt -53.98 -44.98 63.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 119.269 0.94 . . . . 0.97999999999999998 110.13 -176.558 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 22.9 mmmt -74.56 -5.61 43.82 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.559 1.318 . . . . 5.3399999999999999 114.559 -179.847 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 8.7 mmtp -102.78 -22.11 13.95 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 120.749 1.613 . . . . 3.9500000000000002 113.699 168.351 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -91.02 -87.9 0.19 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.315 1.046 . . . . 3.8700000000000001 108.491 170.875 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -77.37 37.77 0.22 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.099 1.76 . . . . 2.23 112.842 -175.936 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 39.8 t -51.05 -27.64 8.51 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.645 1.978 . . . . 4.0800000000000001 113.488 178.604 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.584 ' H ' HD12 ' B' ' 44' ' ' LEU . 3.3 mp -60.16 -37.06 79.01 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.369 2.268 . . . . 4.2800000000000002 113.641 178.92 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -81.83 40.53 2.65 Favored Glycine 0 N--CA 1.473 1.131 0 C-N-CA 124.798 1.19 . . . . 4.0599999999999996 113.983 -169.107 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.427 ' HG3' ' H ' ' B' ' 47' ' ' MET 0.266 6.2 pt-20 46.08 -68.67 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 129.521 3.128 . . . . 4.96 114.928 -165.288 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . 0.427 ' H ' ' HG3' ' B' ' 46' ' ' GLU . 6.9 mmt 59.16 60.82 2.26 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 124.672 2.177 . . . . 3.0299999999999998 113.235 173.074 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.3 mppt? -65.51 159.46 24.44 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 111.604 -2.544 . . . . 3.6699999999999999 111.489 168.256 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.56 -41.85 6.83 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 128.275 2.63 . . . . 5.8600000000000003 115.66 -170.202 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 6.0 t -91.35 -32.97 15.47 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.456 1.102 . . . . 3.6600000000000001 113.151 177.405 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 35.9 t -62.74 -33.83 75.94 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 120.204 -1.56 . . . . 1.8600000000000001 111.398 174.074 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 3.7 mm -59.97 -38.42 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 126.974 2.11 . . . . 1.5700000000000001 112.878 166.815 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.85 -31.02 24.02 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 124.791 1.236 . . . . 2.7000000000000002 111.472 -168.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -81.67 -30.97 32.46 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.201 1.401 . . . . 4.6699999999999999 111.645 170.468 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 16.0 tp -57.74 -45.61 85.61 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.525 -0.75 . . . . 2.0899999999999999 110.061 162.355 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 3.2 ttt -58.68 -41.91 87.3 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-O 118.069 -0.967 . . . . 1.6200000000000001 113.279 173.66 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 31.0 mttp -61.02 -29.48 69.74 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 120.358 1.435 . . . . 4.8499999999999996 112.134 176.455 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 2.2 p -79.21 -37.34 38.42 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.258 0.836 . . . . 2.8700000000000001 113.258 173.643 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . 0.461 HD11 ' HB2' ' B' ' 75' ' ' PHE . 0.4 OUTLIER -67.85 -53.15 29.01 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 125.828 1.651 . . . . 2.5 110.603 179.733 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -76.85 68.08 3.0 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 123.671 1.7 . . . . 1.6299999999999999 111.19 -179.317 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -53.0 -26.51 15.6 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.905 2.482 . . . . 3.75 114.03 178.827 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -73.5 -34.39 65.27 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 118.199 -0.905 . . . . 2.8199999999999998 112.873 171.744 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 65.8 m 53.54 65.49 1.5 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.609 1.164 . . . . 3.25 111.388 -157.841 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -110.34 -74.2 0.66 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.78 1.232 . . . . 2.5800000000000001 109.893 -175.979 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 173.58 -25.23 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 131.362 3.865 . . . . 6.4800000000000004 112.765 -178.096 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -132.28 142.6 49.44 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 127.131 2.172 . . . . 3.5099999999999998 111.443 -169.342 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 46.5 mm -83.23 110.29 17.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 125.15 1.38 . . . . 1.23 109.383 172.937 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -74.45 163.18 28.08 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.86 1.664 . . . . 3.0800000000000001 110.557 161.552 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.62 -36.31 78.31 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 120.16 -1.588 . . . . 2.8100000000000001 112.627 178.446 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -71.89 -15.78 62.12 Favored 'General case' 0 CA--C 1.556 1.194 0 O-C-N 120.631 -1.293 . . . . 6.3399999999999999 111.876 177.433 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -81.14 -58.8 2.9 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.293 1.437 . . . . 1.8700000000000001 108.898 164.172 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -45.93 -45.3 15.37 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.344 2.257 . . . . 1.98 114.032 -175.532 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 56.3 m -53.76 -27.52 29.22 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.291 0.849 . . . . 2.27 113.291 178.477 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 87.5 t -62.16 -36.53 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 119.995 1.271 . . . . 1.6000000000000001 111.211 178.959 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.461 ' HB2' HD11 ' B' ' 59' ' ' LEU . 13.9 t80 -51.45 -62.08 1.84 Allowed 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.446 0.698 . . . . 1.75 111.062 174.135 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 77.9 mt -72.61 -22.72 60.92 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.993 0.917 . . . . 2.2000000000000002 112.328 -175.483 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 86.7 m -60.62 -56.16 24.69 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.631 1.173 . . . . 0.91000000000000003 110.197 169.378 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 58.1 mtm -55.58 -42.32 74.61 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 118.299 0.5 . . . . 1.5 112.099 -179.507 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 31.1 mt -71.18 -40.01 71.49 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.688 0.795 . . . . 1.4099999999999999 112.366 -177.145 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 14.7 t -64.42 -34.12 77.44 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.88 0.696 . . . . 2.2599999999999998 112.88 177.458 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 2.9 mtm -70.96 -36.59 72.63 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.596 -0.69 . . . . 3.6299999999999999 112.012 170.161 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.68 -34.66 78.36 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.76 1.164 . . . . 1.03 112.755 175.383 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -68.43 -35.6 77.84 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 119.182 0.901 . . . . 2.4500000000000002 112.343 171.922 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -64.93 -41.58 95.4 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.179 0.992 . . . . 1.8300000000000001 112.633 173.95 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -72.47 -29.78 63.96 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.043 0.937 . . . . 3.5600000000000001 111.347 179.054 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -58.75 -52.16 66.91 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.201 1.0 . . . . 2.4500000000000002 111.094 167.731 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -58.24 -32.62 68.51 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.161 1.385 . . . . 2.7200000000000002 112.13 -179.869 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 42.4 mt -72.34 -16.24 61.87 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.468 1.285 . . . . 1.8400000000000001 114.468 175.972 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.536 ' CD ' ' HZ3' ' B' ' 92' ' ' LYS . 72.8 mm-40 -97.95 -18.23 18.76 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.743 1.217 . . . . 4.5 113.839 172.915 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -101.17 -40.79 7.01 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.21 1.804 . . . . 2.9300000000000002 113.268 -169.282 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -89.34 24.23 2.28 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 124.598 1.159 . . . . 2.8500000000000001 112.989 177.65 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . 0.536 ' HZ3' ' CD ' ' B' ' 89' ' ' GLU . 38.4 mttp . . . . . 0 C--O 1.246 0.916 0 C-N-CA 126.828 2.051 . . . . 4.7000000000000002 115.14 174.496 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.8 mmt . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 107.713 -1.217 . . . . 6.2599999999999998 107.713 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 -112.08 -95.7 0.43 Allowed 'General case' 0 CA--C 1.535 0.388 0 O-C-N 125.467 1.73 . . . . 4.3899999999999997 109.215 -152.102 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.4 p -136.05 153.24 76.71 Favored Pre-proline 0 N--CA 1.468 0.461 0 C-N-CA 124.814 1.246 . . . . 1.8200000000000001 108.145 169.912 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.18 -17.75 59.45 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.221 1.947 . . . . 1.3700000000000001 112.486 176.333 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 17.1 tp -85.74 -44.64 12.35 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 118.044 -0.979 . . . . 3.02 112.524 -179.09 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -58.2 -49.47 76.95 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.84 1.2 . . . . 4.0499999999999998 109.48 165.615 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -29.9 67.19 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.473 -0.767 . . . . 4.46 112.213 178.767 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.8 -51.2 58.5 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 117.449 -1.262 . . . . 1.05 112.112 172.369 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.7 mt -55.85 -48.3 75.76 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 120.208 1.367 . . . . 1.54 111.01 174.94 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 36.9 m -52.81 -49.93 64.67 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 125.175 1.39 . . . . 1.6399999999999999 110.405 173.292 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 86.4 m -61.38 -45.8 92.85 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 120.077 1.308 . . . . 1.7 112.494 177.858 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 79.0 mtp -54.24 -48.45 71.1 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.427 1.091 . . . . 3.3700000000000001 111.711 175.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 78.0 t -78.53 -33.81 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.484 0.714 . . . . 2.9500000000000002 112.059 -176.405 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.1 m -56.37 -55.84 28.53 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.458 1.103 . . . . 1.28 110.322 170.28 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.8 t -67.84 -33.35 74.6 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 117.376 -1.297 . . . . 2.4199999999999999 110.15 -172.822 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -55.17 -48.88 73.15 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.702 0.683 . . . . 1.8100000000000001 111.504 172.962 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 23.1 m170 -64.68 -34.95 79.52 Favored 'General case' 0 CA--C 1.549 0.925 0 O-C-N 120.863 -1.148 . . . . 3.6699999999999999 112.736 178.291 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.4 tmtm? -61.12 -25.22 66.83 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.692 1.197 . . . . 5.8200000000000003 113.503 173.468 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.408 ' CE2' HD23 ' A' ' 37' ' ' LEU . 69.3 m-85 -88.27 -30.51 19.6 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 120.677 -1.264 . . . . 3.1099999999999999 112.084 168.924 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.5 p -60.26 -19.5 55.03 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 117.425 2.38 . . . . 3.1299999999999999 117.425 -172.092 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.61 -7.67 53.33 Favored Glycine 0 CA--C 1.537 1.412 0 CA-C-O 118.394 -1.226 . . . . 1.75 115.721 -178.893 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 88.5 mtt-85 -77.54 53.07 1.03 Allowed 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 120.278 2.039 . . . . 5.3899999999999997 112.785 176.197 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 121.2 175.33 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 131.221 3.808 . . . . 4.1100000000000003 108.945 -176.031 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 9.68 113.18 0.0 OUTLIER Glycine 0 N--CA 1.481 1.66 0 C-N-CA 128.615 3.007 . . . . 2.6699999999999999 117.964 178.187 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.3 m 69.86 155.51 0.13 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.59 1.156 . . . . 2.6699999999999999 113.69 166.153 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -101.05 52.26 0.85 Allowed 'General case' 0 N--CA 1.483 1.194 0 O-C-N 120.541 -1.35 . . . . 5.5599999999999996 111.136 171.883 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 tt -161.03 -58.3 0.05 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.345 1.058 . . . . 3.2599999999999998 112.338 -172.515 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.9 p -84.64 156.07 21.7 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 127.453 2.301 . . . . 1.4399999999999999 113.284 -173.883 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 18.6 mt -92.07 94.77 9.41 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 114.704 -1.134 . . . . 1.6699999999999999 109.303 161.05 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.0 m -74.37 133.55 42.49 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 125.231 1.413 . . . . 3.7999999999999998 109.304 170.486 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -0.12 -70.34 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 127.687 2.395 . . . . 4.3899999999999997 117.107 -173.476 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.56 -36.68 83.43 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 119.481 -2.012 . . . . 4.0499999999999998 114.539 -175.583 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -57.74 -41.63 82.23 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.846 1.659 . . . . 2.77 110.563 175.518 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -66.05 -40.67 91.15 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.755 1.222 . . . . 2.3599999999999999 110.711 178.944 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.1 mtpt -65.3 -41.55 93.99 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 120.712 -1.242 . . . . 3.3100000000000001 113.154 175.327 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -56.23 -51.46 68.01 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-O 117.995 -1.002 . . . . 5.0800000000000001 112.543 170.075 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.408 HD23 ' CE2' ' A' ' 19' ' ' TYR . 1.7 tm? -52.61 -57.64 9.36 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.078 0.854 . . . . 2.9700000000000002 111.154 -178.506 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 46.0 mt -54.43 -46.35 70.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 118.367 0.531 . . . . 0.79000000000000004 110.784 -178.807 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -70.08 -9.6 55.96 Favored 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 113.767 1.025 . . . . 4.5999999999999996 113.767 -176.624 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.38 -13.34 9.79 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.527 1.931 . . . . 4.4100000000000001 113.15 -178.089 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -71.45 -51.91 21.32 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.801 1.641 . . . . 4.5599999999999996 108.776 158.062 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -115.81 124.18 50.08 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.471 2.309 . . . . 2.75 108.439 179.779 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 62.0 m -107.27 -8.86 16.24 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.767 1.025 . . . . 3.8399999999999999 113.767 -178.68 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -60.99 154.77 21.67 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 119.559 1.072 . . . . 3.96 113.409 172.172 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -72.85 11.88 4.2 Favored Glycine 0 CA--C 1.537 1.423 0 N-CA-C 116.281 1.273 . . . . 3.9399999999999999 116.281 -169.315 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -85.45 -27.03 25.98 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.964 2.105 . . . . 5.6900000000000004 112.08 178.366 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.69 86.92 7.34 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 123.2 1.476 . . . . 2.6299999999999999 112.151 -178.518 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 72.7 mttt -132.14 170.63 14.72 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 127.662 2.385 . . . . 4.9800000000000004 111.245 -177.552 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.96 -46.8 71.71 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.293 -0.88 . . . . 4.2000000000000002 113.039 -164.81 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.8 m -63.04 -25.49 68.4 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.366 1.617 . . . . 2.77 115.366 176.403 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.6 p -94.56 6.78 47.8 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.513 1.125 . . . . 2.8900000000000001 112.735 171.554 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 28.2 mt -125.32 -35.48 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.885 1.274 . . . . 1.3300000000000001 113.448 -173.546 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -82.55 -29.47 30.31 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.478 1.035 . . . . 3.9700000000000002 112.244 179.27 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -66.62 -45.09 80.23 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 118.513 0.597 . . . . 2.46 110.052 158.683 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.5 tp -59.75 -39.38 84.57 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 118.552 -0.737 . . . . 1.79 110.636 -177.806 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.1 tpt -51.75 -59.5 4.23 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 119.241 0.928 . . . . 2.1499999999999999 109.996 165.853 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.19 -19.16 19.04 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 125.808 1.643 . . . . 3.96 115.008 176.367 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.8 m -98.98 -29.42 12.93 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.723 2.009 . . . . 3.1600000000000001 113.515 -178.006 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 97.5 mt -83.27 -42.81 16.76 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.494 1.518 . . . . 1.8899999999999999 111.814 170.873 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -73.76 81.28 1.59 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.418 2.287 . . . . 2.0099999999999998 111.663 -175.694 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -51.7 -32.45 30.06 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 115.247 1.573 . . . . 3.0600000000000001 115.247 -173.014 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -81.88 -11.96 58.67 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.973 1.101 . . . . 1.9399999999999999 113.973 178.793 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.8 t 55.4 45.53 25.16 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.558 1.143 . . . . 2.4399999999999999 111.72 -169.387 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -102.33 -131.89 0.27 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.575 1.95 . . . . 2.96 107.796 178.876 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -142.47 1.06 1.34 Allowed 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 120.337 1.426 . . . . 3.7599999999999998 114.741 164.326 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -103.07 134.17 46.95 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 126.485 1.914 . . . . 2.3500000000000001 109.324 173.548 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.7 mm -96.47 114.06 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 126.581 1.952 . . . . 1.4299999999999999 109.914 171.965 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -88.77 157.2 18.57 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.879 1.271 . . . . 2.6899999999999999 108.759 163.401 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -49.85 -42.17 46.82 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.326 -1.484 . . . . 2.3100000000000001 114.44 -177.394 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.457 ' H ' ' HD2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -69.85 -11.43 60.85 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 114.524 1.305 . . . . 3.1800000000000002 114.524 176.791 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -84.84 -56.06 3.77 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 124.929 1.292 . . . . 1.8 108.004 162.157 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -50.02 -45.14 51.71 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.192 1.797 . . . . 2.3100000000000001 115.771 -176.209 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.9 m -65.03 -8.61 16.84 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 120.793 -1.192 . . . . 2.0099999999999998 113.468 -177.313 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 99.7 t -62.24 -37.02 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 119.585 1.084 . . . . 2.2200000000000002 110.939 167.32 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -65.66 -52.35 52.35 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.18 0.992 . . . . 2.1299999999999999 110.036 178.083 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -55.67 -44.51 77.33 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.627 1.171 . . . . 2.2799999999999998 110.783 176.844 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.3 m -58.53 -52.32 66.15 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.764 0.826 . . . . 0.87 111.855 173.831 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 73.3 mtm -61.92 -35.58 78.82 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.229 0.922 . . . . 1.45 112.404 -179.476 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.75 -50.5 42.74 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 123.857 0.863 . . . . 2.98 111.623 175.715 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 28.1 m -60.66 -33.79 73.33 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 118.42 -0.8 . . . . 1.3799999999999999 112.737 174.428 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 62.6 mtp -70.58 -37.36 73.94 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.008 0.822 . . . . 2.1800000000000002 111.795 172.554 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.51 -41.63 92.97 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 119.571 1.078 . . . . 0.85999999999999999 111.047 173.5 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -70.85 -32.7 69.8 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.702 1.137 . . . . 2.3900000000000001 113.614 175.406 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -58.41 -52.28 66.28 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.407 1.083 . . . . 3.0600000000000001 110.718 168.189 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -67.95 -41.59 82.25 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.558 1.143 . . . . 4.1600000000000001 112.643 -177.262 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.63 -48.93 79.73 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.909 1.684 . . . . 2.6400000000000001 110.576 173.055 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -58.59 -36.96 74.82 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 123.974 0.91 . . . . 3.4199999999999999 111.991 -179.89 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 54.5 mt -72.87 -15.89 61.59 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.37 1.068 . . . . 2.7200000000000002 113.264 177.365 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -106.41 -7.85 17.44 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.433 1.493 . . . . 3.7599999999999998 114.505 175.963 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -108.41 -51.38 2.9 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.412 1.485 . . . . 3.48 112.375 -175.114 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -82.86 27.1 0.55 Allowed 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 125.122 1.369 . . . . 2.5800000000000001 113.085 179.561 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.252 1.199 0 C-N-CA 128.337 2.655 . . . . 3.9399999999999999 115.685 -178.182 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.473 0.714 0 N-CA-C 108.256 -1.016 . . . . 10.539999999999999 108.256 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -146.2 -72.77 0.23 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.861 2.064 . . . . 6.1699999999999999 111.697 -160.68 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 44.3 p -97.08 161.36 26.49 Favored Pre-proline 0 N--CA 1.468 0.461 0 C-N-CA 125.783 1.633 . . . . 2.25 111.279 -154.664 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -62.06 -21.21 72.0 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 121.887 1.725 . . . . 1.3899999999999999 111.696 171.122 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -85.96 -39.54 16.8 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-O 116.683 -1.627 . . . . 2.8199999999999998 113.837 178.101 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -57.69 -37.9 74.25 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 121.925 2.148 . . . . 5.1799999999999997 110.665 166.663 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -72.95 -26.71 61.47 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.087 -1.008 . . . . 4.7999999999999998 112.718 178.14 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.05 -44.53 38.67 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.218 0.607 . . . . 1.0600000000000001 112.004 171.454 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 58.2 mt -57.13 -45.61 83.35 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.987 1.315 . . . . 1.79 110.936 175.843 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 20.6 p -68.16 -43.57 77.94 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 116.875 -1.536 . . . . 2.2400000000000002 112.501 175.385 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 52.7 m -55.55 -43.18 75.61 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 120.567 1.531 . . . . 1.54 111.028 172.312 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -51.88 66.35 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.121 0.968 . . . . 4.0499999999999998 110.019 178.815 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 75.7 t -64.26 -31.78 54.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 O-C-N 121.158 -0.964 . . . . 1.8999999999999999 112.907 176.436 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 81.2 m -60.72 -57.89 10.76 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.543 1.137 . . . . 1.1399999999999999 109.841 176.135 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.44 -28.34 61.91 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 123.918 0.761 . . . . 3.1499999999999999 110.006 -173.598 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -55.85 -53.87 51.46 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-O 119.129 -0.462 . . . . 1.9199999999999999 110.571 166.573 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 49.0 m80 -70.28 -33.62 71.79 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 120.18 1.355 . . . . 2.6600000000000001 113.076 -178.609 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -64.26 -27.52 69.1 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.042 1.127 . . . . 4.9000000000000004 114.042 174.483 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -100.23 -34.55 9.97 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.993 1.317 . . . . 2.3199999999999998 112.995 177.8 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 7.4 t -82.03 -33.19 30.1 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 126.003 1.721 . . . . 2.0899999999999999 113.331 -178.69 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.54 -11.17 83.47 Favored Glycine 0 CA--C 1.525 0.68 0 O-C-N 120.949 -1.095 . . . . 1.6100000000000001 112.514 170.046 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -57.52 -41.14 80.28 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.671 1.236 . . . . 4.6100000000000003 112.402 -167.791 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -139.22 152.88 47.7 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 126.606 1.962 . . . . 4.9699999999999998 111.676 179.529 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 60.75 2.2 2.35 Favored Glycine 0 CA--C 1.535 1.324 0 O-C-N 121.112 -0.993 . . . . 2.1800000000000002 113.509 -165.302 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 6.0 t 59.47 -154.54 0.37 Allowed 'General case' 0 C--O 1.254 1.315 0 C-N-CA 126.022 1.729 . . . . 6.5199999999999996 111.477 -159.398 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 72.4 mttt 85.07 174.79 0.06 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 129.975 3.31 . . . . 10.65 113.738 156.16 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -76.71 19.33 0.28 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.68 0.792 . . . . 2.8799999999999999 112.721 158.0 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 69.7 p -121.06 132.83 55.12 Favored 'General case' 0 C--O 1.251 1.168 0 CA-C-O 122.978 1.371 . . . . 1.3100000000000001 113.588 -177.096 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -111.42 111.15 21.98 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 112.537 -2.12 . . . . 2.1600000000000001 110.913 177.13 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -88.29 170.02 11.34 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 121.517 0.675 . . . . 2.6699999999999999 111.789 166.364 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 -43.93 -29.59 0.59 Allowed 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 118.928 2.936 . . . . 3.2000000000000002 118.928 -162.803 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.92 -36.47 23.29 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.389 1.255 . . . . 5.2000000000000002 114.389 173.0 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -63.58 -49.58 72.81 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 106.845 -1.539 . . . . 2.1200000000000001 106.845 171.609 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 57.9 tp -56.13 -47.56 77.92 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.644 0.778 . . . . 2.5699999999999998 112.808 174.18 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -58.33 -44.4 88.65 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.394 0.997 . . . . 2.98 111.865 -176.245 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -79.79 -17.66 52.83 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.215 1.561 . . . . 4.1900000000000004 115.215 -179.65 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 2.3 tt -72.32 -54.99 7.9 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.983 1.265 . . . . 1.8799999999999999 110.695 165.795 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 33.4 mt -53.24 -44.57 53.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 CA-C-N 119.42 1.009 . . . . 1.03 110.688 -173.565 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -63.13 -13.93 42.58 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.044 1.127 . . . . 4.1399999999999997 114.044 -177.091 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -95.06 -18.67 20.81 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.471 1.908 . . . . 3.1499999999999999 112.607 176.159 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -96.02 -56.62 2.59 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.828 1.651 . . . . 5.8700000000000001 109.894 178.189 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -99.19 71.65 1.82 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.122 1.369 . . . . 2.7400000000000002 109.574 -179.237 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 14.2 p -73.33 -2.42 22.03 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.014 0.926 . . . . 4.6200000000000001 113.285 167.245 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.419 HD23 ' H ' ' B' ' 44' ' ' LEU . 2.2 pt? -138.39 162.57 34.08 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.854 2.461 . . . . 4.7800000000000002 110.371 -178.88 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.13 -129.83 10.03 Favored Glycine 0 N--CA 1.468 0.83 0 N-CA-C 108.884 -1.687 . . . . 5.3799999999999999 108.884 -165.43 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -148.62 64.73 1.06 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 122.761 1.267 . . . . 5.7000000000000002 111.805 168.139 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.15 66.78 3.01 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 123.871 1.795 . . . . 2.2200000000000002 112.019 176.303 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -63.31 143.92 57.39 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.106 -1.406 . . . . 4.25 109.614 165.199 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -57.78 -24.92 59.53 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.643 1.349 . . . . 4.4299999999999997 114.643 -174.342 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 8.6 t -78.45 -27.74 46.46 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 120.732 -1.23 . . . . 2.6899999999999999 113.71 172.332 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 3.6 m -65.87 -17.01 64.36 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.247 0.931 . . . . 2.6400000000000001 111.848 175.307 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 39.9 mm -64.53 -38.96 83.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 125.34 1.456 . . . . 1.6100000000000001 112.031 177.475 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.28 -30.07 65.83 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.509 1.123 . . . . 3.1600000000000001 112.311 -177.1 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -83.71 -40.67 18.58 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.776 0.83 . . . . 2.5899999999999999 112.27 172.793 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.35 -35.32 77.12 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.343 -0.848 . . . . 2.7200000000000002 110.819 173.483 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 2.5 ttt -52.79 -51.62 60.0 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 118.874 -0.584 . . . . 2.1200000000000001 110.93 167.574 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -71.81 -27.14 62.72 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.58 1.082 . . . . 5.79 113.008 -178.112 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 8.6 t -61.08 -31.82 71.49 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 113.868 1.062 . . . . 2.2000000000000002 113.868 168.64 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -114.6 -29.69 6.74 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 116.939 2.2 . . . . 2.6299999999999999 116.939 -176.119 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -76.29 85.14 3.08 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 124.725 1.21 . . . . 1.6399999999999999 107.809 168.419 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -47.43 -35.67 8.83 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.832 1.419 . . . . 4.7800000000000002 114.832 -164.943 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 44.1 p30 -96.58 -14.5 22.17 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.724 1.379 . . . . 2.6099999999999999 114.724 -179.917 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 70.9 m 53.98 62.97 2.35 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.932 1.293 . . . . 3.4900000000000002 111.644 -167.158 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 14.2 p30 -87.92 -79.49 0.29 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.044 1.338 . . . . 2.9300000000000002 108.787 177.306 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -178.92 -27.54 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 129.812 3.245 . . . . 5.5899999999999999 112.66 168.57 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -113.64 142.41 46.04 Favored 'General case' 0 C--O 1.242 0.667 0 C-N-CA 126.475 1.91 . . . . 2.7200000000000002 108.942 -174.366 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 6.3 mt -119.99 109.59 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 123.586 0.754 . . . . 1.5700000000000001 111.18 -176.451 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -84.06 157.61 21.73 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.008 2.123 . . . . 3.8100000000000001 110.987 172.731 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.93 -33.96 39.73 Favored 'General case' 0 CA--C 1.551 1.01 0 O-C-N 120.578 -1.326 . . . . 2.3999999999999999 114.11 179.92 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -75.67 -19.28 59.26 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 119.982 -1.699 . . . . 5.29 112.874 176.669 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -78.64 -63.65 1.36 Allowed 'General case' 0 CA--C 1.551 0.981 0 O-C-N 121.004 -1.06 . . . . 2.1800000000000002 108.624 160.727 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -58.03 -22.49 50.15 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.381 2.672 . . . . 2.27 117.093 -172.387 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 2.3 p -58.54 -21.35 52.17 Favored 'General case' 0 N--CA 1.481 1.075 0 O-C-N 119.117 -2.24 . . . . 2.8999999999999999 112.718 170.48 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.4 p -71.2 -33.33 50.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 O-C-N 121.55 -0.718 . . . . 2.4500000000000002 112.432 171.93 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -62.97 -51.72 65.78 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.197 0.908 . . . . 1.98 110.833 174.611 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 92.2 mt -53.51 -37.65 62.97 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.069 0.948 . . . . 1.79 111.687 174.678 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 55.1 m -74.26 -39.33 63.08 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.42 1.088 . . . . 1.6299999999999999 113.205 179.315 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 77.1 mtm -64.05 -44.97 90.87 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.491 1.041 . . . . 2.1600000000000001 110.95 172.837 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 71.6 mt -63.31 -46.09 88.32 Favored 'General case' 0 CA--C 1.528 0.098 0 CA-C-O 118.495 -0.764 . . . . 2.0099999999999998 112.176 178.191 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.9 p -59.71 -34.61 73.12 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.793 1.179 . . . . 3.98 112.655 178.834 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 20.9 mtp -72.34 -30.73 65.01 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.519 1.303 . . . . 2.48 114.519 173.002 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.27 -33.26 74.93 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 120.62 1.555 . . . . 1.28 111.536 171.543 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -73.07 -26.54 61.3 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.723 1.008 . . . . 2.8500000000000001 113.723 173.773 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -55.44 -53.8 51.81 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.93 1.241 . . . . 3.0600000000000001 110.213 166.008 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.17 -31.94 72.69 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.367 1.067 . . . . 3.6200000000000001 113.082 -175.861 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.0 -40.89 99.15 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.814 1.246 . . . . 2.5299999999999998 112.186 170.837 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -74.45 -30.3 61.83 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.331 1.452 . . . . 3.2200000000000002 112.134 176.563 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 34.9 mt -66.84 -30.1 70.2 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 117.289 -1.339 . . . . 2.6299999999999999 113.589 179.915 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -83.21 -6.31 59.43 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 114.363 1.246 . . . . 4.1699999999999999 114.363 174.834 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -92.92 -53.39 4.17 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.663 0.785 . . . . 4.5499999999999998 110.897 169.141 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -75.84 12.84 0.96 Allowed 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.798 1.407 . . . . 4.0599999999999996 114.798 -168.296 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.937 0 C-N-CA 128.978 2.911 . . . . 5.1900000000000004 113.334 179.71 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.5 mtt . . . . . 0 N--CA 1.477 0.91 0 N-CA-C 107.525 -1.287 . . . . 6.6100000000000003 107.525 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.3 mp0 -114.57 -95.74 0.46 Allowed 'General case' 0 CA--C 1.54 0.577 0 O-C-N 124.778 1.298 . . . . 4.4800000000000004 110.953 -151.172 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -140.72 155.83 69.21 Favored Pre-proline 0 N--CA 1.474 0.753 0 C-N-CA 124.648 1.179 . . . . 2.0 109.352 176.781 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.18 -20.78 27.93 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.434 2.089 . . . . 1.3899999999999999 112.963 -179.066 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 tt -82.68 -41.15 19.71 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.271 1.028 . . . . 2.6099999999999999 110.438 174.482 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.431 ' CD ' ' HZ2' ' A' ' 7' ' ' LYS . 4.0 tm-20 -64.97 -38.69 91.8 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.632 0.73 . . . . 3.73 109.944 175.315 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.483 ' HA ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -70.57 -34.14 71.87 Favored 'General case' 0 C--O 1.232 0.159 0 O-C-N 120.546 -1.346 . . . . 4.9900000000000002 113.32 176.569 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.82 -47.61 82.13 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.567 0.747 . . . . 1.1000000000000001 111.934 169.23 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.3 mt -64.7 -36.02 82.93 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.463 1.029 . . . . 1.8 112.857 173.406 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 57.8 m -61.06 -42.33 98.3 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.995 0.918 . . . . 1.4099999999999999 111.437 172.537 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.5 m -57.93 -34.15 69.57 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.084 1.353 . . . . 1.5800000000000001 111.689 -178.958 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 10.2 mmt -53.65 -65.94 0.48 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.087 1.355 . . . . 3.1699999999999999 111.068 174.355 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.3 m -63.1 -28.39 44.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 CA-C-N 118.792 0.724 . . . . 2.1299999999999999 112.546 -176.162 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.0 m -70.01 -48.24 58.88 Favored 'General case' 0 CA--C 1.502 -0.877 0 C-N-CA 125.618 1.567 . . . . 1.48 112.691 -178.826 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.24 -35.48 48.24 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 117.772 -1.109 . . . . 2.9900000000000002 108.859 177.524 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.4 t80 -53.24 -45.13 68.62 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.994 0.918 . . . . 2.2000000000000002 111.897 -177.168 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.3 m80 -69.38 -11.97 61.27 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.671 1.36 . . . . 2.6400000000000001 114.671 -175.839 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -30.11 66.17 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 120.661 -1.274 . . . . 4.0800000000000001 111.11 170.562 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -102.98 -46.59 4.61 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.922 1.289 . . . . 2.0499999999999998 112.234 -176.888 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.7 p -65.41 -24.3 67.17 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 124.629 1.172 . . . . 2.3100000000000001 113.764 -178.597 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.09 7.42 60.07 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 127.357 2.408 . . . . 1.3100000000000001 115.6 177.607 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -87.26 -102.35 0.07 Allowed 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.053 1.426 . . . . 4.6600000000000001 109.903 170.792 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -66.78 161.99 22.46 Favored 'General case' 0 C--O 1.246 0.889 0 C-N-CA 124.772 1.229 . . . . 4.9800000000000004 113.421 -176.482 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.42 -134.55 51.75 Favored Glycine 0 C--N 1.341 0.816 0 C-N-CA 125.266 1.412 . . . . 1.8999999999999999 111.925 163.759 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.0 t -69.23 151.38 46.37 Favored 'General case' 0 C--O 1.251 1.159 0 CA-C-O 123.26 1.505 . . . . 3.0499999999999998 112.262 163.359 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -73.26 -22.2 60.45 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.989 0.916 . . . . 5.6399999999999997 112.958 171.174 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 28.8 tp -83.55 -11.18 57.71 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.307 1.043 . . . . 3.8399999999999999 112.65 175.748 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.0 p -115.59 154.33 29.61 Favored 'General case' 0 C--O 1.246 0.873 0 C-N-CA 125.981 1.712 . . . . 1.22 112.118 -177.367 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.4 ' HA ' ' OE1' ' A' ' 33' ' ' GLU 0.316 0.3 OUTLIER -121.6 108.18 13.27 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.862 1.06 . . . . 1.8600000000000001 113.862 166.582 . . . . . . . . 4 4 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.0 t -71.77 174.16 7.23 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 124.661 1.184 . . . . 2.48 113.993 174.336 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.446 HH21 ' CG ' ' A' ' 53' ' ' ASP . 19.1 ttt-85 -66.33 8.95 0.18 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 115.75 1.759 . . . . 4.4299999999999997 115.75 -170.181 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.06 -37.92 2.89 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 119.979 -1.7 . . . . 5.2000000000000002 112.381 166.279 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.4 ' OE1' ' HA ' ' A' ' 29' ' ' LEU . 35.7 mt-10 -52.67 -54.55 31.95 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.434 1.016 . . . . 1.54 111.007 165.834 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 22.0 tp -74.66 -32.55 62.28 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.54 0.736 . . . . 2.5499999999999998 112.476 -176.423 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -51.92 -47.85 64.46 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.631 0.651 . . . . 3.5 111.119 171.519 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.513 ' HG3' ' HE2' ' A' ' 40' ' ' LYS . 13.1 tp10 -91.64 4.06 53.58 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.08 1.141 . . . . 4.8099999999999996 114.08 -175.222 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 tt -78.49 -61.93 1.85 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.452 1.101 . . . . 1.8600000000000001 108.849 154.661 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.8 mt -51.32 -44.61 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 125.095 1.358 . . . . 0.89000000000000001 110.65 -178.214 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.02 -20.01 64.91 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.838 1.051 . . . . 3.9700000000000002 113.838 -177.007 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.513 ' HE2' ' HG3' ' A' ' 36' ' ' GLU . 43.2 mttm -102.36 -38.71 7.49 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 124.883 1.273 . . . . 2.75 112.336 179.508 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -58.9 -77.56 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 128.958 2.903 . . . . 4.7300000000000004 109.464 171.29 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.5 mt -81.04 48.2 1.09 Allowed 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.569 -1.332 . . . . 2.6000000000000001 112.798 -179.265 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.37 14.04 0.08 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 125.19 1.396 . . . . 3.21 114.485 176.794 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.429 HD23 ' H ' ' A' ' 44' ' ' LEU . 1.7 pt? -122.69 -3.15 8.77 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.181 2.192 . . . . 3.8300000000000001 114.436 -178.045 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -114.75 -178.99 18.85 Favored Glycine 0 N--CA 1.473 1.154 0 C-N-CA 124.867 1.223 . . . . 3.6000000000000001 114.208 -177.694 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -71.67 34.12 0.06 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 127.906 2.482 . . . . 6.3600000000000003 113.897 -176.359 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -81.46 53.98 2.22 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.668 2.387 . . . . 1.8600000000000001 115.821 -153.478 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.6 tttt -81.85 166.64 19.78 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 128.282 2.633 . . . . 6.0599999999999996 111.259 -179.899 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -45.79 -53.39 9.65 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.31 1.044 . . . . 5.71 113.332 -174.111 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.7 m -70.88 -31.15 67.73 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 113.923 1.082 . . . . 2.3399999999999999 113.923 178.819 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.2 m -65.16 -20.46 66.46 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.908 0.883 . . . . 2.3799999999999999 112.225 171.531 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 59.1 mt -93.8 -30.67 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 126.288 1.835 . . . . 1.22 111.314 174.043 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.446 ' CG ' HH21 ' A' ' 31' ' ' ARG . 5.6 t0 -70.45 -43.54 69.66 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.505 1.122 . . . . 3.1099999999999999 112.316 -178.233 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -69.11 -31.92 70.96 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.141 -0.974 . . . . 3.4500000000000002 111.502 174.431 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.71 -54.66 42.58 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.395 1.078 . . . . 2.7599999999999998 109.482 172.03 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.5 mmm -52.33 -41.14 62.75 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 127.257 2.223 . . . . 2.6699999999999999 112.038 174.403 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -26.94 66.82 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.561 1.545 . . . . 4.3899999999999997 113.043 177.639 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.6 t -92.69 -20.53 20.72 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.346 -1.471 . . . . 2.6600000000000001 113.272 171.97 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.3 -42.37 93.14 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 127.759 2.424 . . . . 2.9700000000000002 111.682 172.159 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -87.2 154.86 20.39 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 115.148 1.536 . . . . 1.96 115.148 -177.051 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -125.76 10.99 7.79 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 126.074 1.75 . . . . 3.0800000000000001 113.805 177.408 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -137.37 -34.94 0.69 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 116.064 1.876 . . . . 2.02 116.064 -162.563 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 75.07 26.95 1.18 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.701 1.601 . . . . 3.0899999999999999 111.551 -161.825 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 39.1 p-10 -93.73 -16.88 23.78 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.482 1.513 . . . . 2.3300000000000001 112.64 -169.84 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 68.78 -0.09 2.49 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.659 2.383 . . . . 4.2699999999999996 115.59 -178.333 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -101.25 140.85 34.98 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 122.244 1.021 . . . . 2.75 110.035 160.546 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 48.6 mm -100.25 113.5 36.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 106.622 -1.622 . . . . 1.1699999999999999 106.622 164.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.66 161.05 28.85 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.903 1.281 . . . . 2.5699999999999998 111.465 172.701 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -58.38 -26.69 63.49 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 115.008 1.485 . . . . 2.3599999999999999 115.008 -176.272 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.2 mtmm -79.82 -32.54 40.68 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.755 -1.215 . . . . 4.1200000000000001 112.397 173.222 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -60.67 -46.97 88.32 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 109.319 -0.623 . . . . 1.8999999999999999 109.319 168.94 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -58.28 -32.41 68.39 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.189 1.796 . . . . 2.3999999999999999 113.856 173.281 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.3 m -61.21 -29.84 70.06 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 119.603 -1.936 . . . . 2.5499999999999998 113.178 168.127 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 43.1 t -73.85 -36.07 44.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 O-C-N 121.127 -0.983 . . . . 2.9300000000000002 110.881 175.926 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -61.94 -51.44 68.09 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 118.911 0.778 . . . . 1.9399999999999999 112.853 170.842 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.4 mt -59.3 -33.29 70.92 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.467 0.707 . . . . 2.0099999999999998 111.578 174.95 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 92.7 m -60.52 -47.48 85.98 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 118.231 -0.89 . . . . 1.1100000000000001 111.346 168.919 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 16.1 mtm -58.08 -44.51 87.62 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 120.118 1.326 . . . . 1.79 112.022 177.441 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.0 mt -71.21 -43.63 66.98 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.546 0.612 . . . . 1.6399999999999999 112.632 -179.189 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 9.9 t -66.09 -26.37 67.44 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.294 -0.878 . . . . 1.51 112.852 175.462 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 76.7 mtp -72.45 -40.11 67.28 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.306 -0.871 . . . . 1.74 112.472 166.03 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.17 -38.5 89.27 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.571 1.078 . . . . 1.3500000000000001 112.757 -178.963 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -65.11 -24.07 67.33 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.839 1.052 . . . . 2.2400000000000002 113.839 171.648 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -70.92 -44.11 66.86 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.3 0.954 . . . . 2.9300000000000002 112.864 179.009 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -60.22 -47.32 86.46 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.766 1.227 . . . . 3.1400000000000001 110.66 170.959 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -50.84 -40.84 56.92 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.907 1.283 . . . . 2.6299999999999999 112.672 176.919 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -70.61 -30.78 67.53 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.001 1.321 . . . . 2.0600000000000001 112.966 179.304 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 60.2 mt -78.55 -20.6 50.3 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.21 1.004 . . . . 1.6100000000000001 112.278 176.612 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.445 ' HA ' ' HE2' ' A' ' 92' ' ' LYS . 59.3 mm-40 -90.01 -6.67 55.34 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.553 1.316 . . . . 3.79 114.553 174.487 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -100.11 -54.22 2.94 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.359 1.863 . . . . 2.8100000000000001 112.946 178.63 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.03 45.96 0.56 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.155 1.782 . . . . 2.6000000000000001 112.758 -177.096 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.445 ' HE2' ' HA ' ' A' ' 89' ' ' GLU . 52.0 mmtt . . . . . 0 C--O 1.252 1.237 0 C-N-CA 128.25 2.62 . . . . 3.4300000000000002 114.98 173.064 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 107.987 -1.116 . . . . 6.2199999999999998 107.987 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 10.1 mp0 -104.51 -67.37 0.91 Allowed 'General case' 0 CA--C 1.538 0.501 0 O-C-N 124.93 1.394 . . . . 4.7699999999999996 112.677 -148.597 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 1.3 t -162.58 149.86 11.22 Favored Pre-proline 0 N--CA 1.473 0.691 0 C-N-CA 124.315 1.046 . . . . 2.46 110.727 -166.334 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -62.54 -18.84 65.63 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 122.961 2.441 . . . . 1.3 114.089 175.869 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.7 -54.65 6.36 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.93 1.241 . . . . 2.6000000000000001 111.169 179.49 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -62.88 -30.97 71.92 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.931 0.787 . . . . 4.7599999999999998 110.657 174.482 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -62.98 -45.78 90.81 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 119.927 -1.733 . . . . 7.8399999999999999 111.471 166.512 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.5 -50.62 73.1 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.426 1.09 . . . . 0.90000000000000002 111.1 177.566 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 70.5 mt -56.99 -47.04 81.74 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.493 1.117 . . . . 1.52 111.704 172.696 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 96.9 m -56.53 -44.38 80.76 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.488 0.715 . . . . 1.4199999999999999 111.362 175.222 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 91.8 m -63.69 -44.56 93.32 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.406 1.482 . . . . 1.4099999999999999 109.842 179.336 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 79.7 mtp -57.13 -51.36 69.62 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.561 0.744 . . . . 3.0699999999999998 110.617 174.376 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 53.2 t -63.39 -30.45 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 N-CA-C 113.367 0.877 . . . . 1.8400000000000001 113.367 176.422 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 82.4 m -62.79 -52.6 62.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.877 1.271 . . . . 0.89000000000000001 110.246 174.717 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -31.78 69.37 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 118.545 -0.741 . . . . 1.6499999999999999 111.311 169.636 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -69.06 -58.41 4.13 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 118.642 0.655 . . . . 2.1000000000000001 111.942 -175.398 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 6.5 m170 -73.53 -12.31 60.73 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 120.307 1.412 . . . . 2.3799999999999999 114.281 177.287 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -67.51 -66.92 0.5 Allowed 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.247 -0.908 . . . . 4.2800000000000002 111.626 157.702 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -70.93 -32.53 69.46 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.73 1.011 . . . . 2.1299999999999999 113.73 -172.517 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 8.2 p -65.1 -18.32 65.2 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 120.477 -1.389 . . . . 2.0699999999999998 112.225 169.301 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.64 9.25 77.45 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 126.048 1.785 . . . . 1.74 114.777 171.058 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -72.72 -24.22 60.96 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.597 1.698 . . . . 3.9199999999999999 112.304 174.262 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -161.4 152.67 18.67 Favored 'General case' 0 C--O 1.252 1.214 0 C-N-CA 125.415 1.486 . . . . 3.3399999999999999 111.91 179.494 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.84 -131.34 52.0 Favored Glycine 0 C--N 1.339 0.697 0 C-N-CA 126.013 1.768 . . . . 2.7400000000000002 111.061 168.018 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.5 m -57.65 125.49 23.16 Favored 'General case' 0 C--O 1.248 1.025 0 O-C-N 122.139 -0.624 . . . . 3.1800000000000002 110.246 166.34 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -74.83 66.86 1.56 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.997 2.119 . . . . 8.0899999999999999 109.667 158.226 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 63.8 tp -167.97 -53.88 0.02 OUTLIER 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 127.526 2.33 . . . . 2.7200000000000002 107.728 -176.54 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 60.7 p -94.84 158.1 15.64 Favored 'General case' 0 C--O 1.252 1.196 0 C-N-CA 125.752 1.621 . . . . 1.23 112.911 176.429 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -103.82 116.8 32.95 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 127.05 2.14 . . . . 2.6499999999999999 109.701 169.112 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 3.0 p -74.34 165.98 24.26 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.141 0.576 . . . . 2.3900000000000001 111.602 164.674 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 15.8 tpp180 -41.49 -33.01 0.38 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.517 1.927 . . . . 4.7000000000000002 113.778 167.98 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.61 -40.11 12.81 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 120.698 -1.251 . . . . 4.4900000000000002 113.753 -179.353 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -56.84 -44.08 81.75 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.45 0.643 . . . . 2.02 110.457 170.564 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 tp -66.75 -44.31 81.81 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.35 1.06 . . . . 2.0600000000000001 112.138 -179.498 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -57.38 -37.25 72.36 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.804 1.242 . . . . 2.9399999999999999 113.175 178.631 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -62.96 -65.76 0.64 Allowed 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 117.839 -1.077 . . . . 3.75 111.087 168.831 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 tp -48.06 -57.31 5.98 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 127.779 2.432 . . . . 2.2200000000000002 112.024 -175.107 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 34.9 mt -56.17 -56.87 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.065 0.848 . . . . 1.29 110.135 -177.395 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -24.02 66.13 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.632 0.773 . . . . 5.4299999999999997 112.446 -174.111 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.95 -31.84 12.89 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.092 1.757 . . . . 6.21 112.835 -173.586 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.6 mm-40 -97.04 -21.22 17.51 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 119.407 1.003 . . . . 5.25 112.712 176.924 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -113.31 118.27 34.15 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 119.712 1.142 . . . . 2.2000000000000002 108.488 171.755 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 15.7 p -139.55 10.73 2.49 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.756 1.222 . . . . 3.2400000000000002 113.623 -175.103 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -68.92 -42.9 76.18 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.615 1.566 . . . . 3.2000000000000002 111.088 -177.265 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -96.88 165.4 23.13 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 110.211 -1.156 . . . . 3.0800000000000001 110.211 156.475 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.91 96.88 0.45 Allowed 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.899 -1.149 . . . . 5.4800000000000004 107.899 165.891 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 8.0 tpt -72.27 75.93 0.99 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.396 1.879 . . . . 2.8500000000000001 112.263 -168.088 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.44 ' H ' ' HE2' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -83.49 163.73 20.29 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.731 1.613 . . . . 3.8100000000000001 114.45 -161.669 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -47.82 -59.95 2.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.775 1.63 . . . . 5.0 112.057 177.839 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 13.1 m -71.77 6.09 2.17 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 115.179 1.548 . . . . 2.6000000000000001 115.179 178.973 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 34.3 p -119.83 16.73 12.67 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.768 -1.208 . . . . 2.79 112.554 163.708 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 35.1 mt -110.42 -47.64 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.018 0.927 . . . . 1.55 111.976 171.691 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -71.89 -30.43 65.38 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.996 1.271 . . . . 3.0699999999999998 113.255 -173.386 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -65.52 -37.05 85.64 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.924 0.784 . . . . 2.4199999999999999 111.5 167.56 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 10.0 tt -60.93 -43.54 98.49 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 117.73 -1.129 . . . . 2.6200000000000001 110.097 176.092 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 6.3 ttt -59.34 -50.55 73.55 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 120.099 1.318 . . . . 1.8700000000000001 113.276 170.632 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 2.0 tmtt? -52.49 -33.32 44.25 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.71 1.204 . . . . 4.2699999999999996 112.195 173.272 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 63.3 m -86.58 -22.94 25.98 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.758 1.623 . . . . 2.5299999999999998 113.532 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 9.5 mt -70.16 -42.18 72.84 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 120.159 1.345 . . . . 1.9199999999999999 110.877 169.386 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.71 141.53 43.58 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.235 1.414 . . . . 2.6400000000000001 113.093 -179.929 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 33.9 mmtm -124.21 -1.06 8.23 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.69 1.196 . . . . 3.23 113.066 172.432 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 31.4 p-10 -113.47 -48.84 2.92 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.642 1.977 . . . . 2.4199999999999999 111.125 167.345 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 5.0 t 94.62 111.12 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 129.399 3.08 . . . . 2.3500000000000001 107.879 -167.29 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 p30 -155.69 -135.46 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 122.037 0.922 . . . . 3.0800000000000001 109.0 -173.475 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -140.58 5.63 2.02 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 114.544 1.313 . . . . 5.1299999999999999 114.544 175.856 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -132.32 136.89 47.19 Favored 'General case' 0 C--O 1.246 0.898 0 C-N-CA 127.393 2.277 . . . . 3.5099999999999998 111.998 -174.306 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 31.8 mm -108.71 122.27 63.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 126.08 1.752 . . . . 1.3 108.456 169.186 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -98.44 -174.48 2.83 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.594 1.957 . . . . 3.0699999999999998 110.994 169.239 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -25.11 65.31 Favored 'General case' 0 CA--C 1.551 0.985 0 O-C-N 120.456 -1.402 . . . . 2.8199999999999998 114.374 177.456 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -71.65 -46.68 58.26 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.436 -1.415 . . . . 5.9299999999999997 112.079 174.137 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -63.11 -48.73 77.31 Favored 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 118.829 0.741 . . . . 1.77 110.177 171.329 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -59.48 -23.43 62.74 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 120.029 -1.669 . . . . 1.96 114.33 -179.33 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 41.4 t -53.01 -35.18 59.12 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.612 -1.305 . . . . 2.3199999999999998 111.904 167.887 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 59.7 t -64.63 -40.54 89.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 CA-C-N 119.181 0.9 . . . . 1.6799999999999999 111.357 178.383 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -62.94 -50.98 68.67 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.881 0.873 . . . . 1.6399999999999999 111.26 176.867 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.9 -43.81 98.02 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.167 0.987 . . . . 1.55 110.961 178.546 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 95.0 m -60.93 -52.12 66.37 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.909 1.284 . . . . 0.93999999999999995 112.07 177.841 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 30.6 ttp -61.06 -41.16 96.09 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.097 0.959 . . . . 2.2599999999999998 111.93 -175.22 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 98.0 mt -72.45 -45.3 60.2 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 123.796 0.838 . . . . 1.75 112.219 175.784 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.4 t -67.19 -28.46 68.11 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.111 0.869 . . . . 1.54 112.998 -177.99 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -50.01 71.48 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.013 0.824 . . . . 3.6899999999999999 111.338 166.63 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.9 -30.56 70.24 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.742 0.701 . . . . 0.87 112.865 -178.71 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -74.64 -24.73 58.88 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.768 1.025 . . . . 2.2999999999999998 113.768 172.282 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -78.59 -42.26 29.54 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.069 0.948 . . . . 2.7000000000000002 111.537 172.725 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -60.8 -35.89 77.62 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.664 0.786 . . . . 3.8100000000000001 110.703 171.589 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -57.24 -46.33 83.09 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.185 0.994 . . . . 2.79 112.203 171.527 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -65.5 -34.95 79.47 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.503 1.121 . . . . 2.3100000000000001 112.217 -179.057 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 98.0 mt -69.58 -30.98 68.87 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.776 0.83 . . . . 1.6699999999999999 112.816 175.749 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -89.31 -6.44 56.71 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 114.498 1.295 . . . . 4.5199999999999996 114.498 178.656 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -93.54 -50.01 5.62 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.395 1.478 . . . . 3.0800000000000001 112.142 170.852 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.73 44.26 0.72 Allowed 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 123.09 1.424 . . . . 2.79 112.963 -178.303 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm . . . . . 0 C--O 1.25 1.116 0 C-N-CA 129.7 3.2 . . . . 4.3600000000000003 115.234 171.399 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.9 mmt . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 108.424 -0.954 . . . . 5.8200000000000003 108.424 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 -116.2 -104.24 0.41 Allowed 'General case' 0 CA--C 1.539 0.532 0 O-C-N 125.506 1.754 . . . . 4.1399999999999997 107.844 -159.183 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.4 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 46.3 p -120.21 174.75 2.69 Favored Pre-proline 0 N--CA 1.469 0.522 0 C-N-CA 124.052 0.941 . . . . 1.72 113.372 -153.703 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.4 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 90.8 Cg_endo -75.11 -29.52 7.97 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 121.659 1.572 . . . . 1.8600000000000001 111.485 159.222 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.0 tp -77.17 -53.77 7.34 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.318 0.963 . . . . 3.1499999999999999 113.064 -170.816 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -71.03 -26.82 63.27 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.876 1.217 . . . . 5.6200000000000001 111.068 -177.874 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -60.58 -40.99 93.75 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.122 -0.986 . . . . 4.7300000000000004 111.67 164.38 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.97 -31.11 61.38 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.048 0.939 . . . . 0.97999999999999998 112.148 176.421 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.5 mt -66.36 -42.57 87.85 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.012 1.278 . . . . 1.51 111.587 168.018 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 91.5 m -60.4 -43.35 96.74 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 121.341 -0.849 . . . . 1.5900000000000001 110.692 172.872 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 51.2 m -60.91 -38.4 85.62 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.205 1.002 . . . . 1.7 111.158 172.065 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 43.1 ttm -62.85 -49.82 73.36 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.56 -1.21 . . . . 3.1099999999999999 111.952 175.764 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.3 m -66.36 -22.4 30.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 CA-C-N 120.804 1.638 . . . . 2.4300000000000002 113.317 174.938 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 60.2 m -67.75 -54.74 16.83 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 117.608 -1.187 . . . . 0.80000000000000004 109.72 173.069 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -52.99 -36.55 60.51 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-N 119.2 0.909 . . . . 2.4399999999999999 111.221 168.753 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -64.42 -44.79 90.12 Favored 'General case' 0 C--O 1.219 -0.503 0 O-C-N 123.849 0.718 . . . . 1.75 111.3 -175.173 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -75.22 -37.28 61.17 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.999 1.272 . . . . 1.9399999999999999 112.895 173.375 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -15.99 17.72 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.121 1.768 . . . . 5.9100000000000001 113.683 175.607 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.483 ' CD2' HD13 ' A' ' 37' ' ' LEU . 90.4 m-85 -121.66 -20.18 6.58 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 116.718 2.118 . . . . 2.25 116.718 162.966 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.7 t -71.44 -23.66 61.88 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 122.462 2.392 . . . . 1.8100000000000001 112.478 172.743 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.8 0.77 89.4 Favored Glycine 0 CA--C 1.535 1.31 0 CA-C-O 118.192 -1.338 . . . . 1.8999999999999999 114.062 166.103 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.4 tpt85 -62.84 -22.86 66.98 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 119.898 1.849 . . . . 5.8099999999999996 112.76 177.525 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -164.03 148.61 10.19 Favored 'General case' 0 C--O 1.252 1.218 0 C-N-CA 127.483 2.313 . . . . 5.0099999999999998 110.447 168.182 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 43.35 -126.55 5.33 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 126.573 2.035 . . . . 2.9100000000000001 114.772 163.185 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.5 m -44.68 137.65 3.79 Favored 'General case' 0 C--O 1.245 0.853 0 C-N-CA 126.686 1.994 . . . . 2.8300000000000001 114.149 178.557 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -110.5 -11.59 14.46 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 127.018 2.127 . . . . 4.2800000000000002 115.586 -163.011 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 28.2 tp -95.89 0.02 51.5 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.095 0.958 . . . . 3.75 111.066 170.259 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.3 p -142.68 156.38 45.03 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 126.14 1.776 . . . . 0.98999999999999999 113.99 -162.174 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.9 mt -111.34 104.58 13.05 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.703 1.201 . . . . 1.52 109.145 171.129 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.1 t -66.25 152.4 44.99 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.4 -0.813 . . . . 1.97 110.683 168.044 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.7 ttp180 -42.51 -29.86 0.31 Allowed 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.926 2.09 . . . . 5.54 115.693 -175.377 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -83.38 -33.17 25.85 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 116.592 2.071 . . . . 7.4400000000000004 116.592 171.479 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -60.81 -43.31 98.37 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.011 0.925 . . . . 1.98 109.948 165.874 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.9 tp -66.94 -45.14 78.72 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.669 0.788 . . . . 2.1800000000000002 112.656 -174.703 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -50.3 -47.29 55.66 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.383 0.992 . . . . 3.4900000000000002 111.44 174.757 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -70.89 -46.0 63.36 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 118.441 -0.79 . . . . 3.0499999999999998 111.615 -174.017 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.483 HD13 ' CD2' ' A' ' 19' ' ' TYR . 29.4 tp -55.47 -52.84 62.3 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.859 1.264 . . . . 2.3199999999999998 112.352 179.824 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 51.3 mt -54.05 -57.57 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 107.866 -1.161 . . . . 1.04 107.866 -178.866 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.16 -16.7 60.5 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.883 1.068 . . . . 4.0099999999999998 113.883 -171.27 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.2 mmtp -81.99 -47.93 12.07 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.984 1.314 . . . . 3.3199999999999998 112.208 177.553 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.511 ' HA ' HG21 ' B' ' 3' ' ' THR . 11.0 mm-40 -101.98 15.23 29.69 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.604 1.162 . . . . 6.04 111.696 -172.23 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.412 HD12 HD22 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -164.83 122.11 1.59 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.217 2.207 . . . . 2.6800000000000002 111.643 173.698 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 48.8 t -71.39 -53.69 13.25 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 114.045 1.128 . . . . 4.7300000000000004 114.045 -179.188 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.412 HD22 HD12 ' A' ' 42' ' ' LEU . 3.9 mm? 61.99 -56.52 0.13 Allowed 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 128.778 2.831 . . . . 5.7199999999999998 113.973 -170.993 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 161.42 26.45 0.02 OUTLIER Glycine 0 CA--C 1.536 1.369 1 C-N-CA 130.818 4.056 . . . . 2.77 110.427 -174.355 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 65.09 132.79 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 128.706 2.802 . . . . 9.4299999999999997 111.458 -157.328 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 41.8 mmm -88.24 129.29 35.4 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.892 0.853 . . . . 2.52 110.335 174.797 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -112.85 159.19 19.28 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.241 1.017 . . . . 4.0899999999999999 110.463 178.417 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -45.2 -46.29 12.17 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 114.673 1.36 . . . . 5.1900000000000004 114.673 -169.928 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 t -61.46 -7.29 2.96 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 115.588 1.699 . . . . 4.2699999999999996 115.588 179.884 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.3 m -115.44 -12.11 11.75 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.584 1.084 . . . . 2.1200000000000001 113.139 171.935 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 74.7 mt -84.39 -44.72 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 O-C-N 120.692 -1.255 . . . . 2.5600000000000001 112.287 -171.347 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -74.94 -12.68 60.41 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.237 0.458 . . . . 4.2599999999999998 112.237 176.742 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.446 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 1.0 OUTLIER -91.0 -28.75 17.79 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.43 1.092 . . . . 2.6200000000000001 113.383 169.375 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.0 -47.27 81.24 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.573 -0.704 . . . . 2.2200000000000002 109.654 156.925 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 6.4 tpt -56.35 -49.05 75.49 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.659 0.784 . . . . 1.8100000000000001 110.712 176.224 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.446 ' HE2' ' HA ' ' A' ' 54' ' ' ASP . 14.8 mtmm -60.05 -39.12 84.86 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.587 1.085 . . . . 4.3200000000000003 112.916 174.37 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 73.0 m -67.32 -25.04 65.82 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.091 0.774 . . . . 1.8600000000000001 113.091 175.575 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.566 HD12 ' HA ' ' A' ' 72' ' ' TYR . 2.4 mm? -86.67 -40.85 14.71 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.055 1.342 . . . . 2.6400000000000001 113.631 172.069 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -88.73 64.3 7.25 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 114.606 1.336 . . . . 1.9099999999999999 114.606 -156.378 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -47.6 -44.85 26.91 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.568 1.547 . . . . 3.1400000000000001 114.28 -176.258 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . 0.281 0.4 OUTLIER -84.03 2.93 36.8 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 114.008 1.114 . . . . 2.7400000000000002 114.008 -175.159 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 69.2 m 60.14 79.68 0.23 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 127.659 2.384 . . . . 4.21 113.253 168.998 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -158.3 -114.8 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.652 -0.655 . . . . 2.7799999999999998 110.153 -155.105 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -155.4 -10.58 0.12 Allowed 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 116.424 2.009 . . . . 4.8200000000000003 116.424 176.816 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -127.35 146.14 50.56 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.227 1.811 . . . . 2.4300000000000002 109.412 -173.467 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.415 HD12 ' HB3' ' A' ' 59' ' ' LEU . 9.4 mm -106.54 98.44 6.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 125.801 1.641 . . . . 1.22 110.205 176.136 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -67.76 158.08 33.23 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.557 1.143 . . . . 3.2799999999999998 111.973 168.543 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -52.64 -31.38 36.52 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.216 1.561 . . . . 2.6400000000000001 115.216 -176.533 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.469 ' HE3' ' H ' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -76.2 -35.4 59.11 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 120.669 -1.269 . . . . 4.0499999999999998 112.581 175.309 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -62.55 -47.86 82.03 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.118 0.567 . . . . 1.72 109.532 166.433 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.566 ' HA ' HD12 ' A' ' 59' ' ' LEU . 73.8 t80 -60.8 -39.67 89.77 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 127.451 2.3 . . . . 2.3700000000000001 115.219 -170.758 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 38.9 m -53.62 -25.56 18.17 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.629 1.171 . . . . 1.98 114.117 -171.29 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.7 m -69.59 -25.6 29.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 O-C-N 121.017 -1.052 . . . . 2.6000000000000001 113.548 178.351 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.53 ' HB2' HD11 ' A' ' 59' ' ' LEU . 20.4 t80 -62.88 -56.97 12.61 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.519 1.054 . . . . 2.0699999999999998 110.866 -177.82 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.6 mt -65.41 -29.06 69.71 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 118.583 -0.723 . . . . 2.4100000000000001 112.009 176.115 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 66.6 m -60.72 -52.22 66.05 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.792 0.837 . . . . 1.0900000000000001 110.94 170.85 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 77.5 mtm -60.12 -41.69 93.16 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.557 0.743 . . . . 1.6299999999999999 111.65 177.088 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 77.2 mt -67.48 -41.59 84.35 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 118.582 -0.723 . . . . 1.26 112.589 179.4 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 3.7 t -69.66 -28.13 65.62 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.735 1.152 . . . . 2.1499999999999999 113.053 175.329 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 27.2 mtp -65.52 -42.53 91.9 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.295 -0.878 . . . . 2.3300000000000001 112.515 165.896 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.04 -33.94 76.88 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 120.009 1.277 . . . . 0.81999999999999995 113.031 175.962 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -64.58 -24.16 67.5 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.221 -0.925 . . . . 2.5699999999999998 112.8 171.459 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.407 ' ND2' ' HD1' ' B' ' 17' ' ' HIS . 2.0 t-20 -75.51 -35.76 60.7 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.279 -0.888 . . . . 2.7400000000000002 113.0 178.379 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -62.37 -44.66 95.95 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.604 1.162 . . . . 3.9900000000000002 110.839 171.558 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.64 -50.75 62.52 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.048 1.339 . . . . 2.5 111.728 171.673 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -62.78 -33.57 75.46 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.161 0.984 . . . . 2.2799999999999998 111.935 178.711 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 42.6 mt -69.63 -18.61 63.61 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 117.507 -1.235 . . . . 1.5 113.308 178.297 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -91.24 -17.2 26.4 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 114.917 1.451 . . . . 2.7400000000000002 114.917 171.622 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -93.73 -43.55 8.58 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.663 1.185 . . . . 3.6400000000000001 112.835 -176.13 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.77 8.11 2.13 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 116.828 2.158 . . . . 4.7400000000000002 116.828 -179.424 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 74.5 tttt . . . . . 0 C--O 1.249 1.028 0 C-N-CA 129.869 3.267 . . . . 4.3300000000000001 116.314 -148.299 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.9 tmm? . . . . . 0 N--CA 1.479 0.989 0 CA-C-O 115.832 -2.032 . . . . 6.5800000000000001 105.751 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 72.51 -142.86 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 120.104 1.32 . . . . 6.3600000000000003 111.799 131.576 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . 0.511 HG21 ' HA ' ' A' ' 41' ' ' GLU . 58.7 p -105.49 167.27 9.98 Favored Pre-proline 0 N--CA 1.471 0.612 0 C-N-CA 125.41 1.484 . . . . 1.8200000000000001 112.24 -166.488 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -62.56 -16.33 51.69 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 122.323 2.015 . . . . 1.52 113.039 165.69 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -80.72 -32.04 35.89 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 117.516 -1.231 . . . . 2.3100000000000001 111.911 173.274 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -50.41 -46.07 56.07 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.194 0.906 . . . . 6.1200000000000001 109.118 159.675 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . 0.484 ' HA ' ' CE ' ' B' ' 7' ' ' LYS . 0.2 OUTLIER -77.67 -25.34 49.48 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 114.707 1.373 . . . . 4.0800000000000001 114.707 -177.544 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.38 -46.28 56.02 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.859 0.754 . . . . 1.01 110.959 171.157 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 79.7 mt -68.86 -37.62 79.22 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.248 1.019 . . . . 1.8 111.834 175.568 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 97.2 m -54.22 -56.54 17.27 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 117.831 -1.08 . . . . 2.6800000000000002 108.657 167.098 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 43.9 m -53.18 -49.73 66.06 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.319 0.963 . . . . 1.72 110.527 -179.13 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 37.2 ttm -62.42 -46.17 89.78 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.666 0.786 . . . . 3.0 112.556 -178.146 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 1.8 p -70.25 -26.46 29.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.871 1.214 . . . . 2.6899999999999999 112.691 175.685 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 65.6 m -70.82 -46.03 63.49 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.373 1.469 . . . . 1.1399999999999999 111.736 -177.898 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.2 p -64.79 -43.16 94.12 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.86 0.864 . . . . 1.6000000000000001 109.459 169.189 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 29.7 t80 -66.55 -49.75 65.43 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 120.081 -0.648 . . . . 2.0299999999999998 111.417 -168.671 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . 0.407 ' HD1' ' ND2' ' A' ' 84' ' ' ASN . 0.1 OUTLIER -67.94 -3.6 10.4 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 120.689 -1.257 . . . . 2.2799999999999998 114.337 178.086 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.63 -57.9 2.08 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.026 -1.046 . . . . 4.6200000000000001 110.806 171.291 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -61.97 -34.1 75.52 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.303 -0.873 . . . . 1.8 112.717 177.056 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 67.5 m -70.02 -11.99 61.28 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.58 -1.325 . . . . 2.0099999999999998 114.121 171.645 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -94.11 -4.04 63.25 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 125.187 1.375 . . . . 1.3300000000000001 114.451 166.349 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 36.5 tpt85 -64.5 -23.48 67.29 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.138 1.469 . . . . 4.0599999999999996 112.502 176.941 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -151.59 175.52 12.25 Favored 'General case' 0 C--O 1.246 0.879 0 C-N-CA 127.225 2.21 . . . . 4.5700000000000003 108.658 172.08 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -41.31 153.8 0.1 OUTLIER Glycine 0 N--CA 1.474 1.176 0 C-N-CA 126.688 2.089 . . . . 3.46 115.122 -174.022 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 16.3 m 63.26 122.78 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.205 1.402 . . . . 3.5499999999999998 112.613 -179.358 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 23.2 mtpt -81.25 -25.39 36.65 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 114.819 1.414 . . . . 7.54 114.819 -175.063 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.437 ' H ' HD23 ' B' ' 27' ' ' LEU . 1.6 pt? -94.02 6.47 48.42 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.195 0.998 . . . . 3.5099999999999998 113.513 -173.882 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 19.0 p -144.63 154.39 42.76 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 127.159 2.184 . . . . 1.96 111.849 -166.929 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 77.1 mt -107.0 108.54 20.1 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.224 1.41 . . . . 1.79 109.722 167.686 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.42 160.9 4.86 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 120.156 -1.59 . . . . 1.8300000000000001 111.228 161.484 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -43.98 -35.21 1.96 Allowed 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.441 1.097 . . . . 3.8100000000000001 113.921 176.488 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.97 -40.5 39.09 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.245 1.018 . . . . 5.5 113.331 178.623 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -59.17 -42.48 90.91 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.084 0.954 . . . . 2.2400000000000002 109.76 173.282 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tp -66.33 -47.02 74.84 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.265 -0.874 . . . . 2.0099999999999998 111.839 176.032 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -54.73 -54.21 44.88 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 120.354 1.434 . . . . 3.0800000000000001 112.045 176.994 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -41.81 -62.61 0.87 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.262 1.425 . . . . 3.48 112.601 170.66 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 tp -48.93 -62.96 1.24 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.114 1.766 . . . . 2.1000000000000001 110.433 -177.871 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 22.3 mt -62.01 -38.01 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 109.546 -0.539 . . . . 1.8300000000000001 109.546 -171.942 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 51.2 mttm -58.12 -33.24 68.92 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.907 0.706 . . . . 4.9500000000000002 112.907 179.955 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -82.97 -47.69 11.48 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 122.979 0.512 . . . . 4.9299999999999997 111.927 177.835 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -75.63 -55.71 5.4 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 124.335 1.022 . . . . 5.5300000000000002 111.014 -172.598 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -83.01 49.13 1.47 Allowed 'General case' 0 CA--C 1.546 0.814 0 O-C-N 119.679 -1.888 . . . . 2.7000000000000002 110.928 -177.899 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 15.4 t -75.92 16.62 0.39 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.617 1.967 . . . . 4.5999999999999996 114.573 -176.521 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.48 18.05 0.18 Allowed 'General case' 0 N--CA 1.478 0.955 0 O-C-N 120.084 -1.635 . . . . 3.71 115.093 -177.029 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.95 -40.93 1.45 Allowed Glycine 0 CA--C 1.534 1.245 0 C-N-CA 126.172 1.844 . . . . 4.1699999999999999 114.72 -179.526 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -64.27 -22.61 67.01 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.177 1.391 . . . . 5.2699999999999996 113.985 -175.82 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 47' ' ' MET . . . . . . . . . . . . . 7.6 tpt -74.85 76.83 2.12 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.759 1.624 . . . . 2.1600000000000001 112.509 -175.866 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 20.2 mttm -62.74 120.73 11.81 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 120.786 -1.196 . . . . 3.9900000000000002 111.029 -170.548 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.67 -34.9 69.87 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.923 1.453 . . . . 3.7999999999999998 114.923 -156.934 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 3.0 m -87.93 -14.68 38.65 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.299 -0.876 . . . . 4.8799999999999999 112.388 -178.442 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 17.9 t -70.48 -10.26 58.71 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.479 -1.388 . . . . 2.5800000000000001 111.979 166.426 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 5.4 mm -65.35 -35.34 75.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 124.191 0.996 . . . . 1.3500000000000001 111.532 172.138 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.78 -39.4 69.97 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.148 0.885 . . . . 3.5 111.821 -176.633 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.29 -30.9 66.82 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.543 0.737 . . . . 4.2999999999999998 112.985 170.895 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 7.8 tt -65.13 -45.83 83.47 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.617 -0.706 . . . . 2.3300000000000001 110.664 166.917 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -56.56 -48.77 76.62 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.576 1.55 . . . . 2.0099999999999998 111.257 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 35.8 mtpt -54.75 -32.79 60.35 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.549 1.54 . . . . 4.4199999999999999 113.782 171.592 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 50.7 m -82.51 -30.21 29.97 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.291 1.037 . . . . 2.52 113.065 178.618 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 19.1 mt -73.66 -36.07 65.31 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.893 0.877 . . . . 2.02 111.988 173.856 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -74.82 74.88 2.12 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 123.178 1.466 . . . . 1.8799999999999999 110.24 -177.892 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.2 tmtm? -61.33 -16.22 43.74 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 114.137 -1.392 . . . . 4.9199999999999999 113.863 -158.424 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 48.1 p-10 -105.89 -14.44 15.21 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 115.777 1.769 . . . . 3.4199999999999999 115.777 172.594 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 40.1 t 56.54 90.88 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.308 1.443 . . . . 4.3600000000000003 113.064 -162.341 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 11.3 p30 -123.91 -79.93 0.62 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.153 1.381 . . . . 3.21 109.864 176.48 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -168.74 -34.77 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 129.77 3.228 . . . . 8.2100000000000009 112.024 177.428 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -129.12 147.22 50.95 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 126.178 1.791 . . . . 2.5699999999999998 110.443 -167.349 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.43 HG22 ' HB2' ' B' ' 72' ' ' TYR . 75.2 mt -97.06 102.36 13.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 121.941 0.877 . . . . 1.3500000000000001 109.105 178.576 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -66.68 152.95 44.39 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.163 1.785 . . . . 3.1400000000000001 108.961 171.752 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -47.65 -41.85 23.14 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.062 1.345 . . . . 2.3799999999999999 113.57 -178.11 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.55 -8.37 59.12 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 115.612 1.708 . . . . 3.4700000000000002 115.612 177.031 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -83.28 -52.29 6.69 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 107.505 -1.295 . . . . 2.1099999999999999 107.505 160.528 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 72' ' ' TYR . . . . . 0.43 ' HB2' HG22 ' B' ' 67' ' ' ILE . 40.5 t80 -52.98 -34.0 53.94 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.584 1.954 . . . . 2.73 114.867 -174.765 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 79.6 p -63.07 -17.64 62.5 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 117.401 -1.285 . . . . 1.95 113.992 174.695 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 92.6 t -56.71 -38.91 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-N 120.837 1.653 . . . . 1.6100000000000001 111.213 168.361 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -60.41 -54.23 48.06 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 118.634 0.652 . . . . 2.04 111.394 172.517 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 69.4 mt -62.8 -37.68 87.69 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 123.784 0.834 . . . . 1.6499999999999999 110.768 -174.63 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 19.1 m -69.37 -43.35 73.75 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.634 1.574 . . . . 1.7 112.532 175.446 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 78' ' ' MET . . . . . . . . . . . . . 5.8 mmm -56.47 -46.11 80.57 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 120.191 1.359 . . . . 2.73 111.801 173.101 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 97.3 mt -67.25 -50.72 59.5 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.43 0.692 . . . . 1.6699999999999999 111.365 175.949 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 2.0 t -66.45 -25.58 66.8 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.101 -0.999 . . . . 2.0099999999999998 113.131 -177.151 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 81' ' ' MET . . . . . . . . . . . . . 62.7 mtm -73.04 -37.34 66.92 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.156 -0.965 . . . . 3.1099999999999999 112.683 168.36 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.97 -33.87 76.3 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.164 0.893 . . . . 1.0600000000000001 112.049 170.929 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -70.68 -32.85 70.25 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 113.378 0.881 . . . . 2.0600000000000001 113.378 168.381 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -69.74 -42.99 73.21 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.28 0.945 . . . . 3.1899999999999999 112.087 179.845 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -58.04 -46.46 85.3 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.729 1.212 . . . . 3.0299999999999998 112.075 170.818 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.26 -50.67 64.34 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.879 1.272 . . . . 3.8399999999999999 111.424 175.615 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -66.67 -27.71 67.88 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.566 1.546 . . . . 2.4199999999999999 111.336 -177.695 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 34.1 mt -81.16 -9.53 59.78 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 125.414 1.485 . . . . 3.1800000000000002 114.488 177.757 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -87.76 -18.0 30.39 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 120.047 1.294 . . . . 5.5599999999999996 114.168 164.155 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -80.92 -52.92 6.92 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.108 0.963 . . . . 5.0499999999999998 110.821 164.406 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -98.46 28.13 4.34 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.297 1.839 . . . . 5.7999999999999998 113.11 -171.906 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.071 0 C-N-CA 128.272 2.629 . . . . 9.2899999999999991 114.445 -177.485 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 185' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 186' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' B' B ' 187' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' B' B ' 188' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_