data_2lcb_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 2lcb _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 ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.466 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.2 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 101' ' ' ASN . 78.3 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.6 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.2 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.9 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.503 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.9 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.7 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.3 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.503 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.421 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.421 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.4 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.0 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 55.0 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD12 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.8 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.0 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 92.3 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 73.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.0 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.1 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.466 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -56.72 -38.44 58.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.849 0.357 . . . . 0.0 111.212 177.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . 0.434 ' HA ' HD22 ' A' ' 7' ' ' LEU . 49.5 t-20 -65.28 -46.79 79.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.164 178.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.0 mmm -61.73 -30.27 70.66 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 125.039 1.336 . . . . 0.0 111.2 -174.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 24.2 m . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.242 -179.015 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 94.5 p . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.828 0.346 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 70.1 mt -52.32 -45.43 65.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.196 -173.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 78.2 ttt180 -60.33 -59.98 4.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.198 -177.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.4 mmt -59.87 -34.1 72.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.176 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 72.1 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.393 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.2 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.7 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -58.67 -42.07 87.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.207 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.467 ' O ' HD21 ' A' ' 133' ' ' LEU . 1.2 tt -76.21 -35.0 59.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.158 -178.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.48 -30.42 69.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.225 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.0 mttt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.249 -175.451 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo . . . . . 0 N--CA 1.459 -0.558 0 N-CA-C 111.198 -0.347 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -69.16 -52.65 25.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.171 -175.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 43.7 ttm105 -65.88 -45.18 83.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.176 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -62.84 -40.93 98.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.246 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.157 177.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.5 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 72.6 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 92.2 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 40.5 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.9 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.407 HG12 HG21 ' A' ' 100' ' ' ILE . 8.9 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 27.3 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.442 HD22 ' HA ' ' A' ' 101' ' ' ASN . 58.8 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.5 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.2 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.4 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.7 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.503 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.7 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.5 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.7 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 15.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.3 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.2 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.503 HD13 HG21 ' A' ' 27' ' ' ILE . 45.5 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.425 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.425 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.4 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 28.9 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.9 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD12 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.4 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.8 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.49 HG22 ' HB3' ' A' ' 118' ' ' LEU . 78.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 60.7 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 85.0 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 90.1 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.407 HG21 HG12 ' A' ' 3' ' ' ILE . 96.5 mt -58.97 -38.49 73.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.821 0.344 . . . . 0.0 111.196 177.239 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . 0.442 ' HA ' HD22 ' A' ' 7' ' ' LEU . 14.6 t-20 -67.35 -43.0 82.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.191 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.5 tpp -64.55 -33.88 76.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.193 -175.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 20.0 m . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.185 -179.963 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.8 m . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.754 0.312 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.49 ' HB3' HG22 ' A' ' 87' ' ' VAL . 76.6 mt -62.3 -36.87 83.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.244 173.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -65.3 -51.56 59.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.229 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.3 mmt -59.01 -41.91 88.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.192 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 79.6 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.393 -178.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.0 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -66.31 -28.27 68.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.209 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 57.5 mt -75.23 -19.58 59.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.181 -178.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -89.31 -2.78 58.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.228 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 97.8 mttt . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.166 -179.315 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo . . . . . 0 N--CA 1.458 -0.596 0 N-CA-C 111.21 -0.342 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -64.66 -29.86 70.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.162 -179.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 42.2 ttm105 -93.48 -41.36 9.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.245 178.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -62.76 -44.0 97.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.243 -178.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.157 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 94.7 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.1 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 89.2 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.8 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 94.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 79.9 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 32.3 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 88.3 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.414 HG12 HG21 ' A' ' 100' ' ' ILE . 9.0 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.4 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.1 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.6 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.4 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.1 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.5 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.8 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.5 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.503 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 66.1 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.1 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 88.9 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.7 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.5 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.6 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.3 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.503 HD13 HG21 ' A' ' 27' ' ' ILE . 45.9 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.424 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.5 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.424 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.7 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.4 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 37.0 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.7 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.8 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 70.2 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 86.8 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.3 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.494 HG22 ' HB3' ' A' ' 118' ' ' LEU . 70.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 59.3 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.414 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -58.6 -29.16 38.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.796 0.331 . . . . 0.0 111.183 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -80.73 -33.19 35.36 Favored 'General case' 0 C--N 1.292 -1.896 0 C-N-CA 124.548 1.139 . . . . 0.0 111.246 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.8 mmm -72.13 -17.11 61.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.203 179.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 30.0 m . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.168 -176.839 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.6 m . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.852 0.358 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.494 ' HB3' HG22 ' A' ' 87' ' ' VAL . 52.9 mt -73.4 -33.35 64.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.224 -177.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -65.86 -41.7 91.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.192 -176.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.8 mmt -68.45 -38.63 81.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.202 -179.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.0 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.393 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -64.86 -35.35 80.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.198 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 49.3 mt -70.1 -33.11 71.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.192 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.74 -13.3 62.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.23 -177.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.4 mttt . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.214 -179.238 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo . . . . . 0 N--CA 1.458 -0.568 0 N-CA-C 111.187 -0.351 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -67.9 -49.76 60.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.21 176.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.7 mtt85 -70.41 -41.43 72.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.233 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.7 -40.55 95.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.193 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.157 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 95.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 87.3 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 71.9 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.465 ' HD3' ' HA ' ' A' ' 162' ' ' LYS . 28.5 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.453 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.0 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 69.3 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.8 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.5 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.7 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.8 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.7 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.6 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.5 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 28.7 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.426 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.426 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.6 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.1 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 62.0 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD12 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.5 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.9 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.8 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.443 HG22 ' HB3' ' A' ' 118' ' ' LEU . 70.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.6 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 91.5 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.453 HG21 HG12 ' A' ' 3' ' ' ILE . 96.3 mt -57.07 -36.35 50.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.847 0.356 . . . . 0.0 111.195 177.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 38.7 t-20 -68.16 -41.9 80.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.199 177.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 91.0 mmm -64.84 -20.13 66.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.149 -173.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 34.9 m . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.242 -176.898 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 69.2 m . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.824 0.345 . . . . 0.0 111.199 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.443 ' HB3' HG22 ' A' ' 87' ' ' VAL . 82.8 mt -76.78 -27.86 55.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.164 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -66.41 -29.44 69.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.189 -174.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.2 mmt -85.18 -34.99 21.96 Favored 'General case' 0 C--N 1.345 0.375 0 C-N-CA 119.261 -0.976 . . . . 0.0 111.253 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.5 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.393 -177.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.9 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -57.41 -37.05 72.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.202 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 87.8 mt -80.11 -33.11 38.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.218 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.51 -28.19 67.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.212 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.0 mttt . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.166 179.34 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo . . . . . 0 N--CA 1.458 -0.581 0 N-CA-C 111.198 -0.347 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -68.77 -52.76 26.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.193 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -68.98 -40.95 78.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.204 -178.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.4 98.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.186 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.182 -0.463 . . . . 0.0 112.157 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.6 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 89.7 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.4 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.2 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 51.7 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.9 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.503 HG12 HG21 ' A' ' 100' ' ' ILE . 8.6 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' MET . . . . . 0.411 ' HE2' ' HA ' ' A' ' 98' ' ' ALA . 27.4 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 76.1 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.5 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.1 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.8 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.3 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 66.2 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.9 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.4 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 28.9 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.424 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.424 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.6 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 55.5 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD12 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.6 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.42 ' HB2' HG21 ' A' ' 103' ' ' VAL . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.4 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 85.7 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.471 HG22 ' HB3' ' A' ' 118' ' ' LEU . 85.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.4 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 85.0 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.411 ' HA ' ' HE2' ' A' ' 6' ' ' MET . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.503 HG21 HG12 ' A' ' 3' ' ' ILE . 96.5 mt -55.31 -38.76 49.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.796 0.331 . . . . 0.0 111.201 177.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . 0.744 ' C ' HD21 ' A' ' 101' ' ' ASN . 0.1 OUTLIER -69.93 -34.25 73.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.18 -179.453 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 94.3 mmm -76.3 -9.14 58.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.159 -177.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.42 HG21 ' HB2' ' A' ' 74' ' ' ALA . 35.5 m . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.252 175.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.786 0.327 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.471 ' HB3' HG22 ' A' ' 87' ' ' VAL . 85.4 mt -96.43 -47.88 5.8 Favored 'General case' 0 C--N 1.332 -0.173 0 O-C-N 120.789 -1.194 . . . . 0.0 111.212 -174.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -48.61 -40.26 26.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.177 -173.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.6 mmt -62.78 -42.7 99.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.216 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.2 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.393 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.5 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -66.94 -30.65 70.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.212 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 58.6 mt -76.0 -19.39 58.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.217 -177.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -80.31 -0.59 37.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.201 -177.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 97.9 mttt . . . . . 0 C--N 1.358 0.961 0 O-C-N 121.601 -0.687 . . . . 0.0 111.193 175.799 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo . . . . . 0 N--CA 1.458 -0.562 0 N-CA-C 111.187 -0.351 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -60.69 -37.41 81.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.203 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -90.25 -37.81 13.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.169 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -59.69 -41.28 90.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.215 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.185 -0.462 . . . . 0.0 112.157 -179.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 95.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.1 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 91.3 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 44.1 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 88.5 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.2 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.0 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.475 HD22 ' HA ' ' A' ' 101' ' ' ASN . 76.0 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.6 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.6 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.5 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.3 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.2 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.4 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.503 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.3 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.2 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 88.8 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 14.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.4 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.1 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.9 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.503 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.422 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.5 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.422 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 36.2 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.1 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.8 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.7 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 93.5 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.0 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.8 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 79.4 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 59.6 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.1 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 95.3 mt -63.14 -29.1 46.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.8 0.333 . . . . 0.0 111.209 177.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . 0.475 ' HA ' HD22 ' A' ' 7' ' ' LEU . 20.5 t-20 -64.31 -50.62 67.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.851 0.358 . . . . 0.0 111.213 174.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.5 mtp -72.26 -14.33 61.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.188 -177.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.595 ' O ' HG12 ' A' ' 103' ' ' VAL . 42.2 t . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.235 178.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 82.2 p . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.801 0.334 . . . . 0.0 111.205 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 69.0 mt -57.8 -38.27 75.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.207 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -62.52 -56.38 18.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.237 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.6 mmt -58.8 -41.67 87.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.215 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 80.6 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.393 -174.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.4 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.2 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -57.47 -36.04 70.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.224 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 77.9 mt -78.44 -33.13 48.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.217 177.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.34 -38.36 83.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.236 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.3 mttt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.181 -173.865 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo . . . . . 0 N--CA 1.458 -0.599 0 N-CA-C 111.175 -0.356 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.8 m-20 -65.54 -56.46 12.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.24 -174.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 44.0 ttm105 -67.06 -40.6 87.12 Favored 'General case' 0 C--N 1.283 -2.302 0 O-C-N 120.552 -1.342 . . . . 0.0 111.166 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.4 93.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.179 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.157 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.4 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 79.0 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 88.9 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 82.1 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 67.3 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 72.3 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.432 ' HD3' ' HA ' ' A' ' 162' ' ' LYS . 24.9 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.8 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.3 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 19.0 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.447 HD22 ' HA ' ' A' ' 101' ' ' ASN . 34.0 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.1 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 91.9 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.9 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.3 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.9 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 79.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.6 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.0 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.8 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.5 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.2 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.0 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.422 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.422 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 43.5 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 53.2 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.4 HD11 HD12 ' A' ' 50' ' ' ILE . 72.4 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 91.8 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.9 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.426 HG22 ' HB3' ' A' ' 118' ' ' LEU . 78.8 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.1 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.9 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 94.5 mt -61.36 -40.82 87.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.789 0.328 . . . . 0.0 111.213 177.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . 0.447 ' HA ' HD22 ' A' ' 7' ' ' LEU . 19.2 t-20 -58.37 -50.29 74.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.204 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 48.2 ttm -73.26 -22.48 60.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.197 -176.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.419 ' O ' ' CG1' ' A' ' 103' ' ' VAL . 20.3 t . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.179 178.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 67.5 m . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.779 0.323 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.426 ' HB3' HG22 ' A' ' 87' ' ' VAL . 71.3 mt -62.41 -35.32 78.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.183 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 78.9 ttt180 -59.51 -55.93 28.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.215 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.9 mmt -59.77 -39.84 86.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.218 -175.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.393 -177.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.0 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -62.6 -31.14 71.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.225 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 79.3 mt -78.51 -38.84 39.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.189 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.76 -27.39 68.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.203 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.1 mttt . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.188 179.76 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo . . . . . 0 N--CA 1.458 -0.591 0 N-CA-C 111.145 -0.367 . . . . 0.0 111.145 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -66.93 -40.82 87.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.231 -174.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -86.96 -40.29 14.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.194 179.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -57.68 -39.64 77.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.192 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.157 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 94.5 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 69.5 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 90.6 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.5 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.7 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 37.9 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.2 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 16.6 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.414 HD22 ' HA ' ' A' ' 101' ' ' ASN . 35.8 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.9 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.6 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.1 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.2 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.5 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.4 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.1 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 28.7 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.425 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.425 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.6 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.4 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.7 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD12 ' A' ' 50' ' ' ILE . 73.1 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 60.1 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 78.1 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.1 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.0 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.472 HG22 ' HB3' ' A' ' 118' ' ' LEU . 77.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 60.7 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.3 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 88.0 mt -60.47 -41.41 87.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.807 0.337 . . . . 0.0 111.206 177.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . 0.414 ' HA ' HD22 ' A' ' 7' ' ' LEU . 12.6 t-20 -73.65 -26.06 60.58 Favored 'General case' 1 C--N 1.237 -4.292 0 C-N-CA 127.061 2.145 . . . . 0.0 111.225 -177.523 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.612 ' HE1' ' HA ' ' A' ' 102' ' ' MET . 4.4 tpt -84.25 -20.72 31.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.224 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 23.1 m . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.231 177.983 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 51.7 m . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.801 0.334 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.472 ' HB3' HG22 ' A' ' 87' ' ' VAL . 77.6 mt -68.32 -34.61 76.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.172 -176.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -62.24 -47.75 83.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.135 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.7 mmt -63.89 -40.94 97.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.218 -177.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.393 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.1 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -62.04 -35.96 80.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.226 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 75.3 mt -72.48 -39.56 67.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.246 -177.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -78.08 -16.35 58.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.217 -178.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 88.7 tttt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.219 -179.363 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 N--CA 1.458 -0.587 0 N-CA-C 111.197 -0.347 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -73.07 -51.05 19.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.181 -177.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 40.2 ttm105 -65.47 -42.27 92.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.165 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -67.64 -39.9 84.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.231 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.192 -0.458 . . . . 0.0 112.157 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.7 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 72.9 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 91.2 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 94.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 44.4 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.446 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 12.9 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.407 HD22 ' HA ' ' A' ' 101' ' ' ASN . 51.1 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.6 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.2 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.8 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.2 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.503 HG21 HD13 ' A' ' 46' ' ' LEU . 14.0 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.2 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.0 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.5 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.9 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.503 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.42 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.5 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.42 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 33.6 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 51.6 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.4 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.8 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.0 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.3 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 71.8 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.8 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.1 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.446 HG21 HG12 ' A' ' 3' ' ' ILE . 96.8 mt -56.7 -42.42 76.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . 0.407 ' HA ' HD22 ' A' ' 7' ' ' LEU . 52.6 t-20 -70.2 -38.69 75.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.229 -178.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.4 tpp -62.32 -33.58 74.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.16 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 15.9 m . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.241 -177.317 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 30.7 m . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.779 0.323 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 74.0 mt -91.62 1.7 56.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.18 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -102.05 15.67 28.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.195 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 67.7 mtt -134.72 -38.12 0.82 Allowed 'General case' 0 C--N 1.339 0.136 0 CA-C-O 120.808 0.337 . . . . 0.0 111.24 176.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.9 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.393 -178.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -61.55 -37.7 84.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.222 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 55.2 mt -72.28 -33.02 67.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.182 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.86 -14.18 62.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.226 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.193 178.702 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo . . . . . 0 N--CA 1.457 -0.628 0 N-CA-C 111.218 -0.339 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -68.9 -55.85 9.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.209 -174.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 44.6 ttm105 -57.19 -46.37 82.92 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-O 120.839 0.352 . . . . 0.0 111.255 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.13 -37.98 89.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.207 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.157 175.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 77.2 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 86.7 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.4 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 80.8 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 33.1 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.432 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 13.1 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 60.4 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.6 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.6 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.503 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.7 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.1 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.2 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.8 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.503 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.424 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.424 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.8 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 54.0 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD12 ' A' ' 50' ' ' ILE . 72.7 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.4 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 88.6 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 97.0 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.403 HG22 ' HB3' ' A' ' 118' ' ' LEU . 79.4 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.8 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.8 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.432 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -58.08 -42.79 83.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.774 0.321 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 55.6 t-20 -67.36 -35.51 79.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.227 175.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 63.5 tpp -63.27 -28.51 70.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.169 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 33.0 m . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.182 -178.043 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 56.2 m . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.779 0.323 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.403 ' HB3' HG22 ' A' ' 87' ' ' VAL . 69.9 mt -57.22 -39.64 75.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.164 175.218 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -63.7 -51.96 62.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.22 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.6 mmt -60.65 -40.11 90.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.255 -178.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 81.4 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.393 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.0 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -63.71 -34.12 77.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.208 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.2 -38.61 69.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.245 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -75.76 -1.91 27.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.193 -174.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 C--N 1.385 2.133 0 O-C-N 120.38 -1.45 . . . . 0.0 111.184 175.41 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo . . . . . 0 N--CA 1.459 -0.55 0 N-CA-C 111.201 -0.346 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -68.27 -51.47 44.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.199 179.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 85.0 mtt85 -63.04 -45.42 92.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.206 -178.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -66.31 -41.75 89.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.219 -179.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.157 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 70.1 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 92.7 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 35.1 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.466 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.2 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 101' ' ' ASN . 78.3 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.6 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.2 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.9 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.503 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.9 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.7 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.3 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.503 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.421 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.421 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.4 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.0 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 55.0 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD12 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.8 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.0 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 92.3 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 73.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.0 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.1 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.466 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -56.72 -38.44 58.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.849 0.357 . . . . 0.0 111.212 177.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . 0.434 ' HA ' HD22 ' A' ' 7' ' ' LEU . 49.5 t-20 -65.28 -46.79 79.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.164 178.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.0 mmm -61.73 -30.27 70.66 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 125.039 1.336 . . . . 0.0 111.2 -174.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 24.2 m -102.07 5.86 10.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.242 -179.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -79.68 83.41 5.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.21 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 52.41 51.5 16.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.201 172.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 26.6 mmt -100.22 162.24 13.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.225 177.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -59.63 179.97 1.88 Allowed Glycine 0 CA--C 1.524 0.614 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 168.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.72 -30.36 69.92 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.767 0.318 . . . . 0.0 111.143 173.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 68.1 p -65.19 -35.1 80.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.227 -174.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -68.68 -42.53 79.67 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 111.214 -0.755 . . . . 0.0 111.214 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 77.4 t -64.63 -43.92 96.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.808 0.337 . . . . 0.0 111.212 178.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -63.88 -47.51 80.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.203 -177.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -61.56 -44.17 98.33 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -70.29 -36.08 74.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.753 0.311 . . . . 0.0 111.191 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.427 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 57.7 m -66.0 -32.42 73.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.202 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -76.27 -19.03 58.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.227 178.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 94.5 p -91.29 -14.51 30.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.19 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.427 ' HG ' ' HA ' ' A' ' 115' ' ' THR . 70.1 mt -52.32 -45.43 65.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.196 -173.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 78.2 ttt180 -60.33 -59.98 4.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.198 -177.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.4 mmt -59.87 -34.1 72.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.176 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 72.1 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.393 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.2 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.7 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -58.67 -42.07 87.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.207 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.467 ' O ' HD21 ' A' ' 133' ' ' LEU . 1.2 tt -76.21 -35.0 59.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.158 -178.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.48 -30.42 69.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.225 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -92.8 16.2 12.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.249 -175.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 65.6 p -84.41 177.37 8.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.208 -178.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -76.65 -31.83 57.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.158 172.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 60.8 t-105 -55.65 -50.69 69.53 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.165 176.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -60.38 -38.13 82.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.182 -178.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -58.68 -37.37 75.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.223 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -83.2 -40.22 19.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.192 -172.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 64.5 p -135.25 75.77 58.55 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.183 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -57.73 -37.1 97.85 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 121.707 1.605 . . . . 0.0 111.198 -177.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -69.16 -52.65 25.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.171 -175.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 43.7 ttm105 -65.88 -45.18 83.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.176 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -62.84 -40.93 98.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.246 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.157 177.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.5 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 72.6 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 92.2 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 40.5 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.9 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.407 HG12 HG21 ' A' ' 100' ' ' ILE . 8.9 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 27.3 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.442 HD22 ' HA ' ' A' ' 101' ' ' ASN . 58.8 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.5 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.2 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.4 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.7 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.503 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.7 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.5 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.7 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 15.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.3 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.2 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.503 HD13 HG21 ' A' ' 27' ' ' ILE . 45.5 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.425 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.425 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.4 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 28.9 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.9 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD12 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.4 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.8 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.49 HG22 ' HB3' ' A' ' 118' ' ' LEU . 78.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 60.7 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 85.0 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 90.1 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.407 HG21 HG12 ' A' ' 3' ' ' ILE . 96.5 mt -58.97 -38.49 73.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.821 0.344 . . . . 0.0 111.196 177.239 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . 0.442 ' HA ' HD22 ' A' ' 7' ' ' LEU . 14.6 t-20 -67.35 -43.0 82.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.191 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.5 tpp -64.55 -33.88 76.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.193 -175.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 20.0 m -93.12 3.05 8.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.185 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -79.5 73.23 6.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.211 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 48.16 58.64 4.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.206 178.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 25.1 mmt -109.34 174.1 6.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.165 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -48.87 136.44 19.37 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.74 -34.03 73.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.756 0.312 . . . . 0.0 111.203 176.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 80.9 p -69.18 -28.34 66.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.184 178.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -77.68 -39.18 25.84 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -176.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 79.1 t -63.23 -40.92 90.86 Favored 'Isoleucine or valine' 0 C--N 1.342 0.256 0 O-C-N 125.729 1.488 . . . . 0.0 111.188 169.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.45 -49.92 74.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.195 -178.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -64.83 -43.92 95.43 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 111.231 -0.747 . . . . 0.0 111.231 177.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -55.43 -40.06 71.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.781 0.324 . . . . 0.0 111.176 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.421 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 94.0 m -59.12 -35.96 74.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.196 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -70.81 -25.41 62.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.177 177.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.8 m -95.46 5.79 50.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.195 -178.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.49 ' HB3' HG22 ' A' ' 87' ' ' VAL . 76.6 mt -62.3 -36.87 83.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.244 173.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -65.3 -51.56 59.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.229 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.3 mmt -59.01 -41.91 88.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.192 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 79.6 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.393 -178.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.0 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -66.31 -28.27 68.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.209 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 57.5 mt -75.23 -19.58 59.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.181 -178.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -89.31 -2.78 58.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.228 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -86.7 -9.85 55.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.166 -179.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 89.1 p -72.91 135.56 45.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.189 175.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 6.3 tpm_? -45.49 -44.07 12.18 Favored 'General case' 0 C--N 1.367 1.339 0 O-C-N 121.464 -0.773 . . . . 0.0 111.164 173.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 74.6 t90 -58.31 -32.33 68.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.197 -171.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -55.66 -45.57 77.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.175 173.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -76.7 -20.86 56.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.2 -176.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -83.01 -40.51 19.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.23 -179.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 62.7 p -134.27 71.34 72.56 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.185 175.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -70.07 -26.17 26.39 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 121.72 1.614 . . . . 0.0 111.21 -173.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -64.66 -29.86 70.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.162 -179.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 42.2 ttm105 -93.48 -41.36 9.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.245 178.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -62.76 -44.0 97.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.243 -178.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.157 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 94.7 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.1 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 89.2 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.8 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 94.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 79.9 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 32.3 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 88.3 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.414 HG12 HG21 ' A' ' 100' ' ' ILE . 9.0 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.4 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.1 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.6 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.4 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.1 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.5 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.8 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.5 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.503 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 66.1 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.1 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 88.9 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.7 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.5 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.6 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.3 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.503 HD13 HG21 ' A' ' 27' ' ' ILE . 45.9 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.424 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.5 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.424 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.7 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.4 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 37.0 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.7 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.8 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 70.2 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 86.8 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.3 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.494 HG22 ' HB3' ' A' ' 118' ' ' LEU . 70.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 59.3 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.414 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -58.6 -29.16 38.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.796 0.331 . . . . 0.0 111.183 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -80.73 -33.19 35.36 Favored 'General case' 0 C--N 1.292 -1.896 0 C-N-CA 124.548 1.139 . . . . 0.0 111.246 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.8 mmm -72.13 -17.11 61.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.203 179.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 30.0 m -115.31 3.3 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.168 -176.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -75.95 91.71 3.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.203 176.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 58.64 31.6 21.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.197 178.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 57.0 tpp -76.38 143.02 40.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.202 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.61 154.36 50.71 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 178.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -58.01 -40.0 79.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.822 0.344 . . . . 0.0 111.197 -178.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 97.6 m -63.32 -44.43 94.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.149 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -64.69 -38.92 96.26 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.7 t -66.16 -37.95 80.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.753 0.311 . . . . 0.0 111.21 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.09 -45.23 93.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.256 174.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -61.16 -38.83 96.26 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 177.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -68.31 -39.37 82.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.806 0.336 . . . . 0.0 111.186 176.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.419 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 89.2 m -59.08 -39.22 81.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.204 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -66.55 -22.83 66.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.175 -178.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.6 m -99.0 11.77 38.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.245 -176.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.494 ' HB3' HG22 ' A' ' 87' ' ' VAL . 52.9 mt -73.4 -33.35 64.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.224 -177.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -65.86 -41.7 91.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.192 -176.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.8 mmt -68.45 -38.63 81.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.202 -179.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.0 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.393 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -64.86 -35.35 80.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.198 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 49.3 mt -70.1 -33.11 71.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.192 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.74 -13.3 62.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.23 -177.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -92.69 5.04 52.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.214 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 97.1 p -82.68 156.98 23.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.197 178.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -59.44 -33.53 71.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.225 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 54.7 t-105 -58.23 -38.88 77.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.218 -178.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -71.55 -38.86 70.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.225 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -67.22 -29.37 69.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.226 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -85.86 -54.97 4.19 Favored 'General case' 0 C--N 1.344 0.328 0 O-C-N 121.465 -0.772 . . . . 0.0 111.184 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 53.0 p -123.93 78.94 57.89 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.177 177.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -68.23 -24.95 37.29 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 121.675 1.583 . . . . 0.0 111.187 -176.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -67.9 -49.76 60.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.21 176.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.7 mtt85 -70.41 -41.43 72.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.233 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.7 -40.55 95.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.193 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.157 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 95.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 87.3 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 71.9 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.465 ' HD3' ' HA ' ' A' ' 162' ' ' LYS . 28.5 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.453 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.0 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 69.3 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.8 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.5 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.7 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.8 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.7 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.6 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.5 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 28.7 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.426 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.426 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.6 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.1 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 62.0 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD12 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.5 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.9 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.8 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.443 HG22 ' HB3' ' A' ' 118' ' ' LEU . 70.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.6 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 91.5 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.453 HG21 HG12 ' A' ' 3' ' ' ILE . 96.3 mt -57.07 -36.35 50.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.847 0.356 . . . . 0.0 111.195 177.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 38.7 t-20 -68.16 -41.9 80.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.199 177.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 91.0 mmm -64.84 -20.13 66.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.149 -173.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 34.9 m -111.24 6.49 8.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.242 -176.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -87.45 107.43 18.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.166 175.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 33.0 tt0 50.07 54.12 11.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.223 -175.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 63.5 tpp -107.45 136.43 47.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.203 -178.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -74.64 172.54 52.6 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 111.191 -0.763 . . . . 0.0 111.191 -178.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -61.07 -36.41 79.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.832 0.349 . . . . 0.0 111.221 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 98.0 m -68.26 -44.17 76.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.212 -177.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -61.39 -43.72 98.98 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 175.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 55.4 t -63.78 -41.42 92.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.803 0.335 . . . . 0.0 111.216 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -62.64 -46.68 87.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.24 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -61.14 -43.75 99.01 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -69.04 -39.69 79.05 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.801 0.334 . . . . 0.0 111.15 -178.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.429 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 80.0 m -62.58 -37.26 85.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.194 178.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -72.41 -12.18 61.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.202 178.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 69.2 m -108.88 14.98 23.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.199 -177.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.443 ' HB3' HG22 ' A' ' 87' ' ' VAL . 82.8 mt -76.78 -27.86 55.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.164 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -66.41 -29.44 69.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.189 -174.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.2 mmt -85.18 -34.99 21.96 Favored 'General case' 0 C--N 1.345 0.375 0 C-N-CA 119.261 -0.976 . . . . 0.0 111.253 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.5 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.393 -177.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.9 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -57.41 -37.05 72.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.202 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 87.8 mt -80.11 -33.11 38.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.218 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.51 -28.19 67.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.212 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -91.84 6.26 46.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.166 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 67.3 m -89.9 157.42 17.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.194 178.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -61.96 -29.43 70.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.226 -173.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 48.1 t-105 -62.92 -39.21 93.86 Favored 'General case' 0 C--N 1.368 1.392 0 O-C-N 120.178 -1.576 . . . . 0.0 111.183 -177.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -63.85 -43.81 95.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.196 172.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -66.15 -25.49 66.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.214 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 94.3 mm-40 -80.82 -59.93 2.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.246 178.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 40.0 m -125.7 88.9 53.45 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.203 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -76.97 -27.92 6.52 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 121.717 1.611 . . . . 0.0 111.198 -166.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -68.77 -52.76 26.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.193 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -68.98 -40.95 78.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.204 -178.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.4 98.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.186 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.182 -0.463 . . . . 0.0 112.157 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.6 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 89.7 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.4 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.2 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 51.7 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.9 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.503 HG12 HG21 ' A' ' 100' ' ' ILE . 8.6 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.411 ' HE2' ' HA ' ' A' ' 98' ' ' ALA . 27.4 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 76.1 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.5 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.1 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.8 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.3 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 66.2 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.9 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.4 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 28.9 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.424 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.424 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.6 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 55.5 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD12 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.6 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.42 ' HB2' HG21 ' A' ' 103' ' ' VAL . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.4 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 85.7 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.471 HG22 ' HB3' ' A' ' 118' ' ' LEU . 85.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.4 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 85.0 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.411 ' HA ' ' HE2' ' A' ' 6' ' ' MET . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.503 HG21 HG12 ' A' ' 3' ' ' ILE . 96.5 mt -55.31 -38.76 49.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.796 0.331 . . . . 0.0 111.201 177.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . 0.744 ' C ' HD21 ' A' ' 101' ' ' ASN . 0.1 OUTLIER -69.93 -34.25 73.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.18 -179.453 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 94.3 mmm -76.3 -9.14 58.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.159 -177.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.42 HG21 ' HB2' ' A' ' 74' ' ' ALA . 35.5 m -123.3 27.51 3.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.252 175.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -97.91 92.34 5.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.164 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 57.29 47.54 16.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.224 176.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 26.4 mmt -108.53 163.86 12.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.197 -173.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -72.87 162.3 54.69 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -62.35 -40.31 95.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.821 0.343 . . . . 0.0 111.208 176.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 95.9 m -66.32 -42.42 88.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.182 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -64.53 -43.98 95.8 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.8 t -65.12 -40.46 88.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.791 0.329 . . . . 0.0 111.23 177.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.33 -45.61 84.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.184 177.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -62.38 -37.3 94.4 Favored Glycine 0 CA--C 1.523 0.591 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -69.43 -40.2 77.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.77 0.319 . . . . 0.0 111.2 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 54.3 p -69.47 -18.03 63.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.158 178.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -74.14 -20.08 60.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.21 175.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 49.3 m -115.14 46.0 1.53 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.196 -174.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.471 ' HB3' HG22 ' A' ' 87' ' ' VAL . 85.4 mt -96.43 -47.88 5.8 Favored 'General case' 0 C--N 1.332 -0.173 0 O-C-N 120.789 -1.194 . . . . 0.0 111.212 -174.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -48.61 -40.26 26.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.177 -173.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.6 mmt -62.78 -42.7 99.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.216 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.2 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.393 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.5 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -66.94 -30.65 70.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.212 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 58.6 mt -76.0 -19.39 58.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.217 -177.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -80.31 -0.59 37.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.201 -177.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -106.61 6.66 30.13 Favored 'General case' 0 C--N 1.358 0.961 0 O-C-N 121.601 -0.687 . . . . 0.0 111.193 175.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 82.6 p -75.16 162.92 28.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.242 -177.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 32.7 tpt180 -65.17 -36.57 84.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.216 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 58.2 t-105 -57.0 -40.81 77.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.208 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -69.85 -39.88 76.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.227 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -61.22 -38.39 86.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.19 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -77.72 -56.49 4.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.241 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 51.3 p -129.56 81.0 70.79 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.171 -175.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -61.58 -30.39 85.93 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 121.652 1.568 . . . . 0.0 111.187 175.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -60.69 -37.41 81.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.203 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -90.25 -37.81 13.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.169 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -59.69 -41.28 90.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.215 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.185 -0.462 . . . . 0.0 112.157 -179.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 95.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.1 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 91.3 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 44.1 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 88.5 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.2 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.0 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.475 HD22 ' HA ' ' A' ' 101' ' ' ASN . 76.0 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.6 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.6 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.5 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.3 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.2 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.4 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.503 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.3 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.2 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 88.8 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 14.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.4 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.1 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.9 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.503 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.422 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.5 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.422 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 36.2 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.1 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.8 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.7 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 93.5 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.0 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.8 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 79.4 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 59.6 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.1 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 95.3 mt -63.14 -29.1 46.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.8 0.333 . . . . 0.0 111.209 177.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . 0.475 ' HA ' HD22 ' A' ' 7' ' ' LEU . 20.5 t-20 -64.31 -50.62 67.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.851 0.358 . . . . 0.0 111.213 174.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.5 mtp -72.26 -14.33 61.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.188 -177.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.595 ' O ' HG12 ' A' ' 103' ' ' VAL . 42.2 t -99.36 -4.12 9.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.235 178.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -82.21 70.76 9.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.24 -176.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 48.28 50.95 15.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.209 -176.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 62.1 tpp -79.35 -45.01 20.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.238 -178.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 138.77 159.88 8.2 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 -174.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -64.27 -32.82 74.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.815 0.34 . . . . 0.0 111.204 174.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 94.2 m -65.92 -40.77 91.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.221 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -65.81 -43.42 94.01 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 111.183 -0.767 . . . . 0.0 111.183 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 69.9 t -67.04 -40.69 86.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.799 0.333 . . . . 0.0 111.223 178.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.36 -48.63 80.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.196 176.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -67.4 -32.61 79.76 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 111.177 -0.769 . . . . 0.0 111.177 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -69.48 -35.94 76.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.85 0.357 . . . . 0.0 111.193 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 99.9 m -58.05 -36.95 73.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.184 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -71.99 -24.78 61.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.202 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 82.2 p -89.17 -12.09 41.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.205 -178.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 69.0 mt -57.8 -38.27 75.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.207 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -62.52 -56.38 18.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.237 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.6 mmt -58.8 -41.67 87.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.215 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 80.6 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.393 -174.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.4 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.2 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -57.47 -36.04 70.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.224 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 77.9 mt -78.44 -33.13 48.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.217 177.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.34 -38.36 83.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.236 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -82.35 -5.64 58.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.181 -173.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 68.0 m -80.68 157.26 25.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.22 -174.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -61.38 -31.24 71.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.181 173.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 47.3 t90 -53.25 -49.83 66.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.205 176.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -66.25 -40.9 90.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.188 176.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -54.87 -40.19 69.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.218 -176.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -73.78 -45.76 49.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.203 -172.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 56.1 p -132.21 76.7 72.44 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.213 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -55.6 -38.35 94.25 Favored 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 121.672 1.581 . . . . 0.0 111.175 -178.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.8 m-20 -65.54 -56.46 12.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.24 -174.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 44.0 ttm105 -67.06 -40.6 87.12 Favored 'General case' 0 C--N 1.283 -2.302 0 O-C-N 120.552 -1.342 . . . . 0.0 111.166 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.4 93.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.179 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.157 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.4 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 79.0 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 88.9 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 82.1 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 67.3 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 72.3 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.432 ' HD3' ' HA ' ' A' ' 162' ' ' LYS . 24.9 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.8 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.3 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 19.0 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.447 HD22 ' HA ' ' A' ' 101' ' ' ASN . 34.0 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.1 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 91.9 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.9 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.3 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.9 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 79.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.6 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.0 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.8 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.5 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.2 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.0 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.422 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.422 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 43.5 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 53.2 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.4 HD11 HD12 ' A' ' 50' ' ' ILE . 72.4 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 91.8 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.9 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.426 HG22 ' HB3' ' A' ' 118' ' ' LEU . 78.8 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.1 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.9 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 94.5 mt -61.36 -40.82 87.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.789 0.328 . . . . 0.0 111.213 177.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . 0.447 ' HA ' HD22 ' A' ' 7' ' ' LEU . 19.2 t-20 -58.37 -50.29 74.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.204 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 48.2 ttm -73.26 -22.48 60.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.197 -176.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.419 ' O ' ' CG1' ' A' ' 103' ' ' VAL . 20.3 t -89.84 -10.87 10.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.179 178.009 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -70.36 76.93 0.55 Allowed 'General case' 0 C--N 1.38 1.923 0 C-N-CA 124.614 1.166 . . . . 0.0 111.259 -173.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 54.8 39.42 31.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.191 174.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 25.2 mmt -92.64 169.82 10.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.163 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.26 150.01 51.7 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 111.251 -0.74 . . . . 0.0 111.251 -175.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -61.12 -34.99 75.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.834 0.349 . . . . 0.0 111.203 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 70.4 p -65.48 -31.39 72.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.208 -172.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -75.36 -37.83 40.56 Favored Glycine 0 CA--C 1.523 0.591 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 177.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 79.0 t -65.1 -35.54 75.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.808 0.337 . . . . 0.0 111.132 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.68 -48.0 80.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.226 178.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -65.77 -37.94 93.92 Favored Glycine 0 CA--C 1.524 0.598 0 N-CA-C 111.233 -0.747 . . . . 0.0 111.233 177.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -63.56 -37.52 87.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.832 0.348 . . . . 0.0 111.206 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.408 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 96.4 m -59.88 -37.88 80.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.205 178.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -73.14 -17.79 61.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.243 178.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 67.5 m -95.25 -3.31 47.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.162 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.426 ' HB3' HG22 ' A' ' 87' ' ' VAL . 71.3 mt -62.41 -35.32 78.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.183 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 78.9 ttt180 -59.51 -55.93 28.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.215 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.9 mmt -59.77 -39.84 86.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.218 -175.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.393 -177.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.0 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -62.6 -31.14 71.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.225 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 79.3 mt -78.51 -38.84 39.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.189 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.76 -27.39 68.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.203 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -87.67 -5.09 58.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.188 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 72.0 m -80.51 174.17 11.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.204 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -74.71 -33.25 62.37 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.188 -170.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 -56.25 -47.65 78.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.239 178.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -68.0 -41.12 82.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.225 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -63.46 -33.4 75.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.2 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 96.6 mm-40 -78.6 -47.52 16.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.179 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 27.9 m -136.01 83.49 33.83 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.191 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -69.66 -27.49 26.88 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 121.695 1.597 . . . . 0.0 111.145 -175.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -66.93 -40.82 87.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.231 -174.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -86.96 -40.29 14.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.194 179.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -57.68 -39.64 77.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.192 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.157 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 94.5 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 69.5 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 90.6 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.5 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.7 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 37.9 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.2 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 16.6 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.414 HD22 ' HA ' ' A' ' 101' ' ' ASN . 35.8 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.9 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.6 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.1 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.2 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.5 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.4 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.1 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 28.7 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.425 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.425 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.6 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.4 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.7 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD12 ' A' ' 50' ' ' ILE . 73.1 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 60.1 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 78.1 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.1 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.0 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.472 HG22 ' HB3' ' A' ' 118' ' ' LEU . 77.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 60.7 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.3 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 88.0 mt -60.47 -41.41 87.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.807 0.337 . . . . 0.0 111.206 177.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . 0.414 ' HA ' HD22 ' A' ' 7' ' ' LEU . 12.6 t-20 -73.65 -26.06 60.58 Favored 'General case' 1 C--N 1.237 -4.292 0 C-N-CA 127.061 2.145 . . . . 0.0 111.225 -177.523 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.612 ' HE1' ' HA ' ' A' ' 102' ' ' MET . 4.4 tpt -84.25 -20.72 31.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.224 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 23.1 m -106.21 7.26 9.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.231 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -76.27 75.05 3.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.214 -178.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 57.87 44.47 19.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.193 176.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 26.0 mmt -91.56 161.0 15.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.205 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.91 160.15 26.43 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 176.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -63.86 -27.3 69.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.851 0.358 . . . . 0.0 111.202 -177.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 100.0 m -70.0 -42.91 72.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.165 -177.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -63.15 -43.35 98.79 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.149 -0.78 . . . . 0.0 111.149 173.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 62.0 t -65.03 -40.07 87.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.797 0.332 . . . . 0.0 111.185 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -62.9 -48.89 77.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.214 177.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.58 -37.57 92.41 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -69.83 -42.85 73.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.814 0.34 . . . . 0.0 111.197 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.471 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 39.4 p -68.79 -20.47 64.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.212 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -89.87 -2.71 58.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.229 -179.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 51.7 m -120.13 15.23 12.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.232 179.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.472 ' HB3' HG22 ' A' ' 87' ' ' VAL . 77.6 mt -68.32 -34.61 76.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.172 -176.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -62.24 -47.75 83.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.135 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.7 mmt -63.89 -40.94 97.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.218 -177.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.393 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.1 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -62.04 -35.96 80.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.226 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 75.3 mt -72.48 -39.56 67.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.246 -177.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -78.08 -16.35 58.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.217 -178.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -71.72 -25.72 62.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.219 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 83.7 p -69.51 163.18 25.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.163 -179.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -70.96 -29.11 65.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.191 -174.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 77.7 t-105 -51.92 -35.6 46.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.197 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -65.83 -34.05 77.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.186 -178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -71.53 -32.09 67.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.196 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -78.94 -37.91 38.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.186 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 77.0 p -134.81 69.24 71.61 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.206 -178.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -71.72 -31.04 13.72 Favored 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 120.124 0.549 . . . . 0.0 111.197 -168.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -73.07 -51.05 19.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.181 -177.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 40.2 ttm105 -65.47 -42.27 92.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.165 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -67.64 -39.9 84.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.231 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.192 -0.458 . . . . 0.0 112.157 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.7 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 72.9 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 91.2 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 94.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 44.4 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.446 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 12.9 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.407 HD22 ' HA ' ' A' ' 101' ' ' ASN . 51.1 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.6 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.2 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.8 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.2 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.503 HG21 HD13 ' A' ' 46' ' ' LEU . 14.0 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.2 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.0 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.5 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.9 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.503 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.42 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.5 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.42 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 33.6 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 51.6 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.4 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.8 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.0 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.3 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 71.8 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.8 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.1 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.446 HG21 HG12 ' A' ' 3' ' ' ILE . 96.8 mt -56.7 -42.42 76.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . 0.407 ' HA ' HD22 ' A' ' 7' ' ' LEU . 52.6 t-20 -70.2 -38.69 75.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.229 -178.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.4 tpp -62.32 -33.58 74.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.16 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 15.9 m -98.27 -18.19 6.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.241 -177.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -53.31 109.47 0.44 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.209 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 46.5 43.04 11.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.154 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 62.5 tpp -100.44 140.99 33.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.188 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -76.24 -178.43 44.99 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 111.204 -0.758 . . . . 0.0 111.204 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -65.41 -30.68 71.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.789 0.328 . . . . 0.0 111.213 -178.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 95.9 m -65.59 -50.14 66.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.194 -177.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.37 -39.6 94.27 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 111.176 -0.77 . . . . 0.0 111.176 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 55.1 t -66.22 -37.46 79.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.836 0.351 . . . . 0.0 111.21 -179.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.36 -43.01 95.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.161 176.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.03 -41.32 97.92 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 111.168 -0.773 . . . . 0.0 111.168 177.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -71.03 -35.68 72.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.779 0.323 . . . . 0.0 111.196 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 97.8 m -65.19 -29.42 70.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.231 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -85.7 6.43 27.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.191 176.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 30.7 m -119.7 18.38 12.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.184 176.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 74.0 mt -91.62 1.7 56.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.18 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -102.05 15.67 28.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.195 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 67.7 mtt -134.72 -38.12 0.82 Allowed 'General case' 0 C--N 1.339 0.136 0 CA-C-O 120.808 0.337 . . . . 0.0 111.24 176.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.9 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.393 -178.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -61.55 -37.7 84.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.222 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 55.2 mt -72.28 -33.02 67.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.182 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.86 -14.18 62.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.226 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -103.33 16.78 25.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.193 178.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 80.7 p -88.92 168.86 12.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.214 172.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -71.12 -29.27 65.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.17 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 40.3 t-105 -62.47 -41.08 98.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.19 -178.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 83.8 t80 -67.1 -44.87 78.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.18 -178.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -64.91 -33.99 77.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.189 177.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -69.22 -48.15 62.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.175 179.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 55.3 p -134.45 82.04 47.17 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.207 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -62.58 -40.83 35.49 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 121.738 1.625 . . . . 0.0 111.218 -167.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -68.9 -55.85 9.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.209 -174.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 44.6 ttm105 -57.19 -46.37 82.92 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-O 120.839 0.352 . . . . 0.0 111.255 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.13 -37.98 89.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.207 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.157 175.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 77.2 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 86.7 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.4 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 80.8 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 33.1 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.432 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 13.1 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 60.4 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.6 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.6 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.503 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.7 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.1 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.2 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.8 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.503 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.424 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.424 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.8 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 54.0 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD12 ' A' ' 50' ' ' ILE . 72.7 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.4 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 88.6 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 97.0 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.403 HG22 ' HB3' ' A' ' 118' ' ' LEU . 79.4 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.8 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.8 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.432 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -58.08 -42.79 83.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.774 0.321 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 55.6 t-20 -67.36 -35.51 79.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.227 175.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 63.5 tpp -63.27 -28.51 70.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.169 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 33.0 m -112.05 22.72 5.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.182 -178.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -85.7 86.52 7.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.181 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 66.71 20.58 10.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.175 178.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 61.0 tpp -70.88 133.8 46.76 Favored 'General case' 0 C--N 1.333 -0.113 0 O-C-N 118.309 -2.744 . . . . 0.0 111.178 -167.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -64.22 156.01 45.57 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -64.82 -25.16 67.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.823 0.344 . . . . 0.0 111.22 -174.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 72.7 p -66.05 -30.71 71.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.226 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -87.49 -34.01 10.89 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 179.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 77.1 t -66.08 -37.57 80.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.789 0.328 . . . . 0.0 111.198 177.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -58.79 -47.44 84.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.202 177.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -63.76 -43.3 97.94 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 111.184 -0.766 . . . . 0.0 111.184 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -61.37 -36.08 79.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.784 0.326 . . . . 0.0 111.189 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 81.3 m -65.12 -26.92 68.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.167 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -82.32 -10.17 59.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.212 178.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 56.2 m -108.45 -3.09 18.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.217 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.403 ' HB3' HG22 ' A' ' 87' ' ' VAL . 69.9 mt -57.22 -39.64 75.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.164 175.218 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -63.7 -51.96 62.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.22 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.6 mmt -60.65 -40.11 90.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.255 -178.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 81.4 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.393 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.0 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -63.71 -34.12 77.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.208 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.2 -38.61 69.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.245 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -75.76 -1.91 27.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.193 -174.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -96.81 -0.47 47.91 Favored 'General case' 0 C--N 1.385 2.133 0 O-C-N 120.38 -1.45 . . . . 0.0 111.184 175.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 82.8 p -77.11 164.03 26.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.213 -177.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.47 -35.12 79.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.212 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 55.7 t-105 -57.27 -39.91 76.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.217 -178.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -65.35 -41.84 93.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.23 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -65.82 -35.44 80.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.224 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -77.61 -41.85 37.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.18 -176.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 54.9 p -133.25 79.58 61.08 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.18 176.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -62.02 -35.17 78.09 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 121.689 1.592 . . . . 0.0 111.201 -174.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -68.27 -51.47 44.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.199 179.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 85.0 mtt85 -63.04 -45.42 92.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.206 -178.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -66.31 -41.75 89.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.219 -179.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.157 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 70.1 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 92.7 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 35.1 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.475 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.2 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.43 HD21 ' HA ' ' A' ' 101' ' ' ASN . 78.3 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.6 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.2 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.9 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.9 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.7 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.3 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.416 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.416 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.4 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.0 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 55.0 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.8 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.0 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 92.3 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.468 HG21 ' HB3' ' A' ' 118' ' ' LEU . 73.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.0 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.1 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.475 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -56.72 -38.44 58.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.849 0.357 . . . . 0.0 111.212 177.239 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ASN . . . . . 0.43 ' HA ' HD21 ' A' ' 7' ' ' LEU . 49.5 t-20 -65.28 -46.79 79.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.164 178.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.0 mmm -61.73 -30.27 70.66 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 125.039 1.336 . . . . 0.0 111.2 -174.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 24.2 m . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.242 -179.015 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 94.5 p . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.828 0.346 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.468 ' HB3' HG21 ' A' ' 87' ' ' VAL . 70.1 mt -52.32 -45.43 65.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.196 -173.529 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 78.2 ttt180 -60.33 -59.98 4.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.198 -177.155 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.4 mmt -59.87 -34.1 72.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.176 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 72.1 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.393 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.2 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.7 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -58.67 -42.07 87.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.207 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.467 HD23 ' O ' ' A' ' 133' ' ' LEU . 1.2 tt -76.21 -35.0 59.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.158 -178.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.48 -30.42 69.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.225 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.0 mttt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.249 -175.451 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo . . . . . 0 N--CA 1.459 -0.558 0 N-CA-C 111.198 -0.347 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -69.16 -52.65 25.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.171 -175.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 43.7 ttm105 -65.88 -45.18 83.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.176 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -62.84 -40.93 98.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.246 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.157 177.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.5 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 72.6 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 92.2 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 40.5 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.9 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.418 HG12 HG21 ' A' ' 100' ' ' ILE . 8.9 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.41 ' HE1' ' HA ' ' A' ' 98' ' ' ALA . 27.3 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.432 HD21 ' HA ' ' A' ' 101' ' ' ASN . 58.8 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.5 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.2 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.4 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.7 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.7 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.5 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.7 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 15.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.3 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.2 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 45.5 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.422 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.422 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.4 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 28.9 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.9 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.4 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.8 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.568 HG21 ' HB3' ' A' ' 118' ' ' LEU . 78.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 60.7 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 85.0 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 90.1 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.41 ' HA ' ' HE1' ' A' ' 6' ' ' MET . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.418 HG21 HG12 ' A' ' 3' ' ' ILE . 96.5 mt -58.97 -38.49 73.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.821 0.344 . . . . 0.0 111.196 177.239 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ASN . . . . . 0.432 ' HA ' HD21 ' A' ' 7' ' ' LEU . 14.6 t-20 -67.35 -43.0 82.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.191 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.5 tpp -64.55 -33.88 76.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.193 -175.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 20.0 m . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.185 -179.963 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.8 m . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.754 0.312 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.568 ' HB3' HG21 ' A' ' 87' ' ' VAL . 76.6 mt -62.3 -36.87 83.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.244 173.671 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -65.3 -51.56 59.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.229 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.3 mmt -59.01 -41.91 88.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.192 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 79.6 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.393 -178.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.0 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -66.31 -28.27 68.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.209 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 57.5 mt -75.23 -19.58 59.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.181 -178.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -89.31 -2.78 58.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.228 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 97.8 mttt . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.166 -179.315 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo . . . . . 0 N--CA 1.458 -0.596 0 N-CA-C 111.21 -0.342 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -64.66 -29.86 70.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.162 -179.077 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 42.2 ttm105 -93.48 -41.36 9.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.245 178.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -62.76 -44.0 97.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.243 -178.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.157 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 94.7 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.1 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 89.2 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.8 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 94.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 79.9 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 32.3 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 88.3 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.428 HG12 HG21 ' A' ' 100' ' ' ILE . 9.0 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.4 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.1 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.6 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.4 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.1 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.5 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.8 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.5 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 66.1 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.1 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 88.9 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.7 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.5 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.6 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.3 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 45.9 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.422 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.5 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.422 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.7 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.4 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 37.0 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.7 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.8 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 70.2 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 86.8 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.3 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.558 HG21 ' HB3' ' A' ' 118' ' ' LEU . 70.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 59.3 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.428 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -58.6 -29.16 38.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.796 0.331 . . . . 0.0 111.183 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -80.73 -33.19 35.36 Favored 'General case' 0 C--N 1.292 -1.896 0 C-N-CA 124.548 1.139 . . . . 0.0 111.246 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.8 mmm -72.13 -17.11 61.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.203 179.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 30.0 m . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.168 -176.839 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.6 m . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.852 0.358 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.558 ' HB3' HG21 ' A' ' 87' ' ' VAL . 52.9 mt -73.4 -33.35 64.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.224 -177.659 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -65.86 -41.7 91.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.192 -176.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.8 mmt -68.45 -38.63 81.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.202 -179.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.0 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.393 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -64.86 -35.35 80.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.198 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 49.3 mt -70.1 -33.11 71.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.192 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.74 -13.3 62.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.23 -177.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.4 mttt . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.214 -179.238 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo . . . . . 0 N--CA 1.458 -0.568 0 N-CA-C 111.187 -0.351 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -67.9 -49.76 60.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.21 176.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.7 mtt85 -70.41 -41.43 72.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.233 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.7 -40.55 95.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.193 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.157 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 95.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 87.3 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 71.9 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 162' ' ' LYS . 28.5 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.463 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.0 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 69.3 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.8 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.5 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.7 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.8 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.7 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.6 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.5 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 28.7 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.421 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.421 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.6 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.1 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 62.0 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.5 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.9 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.8 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.498 HG21 ' HB3' ' A' ' 118' ' ' LEU . 70.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.6 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 91.5 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.463 HG21 HG12 ' A' ' 3' ' ' ILE . 96.3 mt -57.07 -36.35 50.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.847 0.356 . . . . 0.0 111.195 177.239 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 38.7 t-20 -68.16 -41.9 80.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.199 177.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 91.0 mmm -64.84 -20.13 66.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.149 -173.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 34.9 m . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.242 -176.898 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 69.2 m . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.824 0.345 . . . . 0.0 111.199 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.498 ' HB3' HG21 ' A' ' 87' ' ' VAL . 82.8 mt -76.78 -27.86 55.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.164 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -66.41 -29.44 69.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.189 -174.59 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.2 mmt -85.18 -34.99 21.96 Favored 'General case' 0 C--N 1.345 0.375 0 C-N-CA 119.261 -0.976 . . . . 0.0 111.253 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.5 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.393 -177.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.9 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -57.41 -37.05 72.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.202 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 87.8 mt -80.11 -33.11 38.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.218 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.51 -28.19 67.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.212 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.0 mttt . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.166 179.34 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo . . . . . 0 N--CA 1.458 -0.581 0 N-CA-C 111.198 -0.347 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -68.77 -52.76 26.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.193 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -68.98 -40.95 78.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.204 -178.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.4 98.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.186 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.182 -0.463 . . . . 0.0 112.157 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.6 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 89.7 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.4 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.2 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 51.7 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.9 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.513 HG12 HG21 ' A' ' 100' ' ' ILE . 8.6 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 27.4 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 76.1 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.5 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.1 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.8 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.3 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 66.2 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.9 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.4 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 28.9 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.419 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.419 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.6 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 55.5 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.6 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.419 ' HB1' HG23 ' A' ' 103' ' ' VAL . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.4 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 85.7 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.531 HG21 ' HB3' ' A' ' 118' ' ' LEU . 85.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.4 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 85.0 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.513 HG21 HG12 ' A' ' 3' ' ' ILE . 96.5 mt -55.31 -38.76 49.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.796 0.331 . . . . 0.0 111.201 177.239 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ASN . . . . . 0.406 ' OD1' ' O ' ' A' ' 101' ' ' ASN . 40.6 t-20 -69.93 -34.25 73.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.18 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 94.3 mmm -76.3 -9.14 58.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.159 -177.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.419 HG23 ' HB1' ' A' ' 74' ' ' ALA . 35.5 m . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.252 175.291 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.786 0.327 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.531 ' HB3' HG21 ' A' ' 87' ' ' VAL . 85.4 mt -96.43 -47.88 5.8 Favored 'General case' 0 C--N 1.332 -0.173 0 O-C-N 120.789 -1.194 . . . . 0.0 111.212 -174.023 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -48.61 -40.26 26.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.177 -173.106 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.6 mmt -62.78 -42.7 99.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.216 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.2 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.393 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.5 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -66.94 -30.65 70.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.212 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 58.6 mt -76.0 -19.39 58.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.217 -177.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -80.31 -0.59 37.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.201 -177.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 97.9 mttt . . . . . 0 C--N 1.358 0.961 0 O-C-N 121.601 -0.687 . . . . 0.0 111.193 175.799 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo . . . . . 0 N--CA 1.458 -0.562 0 N-CA-C 111.187 -0.351 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -60.69 -37.41 81.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.203 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -90.25 -37.81 13.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.169 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -59.69 -41.28 90.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.215 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.185 -0.462 . . . . 0.0 112.157 -179.4 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 95.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.1 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 91.3 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 44.1 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 88.5 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.2 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.0 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.465 HD21 ' HA ' ' A' ' 101' ' ' ASN . 76.0 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.6 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.6 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.5 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.3 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.2 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.4 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.3 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.2 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 88.8 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 14.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.4 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.1 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.9 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.418 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.5 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.418 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 36.2 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.1 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.8 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.7 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 93.5 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.0 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.8 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.466 HG21 ' HB3' ' A' ' 118' ' ' LEU . 79.4 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 59.6 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.1 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 95.3 mt -63.14 -29.1 46.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.8 0.333 . . . . 0.0 111.209 177.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ASN . . . . . 0.465 ' HA ' HD21 ' A' ' 7' ' ' LEU . 20.5 t-20 -64.31 -50.62 67.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.851 0.358 . . . . 0.0 111.213 174.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.41 ' HG3' HG11 ' A' ' 149' ' ' VAL . 96.5 mtp -72.26 -14.33 61.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.188 -177.551 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.595 ' O ' HG12 ' A' ' 103' ' ' VAL . 42.2 t . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.235 178.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 82.2 p . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.801 0.334 . . . . 0.0 111.205 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.466 ' HB3' HG21 ' A' ' 87' ' ' VAL . 69.0 mt -57.8 -38.27 75.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.207 -178.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -62.52 -56.38 18.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.237 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.408 ' HB3' ' HB2' ' A' ' 129' ' ' ALA . 36.6 mmt -58.8 -41.67 87.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.215 -179.492 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 80.6 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.393 -174.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.4 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.2 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.408 ' HB2' ' HB3' ' A' ' 120' ' ' MET . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -57.47 -36.04 70.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.224 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 77.9 mt -78.44 -33.13 48.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.217 177.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.34 -38.36 83.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.236 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.3 mttt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.181 -173.865 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo . . . . . 0 N--CA 1.458 -0.599 0 N-CA-C 111.175 -0.356 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.8 m-20 -65.54 -56.46 12.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.24 -174.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 44.0 ttm105 -67.06 -40.6 87.12 Favored 'General case' 0 C--N 1.283 -2.302 0 O-C-N 120.552 -1.342 . . . . 0.0 111.166 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.4 93.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.179 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.157 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.4 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' VAL . . . . . 0.41 HG11 ' HG3' ' A' ' 102' ' ' MET . 79.0 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 88.9 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 82.1 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 67.3 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 72.3 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.8 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.3 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 19.0 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.423 HD21 ' HA ' ' A' ' 101' ' ' ASN . 34.0 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.1 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 91.9 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.9 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.3 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.9 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 79.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.6 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.0 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.8 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.5 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.2 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.0 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.417 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.417 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 43.5 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 53.2 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.4 HD11 HD11 ' A' ' 50' ' ' ILE . 72.4 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 91.8 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.9 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.509 HG21 ' HB3' ' A' ' 118' ' ' LEU . 78.8 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.1 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.9 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 94.5 mt -61.36 -40.82 87.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.789 0.328 . . . . 0.0 111.213 177.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ASN . . . . . 0.423 ' HA ' HD21 ' A' ' 7' ' ' LEU . 19.2 t-20 -58.37 -50.29 74.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.204 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 48.2 ttm -73.26 -22.48 60.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.197 -176.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.419 ' O ' ' CG1' ' A' ' 103' ' ' VAL . 20.3 t . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.179 178.009 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 67.5 m . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.779 0.323 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.509 ' HB3' HG21 ' A' ' 87' ' ' VAL . 71.3 mt -62.41 -35.32 78.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.183 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 78.9 ttt180 -59.51 -55.93 28.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.215 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.9 mmt -59.77 -39.84 86.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.218 -175.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.393 -177.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.0 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -62.6 -31.14 71.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.225 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 79.3 mt -78.51 -38.84 39.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.189 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.76 -27.39 68.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.203 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.1 mttt . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.188 179.76 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo . . . . . 0 N--CA 1.458 -0.591 0 N-CA-C 111.145 -0.367 . . . . 0.0 111.145 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -66.93 -40.82 87.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.231 -174.102 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -86.96 -40.29 14.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.194 179.158 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -57.68 -39.64 77.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.192 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.157 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 94.5 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 69.5 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 90.6 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.5 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.7 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 37.9 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.2 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 16.6 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 35.8 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.9 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.6 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.1 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.2 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.5 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.4 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.1 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 28.7 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.419 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.419 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.6 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.4 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.7 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 73.1 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 60.1 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 78.1 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.1 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.0 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.552 HG21 ' HB3' ' A' ' 118' ' ' LEU . 77.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 60.7 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.3 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 88.0 mt -60.47 -41.41 87.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.807 0.337 . . . . 0.0 111.206 177.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -73.65 -26.06 60.58 Favored 'General case' 1 C--N 1.237 -4.292 0 C-N-CA 127.061 2.145 . . . . 0.0 111.225 -177.523 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 4.4 tpt -84.25 -20.72 31.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.224 179.117 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 23.1 m . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.231 177.983 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 51.7 m . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.801 0.334 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.552 ' HB3' HG21 ' A' ' 87' ' ' VAL . 77.6 mt -68.32 -34.61 76.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.172 -176.278 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -62.24 -47.75 83.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.135 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.7 mmt -63.89 -40.94 97.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.218 -177.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.393 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.1 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -62.04 -35.96 80.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.226 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 75.3 mt -72.48 -39.56 67.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.246 -177.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -78.08 -16.35 58.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.217 -178.117 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 88.7 tttt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.219 -179.363 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 N--CA 1.458 -0.587 0 N-CA-C 111.197 -0.347 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -73.07 -51.05 19.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.181 -177.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 40.2 ttm105 -65.47 -42.27 92.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.165 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -67.64 -39.9 84.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.231 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.192 -0.458 . . . . 0.0 112.157 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.7 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 72.9 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 91.2 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 94.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 44.4 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.465 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 12.9 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 51.1 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.6 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.2 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.8 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.2 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.0 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.2 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.0 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.5 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.9 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.416 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.5 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.416 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 33.6 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 51.6 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.4 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.8 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.0 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.3 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.406 HG21 ' HB3' ' A' ' 118' ' ' LEU . 71.8 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.8 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.1 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.465 HG21 HG12 ' A' ' 3' ' ' ILE . 96.8 mt -56.7 -42.42 76.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 52.6 t-20 -70.2 -38.69 75.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.229 -178.097 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.4 tpp -62.32 -33.58 74.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.16 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 15.9 m . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.241 -177.317 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 30.7 m . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.779 0.323 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.406 ' HB3' HG21 ' A' ' 87' ' ' VAL . 74.0 mt -91.62 1.7 56.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.18 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -102.05 15.67 28.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.195 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 67.7 mtt -134.72 -38.12 0.82 Allowed 'General case' 0 C--N 1.339 0.136 0 CA-C-O 120.808 0.337 . . . . 0.0 111.24 176.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.9 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.393 -178.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -61.55 -37.7 84.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.222 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 55.2 mt -72.28 -33.02 67.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.182 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.86 -14.18 62.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.226 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.193 178.702 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo . . . . . 0 N--CA 1.457 -0.628 0 N-CA-C 111.218 -0.339 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -68.9 -55.85 9.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.209 -174.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 44.6 ttm105 -57.19 -46.37 82.92 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-O 120.839 0.352 . . . . 0.0 111.255 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.13 -37.98 89.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.207 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.157 175.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 77.2 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 86.7 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.4 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 80.8 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 33.1 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.44 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 13.1 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 60.4 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.6 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.6 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.7 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.1 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.2 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.8 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.421 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.421 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.8 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 54.0 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.4 HD11 HD11 ' A' ' 50' ' ' ILE . 72.7 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.4 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 88.6 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 97.0 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.488 HG21 ' HB3' ' A' ' 118' ' ' LEU . 79.4 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.8 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.8 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.44 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -58.08 -42.79 83.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.774 0.321 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 55.6 t-20 -67.36 -35.51 79.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.227 175.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 63.5 tpp -63.27 -28.51 70.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.169 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 33.0 m . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.182 -178.043 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 56.2 m . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.779 0.323 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.488 ' HB3' HG21 ' A' ' 87' ' ' VAL . 69.9 mt -57.22 -39.64 75.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.164 175.218 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -63.7 -51.96 62.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.22 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.6 mmt -60.65 -40.11 90.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.255 -178.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 81.4 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.393 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.0 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -63.71 -34.12 77.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.208 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.2 -38.61 69.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.245 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -75.76 -1.91 27.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.193 -174.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 C--N 1.385 2.133 0 O-C-N 120.38 -1.45 . . . . 0.0 111.184 175.41 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo . . . . . 0 N--CA 1.459 -0.55 0 N-CA-C 111.201 -0.346 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -68.27 -51.47 44.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.199 179.293 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 85.0 mtt85 -63.04 -45.42 92.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.206 -178.4 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -66.31 -41.75 89.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.219 -179.308 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.157 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 70.1 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 92.7 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 35.1 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.475 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.2 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.43 HD21 ' HA ' ' A' ' 101' ' ' ASN . 78.3 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.6 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.2 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.9 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.9 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.7 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.3 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.416 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.416 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.4 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.0 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 55.0 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.8 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.0 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 92.3 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.468 HG21 ' HB3' ' A' ' 118' ' ' LEU . 73.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.0 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.1 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.475 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -56.72 -38.44 58.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.849 0.357 . . . . 0.0 111.212 177.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ASN . . . . . 0.43 ' HA ' HD21 ' A' ' 7' ' ' LEU . 49.5 t-20 -65.28 -46.79 79.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.164 178.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.0 mmm -61.73 -30.27 70.66 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 125.039 1.336 . . . . 0.0 111.2 -174.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 24.2 m -102.07 5.86 10.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.242 -179.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -79.68 83.41 5.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.21 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 52.41 51.5 16.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.201 172.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 26.6 mmt -100.22 162.24 13.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.225 177.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -59.63 179.97 1.88 Allowed Glycine 0 CA--C 1.524 0.614 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 168.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.72 -30.36 69.92 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.767 0.318 . . . . 0.0 111.143 173.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 68.1 p -65.19 -35.1 80.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.227 -174.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -68.68 -42.53 79.67 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 111.214 -0.755 . . . . 0.0 111.214 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 77.4 t -64.63 -43.92 96.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.808 0.337 . . . . 0.0 111.212 178.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -63.88 -47.51 80.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.203 -177.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -61.56 -44.17 98.33 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -70.29 -36.08 74.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.753 0.311 . . . . 0.0 111.191 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.459 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 57.7 m -66.0 -32.42 73.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.202 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -76.27 -19.03 58.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.227 178.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 94.5 p -91.29 -14.51 30.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.19 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.468 ' HB3' HG21 ' A' ' 87' ' ' VAL . 70.1 mt -52.32 -45.43 65.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.196 -173.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 78.2 ttt180 -60.33 -59.98 4.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.198 -177.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.4 mmt -59.87 -34.1 72.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.176 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 72.1 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.393 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.2 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.7 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -58.67 -42.07 87.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.207 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.467 HD23 ' O ' ' A' ' 133' ' ' LEU . 1.2 tt -76.21 -35.0 59.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.158 -178.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.48 -30.42 69.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.225 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -92.8 16.2 12.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.249 -175.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 65.6 p -84.41 177.37 8.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.208 -178.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -76.65 -31.83 57.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.158 172.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 60.8 t-105 -55.65 -50.69 69.53 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.165 176.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -60.38 -38.13 82.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.182 -178.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -58.68 -37.37 75.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.223 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -83.2 -40.22 19.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.192 -172.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 64.5 p -135.25 75.77 58.55 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.183 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -57.73 -37.1 97.85 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 121.707 1.605 . . . . 0.0 111.198 -177.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -69.16 -52.65 25.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.171 -175.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 43.7 ttm105 -65.88 -45.18 83.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.176 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -62.84 -40.93 98.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.246 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.157 177.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.5 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 72.6 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 92.2 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 40.5 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.9 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.418 HG12 HG21 ' A' ' 100' ' ' ILE . 8.9 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.41 ' HE1' ' HA ' ' A' ' 98' ' ' ALA . 27.3 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.432 HD21 ' HA ' ' A' ' 101' ' ' ASN . 58.8 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.5 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.2 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.4 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.7 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.7 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.5 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.7 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 15.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.3 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.2 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 45.5 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.422 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.422 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.4 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 28.9 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.9 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.4 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.8 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.568 HG21 ' HB3' ' A' ' 118' ' ' LEU . 78.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 60.7 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 85.0 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 90.1 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.41 ' HA ' ' HE1' ' A' ' 6' ' ' MET . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.418 HG21 HG12 ' A' ' 3' ' ' ILE . 96.5 mt -58.97 -38.49 73.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.821 0.344 . . . . 0.0 111.196 177.239 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ASN . . . . . 0.432 ' HA ' HD21 ' A' ' 7' ' ' LEU . 14.6 t-20 -67.35 -43.0 82.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.191 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.5 tpp -64.55 -33.88 76.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.193 -175.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 20.0 m -93.12 3.05 8.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.185 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -79.5 73.23 6.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.211 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 48.16 58.64 4.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.206 178.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 25.1 mmt -109.34 174.1 6.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.165 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -48.87 136.44 19.37 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.74 -34.03 73.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.756 0.312 . . . . 0.0 111.203 176.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 80.9 p -69.18 -28.34 66.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.184 178.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -77.68 -39.18 25.84 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -176.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 79.1 t -63.23 -40.92 90.86 Favored 'Isoleucine or valine' 0 C--N 1.342 0.256 0 O-C-N 125.729 1.488 . . . . 0.0 111.188 169.175 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.45 -49.92 74.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.195 -178.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -64.83 -43.92 95.43 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 111.231 -0.747 . . . . 0.0 111.231 177.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -55.43 -40.06 71.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.781 0.324 . . . . 0.0 111.176 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.446 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 94.0 m -59.12 -35.96 74.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.196 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -70.81 -25.41 62.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.177 177.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.8 m -95.46 5.79 50.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.195 -178.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.568 ' HB3' HG21 ' A' ' 87' ' ' VAL . 76.6 mt -62.3 -36.87 83.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.244 173.671 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -65.3 -51.56 59.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.229 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.3 mmt -59.01 -41.91 88.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.192 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 79.6 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.393 -178.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.0 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -66.31 -28.27 68.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.209 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 57.5 mt -75.23 -19.58 59.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.181 -178.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -89.31 -2.78 58.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.228 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -86.7 -9.85 55.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.166 -179.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 89.1 p -72.91 135.56 45.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.189 175.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 6.3 tpm_? -45.49 -44.07 12.18 Favored 'General case' 0 C--N 1.367 1.339 0 O-C-N 121.464 -0.773 . . . . 0.0 111.164 173.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 74.6 t90 -58.31 -32.33 68.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.197 -171.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -55.66 -45.57 77.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.175 173.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -76.7 -20.86 56.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.2 -176.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -83.01 -40.51 19.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.23 -179.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 62.7 p -134.27 71.34 72.56 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.185 175.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -70.07 -26.17 26.39 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 121.72 1.614 . . . . 0.0 111.21 -173.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -64.66 -29.86 70.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.162 -179.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 42.2 ttm105 -93.48 -41.36 9.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.245 178.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -62.76 -44.0 97.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.243 -178.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.157 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 94.7 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.1 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 89.2 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.8 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 94.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 79.9 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 32.3 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 88.3 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.428 HG12 HG21 ' A' ' 100' ' ' ILE . 9.0 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.4 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.1 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.6 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.4 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.1 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.5 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.8 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.5 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 66.1 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.1 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 88.9 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.7 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.5 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.6 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.3 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 45.9 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.422 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.5 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.422 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.7 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.4 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 37.0 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.7 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.8 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 70.2 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 86.8 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.3 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.558 HG21 ' HB3' ' A' ' 118' ' ' LEU . 70.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 59.3 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.428 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -58.6 -29.16 38.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.796 0.331 . . . . 0.0 111.183 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -80.73 -33.19 35.36 Favored 'General case' 0 C--N 1.292 -1.896 0 C-N-CA 124.548 1.139 . . . . 0.0 111.246 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.8 mmm -72.13 -17.11 61.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.203 179.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 30.0 m -115.31 3.3 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.168 -176.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -75.95 91.71 3.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.203 176.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 58.64 31.6 21.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.197 178.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 57.0 tpp -76.38 143.02 40.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.202 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.61 154.36 50.71 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 178.137 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -58.01 -40.0 79.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.822 0.344 . . . . 0.0 111.197 -178.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 97.6 m -63.32 -44.43 94.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.149 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -64.69 -38.92 96.26 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.7 t -66.16 -37.95 80.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.753 0.311 . . . . 0.0 111.21 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.09 -45.23 93.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.256 174.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -61.16 -38.83 96.26 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 177.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -68.31 -39.37 82.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.806 0.336 . . . . 0.0 111.186 176.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.455 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 89.2 m -59.08 -39.22 81.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.204 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -66.55 -22.83 66.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.175 -178.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.6 m -99.0 11.77 38.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.245 -176.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.558 ' HB3' HG21 ' A' ' 87' ' ' VAL . 52.9 mt -73.4 -33.35 64.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.224 -177.659 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -65.86 -41.7 91.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.192 -176.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.8 mmt -68.45 -38.63 81.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.202 -179.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.0 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.393 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -64.86 -35.35 80.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.198 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 49.3 mt -70.1 -33.11 71.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.192 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.74 -13.3 62.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.23 -177.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -92.69 5.04 52.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.214 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 97.1 p -82.68 156.98 23.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.197 178.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -59.44 -33.53 71.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.225 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 54.7 t-105 -58.23 -38.88 77.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.218 -178.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -71.55 -38.86 70.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.225 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -67.22 -29.37 69.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.226 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -85.86 -54.97 4.19 Favored 'General case' 0 C--N 1.344 0.328 0 O-C-N 121.465 -0.772 . . . . 0.0 111.184 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 53.0 p -123.93 78.94 57.89 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.177 177.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -68.23 -24.95 37.29 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 121.675 1.583 . . . . 0.0 111.187 -176.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -67.9 -49.76 60.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.21 176.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.7 mtt85 -70.41 -41.43 72.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.233 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.7 -40.55 95.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.193 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.157 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 95.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 87.3 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 71.9 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 162' ' ' LYS . 28.5 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.463 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.0 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 69.3 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.8 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.5 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.7 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.8 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.7 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.6 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.5 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 28.7 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.421 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.421 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.6 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.1 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 62.0 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.5 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.9 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.8 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.498 HG21 ' HB3' ' A' ' 118' ' ' LEU . 70.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.6 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 91.5 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.463 HG21 HG12 ' A' ' 3' ' ' ILE . 96.3 mt -57.07 -36.35 50.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.847 0.356 . . . . 0.0 111.195 177.239 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 38.7 t-20 -68.16 -41.9 80.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.199 177.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 91.0 mmm -64.84 -20.13 66.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.149 -173.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 34.9 m -111.24 6.49 8.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.242 -176.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -87.45 107.43 18.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.166 175.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.59 ' HG2' ' O ' ' A' ' 105' ' ' GLN . 33.0 tt0 50.07 54.12 11.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.223 -175.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 63.5 tpp -107.45 136.43 47.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.203 -178.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -74.64 172.54 52.6 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 111.191 -0.763 . . . . 0.0 111.191 -178.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -61.07 -36.41 79.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.832 0.349 . . . . 0.0 111.221 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 98.0 m -68.26 -44.17 76.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.212 -177.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -61.39 -43.72 98.98 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 175.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 55.4 t -63.78 -41.42 92.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.803 0.335 . . . . 0.0 111.216 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -62.64 -46.68 87.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.24 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -61.14 -43.75 99.01 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -69.04 -39.69 79.05 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.801 0.334 . . . . 0.0 111.15 -178.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.461 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 80.0 m -62.58 -37.26 85.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.194 178.067 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -72.41 -12.18 61.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.202 178.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 69.2 m -108.88 14.98 23.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.199 -177.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.498 ' HB3' HG21 ' A' ' 87' ' ' VAL . 82.8 mt -76.78 -27.86 55.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.164 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -66.41 -29.44 69.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.189 -174.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.2 mmt -85.18 -34.99 21.96 Favored 'General case' 0 C--N 1.345 0.375 0 C-N-CA 119.261 -0.976 . . . . 0.0 111.253 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.5 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.393 -177.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.9 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -57.41 -37.05 72.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.202 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 87.8 mt -80.11 -33.11 38.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.218 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.51 -28.19 67.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.212 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -91.84 6.26 46.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.166 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 67.3 m -89.9 157.42 17.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.194 178.005 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -61.96 -29.43 70.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.226 -173.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 48.1 t-105 -62.92 -39.21 93.86 Favored 'General case' 0 C--N 1.368 1.392 0 O-C-N 120.178 -1.576 . . . . 0.0 111.183 -177.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -63.85 -43.81 95.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.196 172.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -66.15 -25.49 66.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.214 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 94.3 mm-40 -80.82 -59.93 2.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.246 178.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 40.0 m -125.7 88.9 53.45 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.203 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -76.97 -27.92 6.52 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 121.717 1.611 . . . . 0.0 111.198 -166.143 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -68.77 -52.76 26.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.193 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -68.98 -40.95 78.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.204 -178.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.4 98.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.186 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.182 -0.463 . . . . 0.0 112.157 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.6 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 89.7 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.4 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.2 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 51.7 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.9 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.513 HG12 HG21 ' A' ' 100' ' ' ILE . 8.6 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 27.4 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 76.1 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.5 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.1 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.8 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.3 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 66.2 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.9 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.4 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 28.9 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.419 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.419 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.6 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 55.5 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.6 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.419 ' HB1' HG23 ' A' ' 103' ' ' VAL . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.4 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 85.7 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.531 HG21 ' HB3' ' A' ' 118' ' ' LEU . 85.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.4 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 85.0 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.513 HG21 HG12 ' A' ' 3' ' ' ILE . 96.5 mt -55.31 -38.76 49.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.796 0.331 . . . . 0.0 111.201 177.239 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ASN . . . . . 0.406 ' OD1' ' O ' ' A' ' 101' ' ' ASN . 40.6 t-20 -69.93 -34.25 73.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.18 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 94.3 mmm -76.3 -9.14 58.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.159 -177.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.419 HG23 ' HB1' ' A' ' 74' ' ' ALA . 35.5 m -123.3 27.51 3.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.252 175.291 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -97.91 92.34 5.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.164 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 57.29 47.54 16.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.224 176.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 26.4 mmt -108.53 163.86 12.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.197 -173.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -72.87 162.3 54.69 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -62.35 -40.31 95.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.821 0.343 . . . . 0.0 111.208 176.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 95.9 m -66.32 -42.42 88.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.182 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -64.53 -43.98 95.8 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.8 t -65.12 -40.46 88.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.791 0.329 . . . . 0.0 111.23 177.036 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.33 -45.61 84.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.184 177.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -62.38 -37.3 94.4 Favored Glycine 0 CA--C 1.523 0.591 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -69.43 -40.2 77.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.77 0.319 . . . . 0.0 111.2 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 54.3 p -69.47 -18.03 63.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.158 178.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -74.14 -20.08 60.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.21 175.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 49.3 m -115.14 46.0 1.53 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.196 -174.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.531 ' HB3' HG21 ' A' ' 87' ' ' VAL . 85.4 mt -96.43 -47.88 5.8 Favored 'General case' 0 C--N 1.332 -0.173 0 O-C-N 120.789 -1.194 . . . . 0.0 111.212 -174.023 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -48.61 -40.26 26.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.177 -173.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.6 mmt -62.78 -42.7 99.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.216 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.2 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.393 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.5 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -66.94 -30.65 70.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.212 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 58.6 mt -76.0 -19.39 58.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.217 -177.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -80.31 -0.59 37.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.201 -177.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -106.61 6.66 30.13 Favored 'General case' 0 C--N 1.358 0.961 0 O-C-N 121.601 -0.687 . . . . 0.0 111.193 175.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 82.6 p -75.16 162.92 28.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.242 -177.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 32.7 tpt180 -65.17 -36.57 84.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.216 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 58.2 t-105 -57.0 -40.81 77.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.208 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -69.85 -39.88 76.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.227 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -61.22 -38.39 86.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.19 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -77.72 -56.49 4.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.241 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 51.3 p -129.56 81.0 70.79 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.171 -175.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -61.58 -30.39 85.93 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 121.652 1.568 . . . . 0.0 111.187 175.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -60.69 -37.41 81.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.203 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -90.25 -37.81 13.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.169 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -59.69 -41.28 90.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.215 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.185 -0.462 . . . . 0.0 112.157 -179.4 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 95.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.1 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 91.3 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 44.1 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 88.5 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.2 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.0 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.465 HD21 ' HA ' ' A' ' 101' ' ' ASN . 76.0 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.6 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.6 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.5 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.3 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.2 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.4 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.3 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.2 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 88.8 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 14.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.4 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.1 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.9 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.418 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.5 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.418 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 36.2 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.1 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.8 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.7 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 93.5 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.0 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.8 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.466 HG21 ' HB3' ' A' ' 118' ' ' LEU . 79.4 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 59.6 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.1 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 95.3 mt -63.14 -29.1 46.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.8 0.333 . . . . 0.0 111.209 177.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ASN . . . . . 0.465 ' HA ' HD21 ' A' ' 7' ' ' LEU . 20.5 t-20 -64.31 -50.62 67.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.851 0.358 . . . . 0.0 111.213 174.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.41 ' HG3' HG11 ' A' ' 149' ' ' VAL . 96.5 mtp -72.26 -14.33 61.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.188 -177.551 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.595 ' O ' HG12 ' A' ' 103' ' ' VAL . 42.2 t -99.36 -4.12 9.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.235 178.389 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -82.21 70.76 9.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.24 -176.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 48.28 50.95 15.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.209 -176.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 62.1 tpp -79.35 -45.01 20.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.238 -178.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 138.77 159.88 8.2 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 -174.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -64.27 -32.82 74.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.815 0.34 . . . . 0.0 111.204 174.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 94.2 m -65.92 -40.77 91.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.221 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -65.81 -43.42 94.01 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 111.183 -0.767 . . . . 0.0 111.183 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 69.9 t -67.04 -40.69 86.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.799 0.333 . . . . 0.0 111.223 178.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.36 -48.63 80.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.196 176.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -67.4 -32.61 79.76 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 111.177 -0.769 . . . . 0.0 111.177 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -69.48 -35.94 76.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.85 0.357 . . . . 0.0 111.193 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 99.9 m -58.05 -36.95 73.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.184 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -71.99 -24.78 61.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.202 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 82.2 p -89.17 -12.09 41.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.205 -178.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.466 ' HB3' HG21 ' A' ' 87' ' ' VAL . 69.0 mt -57.8 -38.27 75.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.207 -178.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -62.52 -56.38 18.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.237 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.408 ' HB3' ' HB2' ' A' ' 129' ' ' ALA . 36.6 mmt -58.8 -41.67 87.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.215 -179.492 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 80.6 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.393 -174.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.4 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.2 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.408 ' HB2' ' HB3' ' A' ' 120' ' ' MET . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -57.47 -36.04 70.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.224 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 77.9 mt -78.44 -33.13 48.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.217 177.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.34 -38.36 83.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.236 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -82.35 -5.64 58.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.181 -173.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 68.0 m -80.68 157.26 25.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.22 -174.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -61.38 -31.24 71.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.181 173.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 47.3 t90 -53.25 -49.83 66.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.205 176.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -66.25 -40.9 90.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.188 176.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -54.87 -40.19 69.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.218 -176.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -73.78 -45.76 49.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.203 -172.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 56.1 p -132.21 76.7 72.44 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.213 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -55.6 -38.35 94.25 Favored 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 121.672 1.581 . . . . 0.0 111.175 -178.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.8 m-20 -65.54 -56.46 12.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.24 -174.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 44.0 ttm105 -67.06 -40.6 87.12 Favored 'General case' 0 C--N 1.283 -2.302 0 O-C-N 120.552 -1.342 . . . . 0.0 111.166 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.4 93.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.179 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.157 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.4 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' VAL . . . . . 0.41 HG11 ' HG3' ' A' ' 102' ' ' MET . 79.0 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 88.9 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 82.1 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 67.3 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 72.3 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.8 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.3 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 19.0 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.423 HD21 ' HA ' ' A' ' 101' ' ' ASN . 34.0 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.1 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 91.9 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.9 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.3 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.9 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 79.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.6 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.0 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.8 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.5 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.2 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.0 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.417 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.417 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 43.5 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 53.2 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.4 HD11 HD11 ' A' ' 50' ' ' ILE . 72.4 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 91.8 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.9 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.509 HG21 ' HB3' ' A' ' 118' ' ' LEU . 78.8 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.1 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.9 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 94.5 mt -61.36 -40.82 87.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.789 0.328 . . . . 0.0 111.213 177.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ASN . . . . . 0.423 ' HA ' HD21 ' A' ' 7' ' ' LEU . 19.2 t-20 -58.37 -50.29 74.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.204 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 48.2 ttm -73.26 -22.48 60.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.197 -176.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.419 ' O ' ' CG1' ' A' ' 103' ' ' VAL . 20.3 t -89.84 -10.87 10.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.179 178.009 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -70.36 76.93 0.55 Allowed 'General case' 0 C--N 1.38 1.923 0 C-N-CA 124.614 1.166 . . . . 0.0 111.259 -173.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 54.8 39.42 31.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.191 174.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 25.2 mmt -92.64 169.82 10.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.163 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.26 150.01 51.7 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 111.251 -0.74 . . . . 0.0 111.251 -175.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -61.12 -34.99 75.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.834 0.349 . . . . 0.0 111.203 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 70.4 p -65.48 -31.39 72.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.208 -172.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -75.36 -37.83 40.56 Favored Glycine 0 CA--C 1.523 0.591 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 177.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 79.0 t -65.1 -35.54 75.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.808 0.337 . . . . 0.0 111.132 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.68 -48.0 80.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.226 178.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -65.77 -37.94 93.92 Favored Glycine 0 CA--C 1.524 0.598 0 N-CA-C 111.233 -0.747 . . . . 0.0 111.233 177.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -63.56 -37.52 87.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.832 0.348 . . . . 0.0 111.206 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.445 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 96.4 m -59.88 -37.88 80.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.205 178.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -73.14 -17.79 61.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.243 178.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 67.5 m -95.25 -3.31 47.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.162 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.509 ' HB3' HG21 ' A' ' 87' ' ' VAL . 71.3 mt -62.41 -35.32 78.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.183 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 78.9 ttt180 -59.51 -55.93 28.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.215 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.9 mmt -59.77 -39.84 86.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.218 -175.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.393 -177.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.0 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -62.6 -31.14 71.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.225 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 79.3 mt -78.51 -38.84 39.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.189 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.76 -27.39 68.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.203 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -87.67 -5.09 58.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.188 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 72.0 m -80.51 174.17 11.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.204 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -74.71 -33.25 62.37 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.188 -170.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 -56.25 -47.65 78.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.239 178.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -68.0 -41.12 82.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.225 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -63.46 -33.4 75.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.2 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 96.6 mm-40 -78.6 -47.52 16.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.179 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 27.9 m -136.01 83.49 33.83 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.191 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -69.66 -27.49 26.88 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 121.695 1.597 . . . . 0.0 111.145 -175.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -66.93 -40.82 87.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.231 -174.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -86.96 -40.29 14.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.194 179.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -57.68 -39.64 77.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.192 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.157 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 94.5 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 69.5 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 90.6 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.5 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.7 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 37.9 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.2 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 16.6 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 35.8 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.9 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.6 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.1 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.2 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.5 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.4 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.1 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 28.7 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.419 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.419 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.6 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.4 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.7 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 73.1 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 60.1 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 78.1 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.1 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.0 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.552 HG21 ' HB3' ' A' ' 118' ' ' LEU . 77.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 60.7 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.3 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 88.0 mt -60.47 -41.41 87.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.807 0.337 . . . . 0.0 111.206 177.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -73.65 -26.06 60.58 Favored 'General case' 1 C--N 1.237 -4.292 0 C-N-CA 127.061 2.145 . . . . 0.0 111.225 -177.523 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 4.4 tpt -84.25 -20.72 31.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.224 179.117 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 23.1 m -106.21 7.26 9.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.231 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -76.27 75.05 3.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.214 -178.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 57.87 44.47 19.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.193 176.279 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 26.0 mmt -91.56 161.0 15.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.205 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.91 160.15 26.43 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 176.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -63.86 -27.3 69.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.851 0.358 . . . . 0.0 111.202 -177.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 100.0 m -70.0 -42.91 72.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.165 -177.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -63.15 -43.35 98.79 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.149 -0.78 . . . . 0.0 111.149 173.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 62.0 t -65.03 -40.07 87.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.797 0.332 . . . . 0.0 111.185 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -62.9 -48.89 77.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.214 177.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.58 -37.57 92.41 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -69.83 -42.85 73.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.814 0.34 . . . . 0.0 111.197 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.504 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 39.4 p -68.79 -20.47 64.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.212 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -89.87 -2.71 58.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.229 -179.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 51.7 m -120.13 15.23 12.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.232 179.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.552 ' HB3' HG21 ' A' ' 87' ' ' VAL . 77.6 mt -68.32 -34.61 76.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.172 -176.278 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -62.24 -47.75 83.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.135 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.7 mmt -63.89 -40.94 97.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.218 -177.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.393 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.1 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -62.04 -35.96 80.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.226 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 75.3 mt -72.48 -39.56 67.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.246 -177.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -78.08 -16.35 58.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.217 -178.117 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -71.72 -25.72 62.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.219 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 83.7 p -69.51 163.18 25.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.163 -179.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -70.96 -29.11 65.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.191 -174.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 77.7 t-105 -51.92 -35.6 46.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.197 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -65.83 -34.05 77.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.186 -178.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -71.53 -32.09 67.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.196 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -78.94 -37.91 38.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.186 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 77.0 p -134.81 69.24 71.61 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.206 -178.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -71.72 -31.04 13.72 Favored 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 120.124 0.549 . . . . 0.0 111.197 -168.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -73.07 -51.05 19.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.181 -177.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 40.2 ttm105 -65.47 -42.27 92.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.165 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -67.64 -39.9 84.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.231 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.192 -0.458 . . . . 0.0 112.157 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.7 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 72.9 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 91.2 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 94.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 44.4 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.465 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 12.9 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 51.1 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.6 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.2 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.8 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.2 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.0 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.2 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.0 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.5 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.9 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.416 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.5 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.416 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 33.6 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 51.6 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.4 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.8 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.0 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.3 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.406 HG21 ' HB3' ' A' ' 118' ' ' LEU . 71.8 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.8 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.1 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.465 HG21 HG12 ' A' ' 3' ' ' ILE . 96.8 mt -56.7 -42.42 76.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 52.6 t-20 -70.2 -38.69 75.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.229 -178.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.4 tpp -62.32 -33.58 74.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.16 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 15.9 m -98.27 -18.19 6.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.241 -177.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -53.31 109.47 0.44 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.209 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 46.5 43.04 11.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.154 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 62.5 tpp -100.44 140.99 33.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.188 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -76.24 -178.43 44.99 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 111.204 -0.758 . . . . 0.0 111.204 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -65.41 -30.68 71.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.789 0.328 . . . . 0.0 111.213 -178.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 95.9 m -65.59 -50.14 66.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.194 -177.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.37 -39.6 94.27 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 111.176 -0.77 . . . . 0.0 111.176 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 55.1 t -66.22 -37.46 79.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.836 0.351 . . . . 0.0 111.21 -179.033 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.36 -43.01 95.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.161 176.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.03 -41.32 97.92 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 111.168 -0.773 . . . . 0.0 111.168 177.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -71.03 -35.68 72.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.779 0.323 . . . . 0.0 111.196 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 97.8 m -65.19 -29.42 70.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.231 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -85.7 6.43 27.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.191 176.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 30.7 m -119.7 18.38 12.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.184 176.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.406 ' HB3' HG21 ' A' ' 87' ' ' VAL . 74.0 mt -91.62 1.7 56.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.18 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -102.05 15.67 28.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.195 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 67.7 mtt -134.72 -38.12 0.82 Allowed 'General case' 0 C--N 1.339 0.136 0 CA-C-O 120.808 0.337 . . . . 0.0 111.24 176.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.9 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.393 -178.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -61.55 -37.7 84.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.222 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 55.2 mt -72.28 -33.02 67.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.182 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.86 -14.18 62.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.226 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -103.33 16.78 25.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.193 178.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 80.7 p -88.92 168.86 12.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.214 172.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -71.12 -29.27 65.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.17 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 40.3 t-105 -62.47 -41.08 98.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.19 -178.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 83.8 t80 -67.1 -44.87 78.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.18 -178.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -64.91 -33.99 77.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.189 177.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -69.22 -48.15 62.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.175 179.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 55.3 p -134.45 82.04 47.17 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.207 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -62.58 -40.83 35.49 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 121.738 1.625 . . . . 0.0 111.218 -167.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -68.9 -55.85 9.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.209 -174.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 44.6 ttm105 -57.19 -46.37 82.92 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-O 120.839 0.352 . . . . 0.0 111.255 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.13 -37.98 89.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.207 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.157 175.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 77.2 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 86.7 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.4 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 80.8 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 33.1 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.44 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 13.1 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 60.4 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.6 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.6 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.7 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.1 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.2 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.8 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.421 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.421 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.8 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 54.0 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.4 HD11 HD11 ' A' ' 50' ' ' ILE . 72.7 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.4 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 88.6 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 97.0 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.488 HG21 ' HB3' ' A' ' 118' ' ' LEU . 79.4 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.8 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.8 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.44 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -58.08 -42.79 83.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.774 0.321 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 55.6 t-20 -67.36 -35.51 79.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.227 175.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 63.5 tpp -63.27 -28.51 70.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.169 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 33.0 m -112.05 22.72 5.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.182 -178.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -85.7 86.52 7.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.181 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 66.71 20.58 10.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.175 178.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 61.0 tpp -70.88 133.8 46.76 Favored 'General case' 0 C--N 1.333 -0.113 0 O-C-N 118.309 -2.744 . . . . 0.0 111.178 -167.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -64.22 156.01 45.57 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -64.82 -25.16 67.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.823 0.344 . . . . 0.0 111.22 -174.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 72.7 p -66.05 -30.71 71.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.226 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -87.49 -34.01 10.89 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 179.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 77.1 t -66.08 -37.57 80.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.789 0.328 . . . . 0.0 111.198 177.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -58.79 -47.44 84.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.202 177.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -63.76 -43.3 97.94 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 111.184 -0.766 . . . . 0.0 111.184 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -61.37 -36.08 79.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.784 0.326 . . . . 0.0 111.189 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 81.3 m -65.12 -26.92 68.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.167 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -82.32 -10.17 59.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.212 178.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 56.2 m -108.45 -3.09 18.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.217 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.488 ' HB3' HG21 ' A' ' 87' ' ' VAL . 69.9 mt -57.22 -39.64 75.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.164 175.218 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -63.7 -51.96 62.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.22 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.6 mmt -60.65 -40.11 90.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.255 -178.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 81.4 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.393 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.0 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -63.71 -34.12 77.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.208 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.2 -38.61 69.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.245 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -75.76 -1.91 27.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.193 -174.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -96.81 -0.47 47.91 Favored 'General case' 0 C--N 1.385 2.133 0 O-C-N 120.38 -1.45 . . . . 0.0 111.184 175.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 82.8 p -77.11 164.03 26.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.213 -177.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.47 -35.12 79.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.212 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 55.7 t-105 -57.27 -39.91 76.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.217 -178.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -65.35 -41.84 93.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.23 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -65.82 -35.44 80.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.224 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -77.61 -41.85 37.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.18 -176.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 54.9 p -133.25 79.58 61.08 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.18 176.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -62.02 -35.17 78.09 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 121.689 1.592 . . . . 0.0 111.201 -174.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -68.27 -51.47 44.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.199 179.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 85.0 mtt85 -63.04 -45.42 92.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.206 -178.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -66.31 -41.75 89.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.219 -179.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.157 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 70.1 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 92.7 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 35.1 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.475 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.2 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.43 HD21 ' HA ' ' A' ' 101' ' ' ASN . 78.3 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.6 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.2 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.9 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.9 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.7 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.3 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.416 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.416 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.4 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.0 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 55.0 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.8 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.0 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 92.3 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.468 HG21 ' HB3' ' A' ' 118' ' ' LEU . 73.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.0 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.1 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.475 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -56.72 -38.44 58.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.849 0.357 . . . . 0.0 111.212 177.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . 0.43 ' HA ' HD21 ' A' ' 7' ' ' LEU . 49.5 t-20 -65.28 -46.79 79.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.164 178.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.0 mmm -61.73 -30.27 70.66 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 125.039 1.336 . . . . 0.0 111.2 -174.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 24.2 m . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.242 -179.015 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 94.5 p . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.828 0.346 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.468 ' HB3' HG21 ' A' ' 87' ' ' VAL . 70.1 mt -52.32 -45.43 65.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.196 -173.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 78.2 ttt180 -60.33 -59.98 4.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.198 -177.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.4 mmt -59.87 -34.1 72.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.176 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 72.1 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.393 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.2 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.7 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -58.67 -42.07 87.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.207 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.467 ' O ' HD23 ' A' ' 133' ' ' LEU . 1.2 tt -76.21 -35.0 59.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.158 -178.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.48 -30.42 69.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.225 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.0 mttt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.249 -175.451 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo . . . . . 0 N--CA 1.459 -0.558 0 N-CA-C 111.198 -0.347 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -69.16 -52.65 25.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.171 -175.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 43.7 ttm105 -65.88 -45.18 83.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.176 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -62.84 -40.93 98.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.246 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.157 177.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.5 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 72.6 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 92.2 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 40.5 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.9 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.418 HG12 HG21 ' A' ' 100' ' ' ILE . 8.9 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.41 ' HE1' ' HA ' ' A' ' 98' ' ' ALA . 27.3 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.432 HD21 ' HA ' ' A' ' 101' ' ' ASN . 58.8 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.5 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.2 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.4 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.7 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.7 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.5 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.7 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 15.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.3 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.2 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 45.5 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.422 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.422 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.4 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 28.9 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.9 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.4 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.8 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.568 HG21 ' HB3' ' A' ' 118' ' ' LEU . 78.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 60.7 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 85.0 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 90.1 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.41 ' HA ' ' HE1' ' A' ' 6' ' ' MET . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.418 HG21 HG12 ' A' ' 3' ' ' ILE . 96.5 mt -58.97 -38.49 73.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.821 0.344 . . . . 0.0 111.196 177.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . 0.432 ' HA ' HD21 ' A' ' 7' ' ' LEU . 14.6 t-20 -67.35 -43.0 82.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.191 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.5 tpp -64.55 -33.88 76.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.193 -175.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 20.0 m . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.185 -179.963 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.8 m . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.754 0.312 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.568 ' HB3' HG21 ' A' ' 87' ' ' VAL . 76.6 mt -62.3 -36.87 83.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.244 173.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -65.3 -51.56 59.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.229 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.3 mmt -59.01 -41.91 88.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.192 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 79.6 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.393 -178.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.0 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -66.31 -28.27 68.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.209 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 57.5 mt -75.23 -19.58 59.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.181 -178.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -89.31 -2.78 58.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.228 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 97.8 mttt . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.166 -179.315 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo . . . . . 0 N--CA 1.458 -0.596 0 N-CA-C 111.21 -0.342 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -64.66 -29.86 70.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.162 -179.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 42.2 ttm105 -93.48 -41.36 9.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.245 178.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -62.76 -44.0 97.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.243 -178.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.157 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 94.7 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.1 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 89.2 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.8 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 94.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 79.9 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 32.3 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 88.3 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.428 HG12 HG21 ' A' ' 100' ' ' ILE . 9.0 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.4 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.1 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.6 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.4 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.1 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.5 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.8 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.5 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 66.1 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.1 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 88.9 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.7 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.5 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.6 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.3 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 45.9 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.422 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.5 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.422 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.7 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.4 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 37.0 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.7 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.8 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 70.2 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 86.8 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.3 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.558 HG21 ' HB3' ' A' ' 118' ' ' LEU . 70.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 59.3 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.428 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -58.6 -29.16 38.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.796 0.331 . . . . 0.0 111.183 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -80.73 -33.19 35.36 Favored 'General case' 0 C--N 1.292 -1.896 0 C-N-CA 124.548 1.139 . . . . 0.0 111.246 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.8 mmm -72.13 -17.11 61.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.203 179.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 30.0 m . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.168 -176.839 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.6 m . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.852 0.358 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.558 ' HB3' HG21 ' A' ' 87' ' ' VAL . 52.9 mt -73.4 -33.35 64.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.224 -177.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -65.86 -41.7 91.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.192 -176.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.8 mmt -68.45 -38.63 81.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.202 -179.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.0 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.393 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -64.86 -35.35 80.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.198 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 49.3 mt -70.1 -33.11 71.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.192 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.74 -13.3 62.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.23 -177.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.4 mttt . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.214 -179.238 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo . . . . . 0 N--CA 1.458 -0.568 0 N-CA-C 111.187 -0.351 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -67.9 -49.76 60.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.21 176.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.7 mtt85 -70.41 -41.43 72.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.233 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.7 -40.55 95.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.193 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.157 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 95.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 87.3 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 71.9 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 162' ' ' LYS . 28.5 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.463 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.0 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 69.3 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.8 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.5 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.7 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.8 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.7 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.6 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.5 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 28.7 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.421 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.421 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.6 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.1 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 62.0 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.5 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.9 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.8 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.498 HG21 ' HB3' ' A' ' 118' ' ' LEU . 70.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.6 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 91.5 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.463 HG21 HG12 ' A' ' 3' ' ' ILE . 96.3 mt -57.07 -36.35 50.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.847 0.356 . . . . 0.0 111.195 177.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 38.7 t-20 -68.16 -41.9 80.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.199 177.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 91.0 mmm -64.84 -20.13 66.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.149 -173.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 34.9 m . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.242 -176.898 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 69.2 m . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.824 0.345 . . . . 0.0 111.199 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.498 ' HB3' HG21 ' A' ' 87' ' ' VAL . 82.8 mt -76.78 -27.86 55.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.164 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -66.41 -29.44 69.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.189 -174.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.2 mmt -85.18 -34.99 21.96 Favored 'General case' 0 C--N 1.345 0.375 0 C-N-CA 119.261 -0.976 . . . . 0.0 111.253 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.5 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.393 -177.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.9 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -57.41 -37.05 72.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.202 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 87.8 mt -80.11 -33.11 38.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.218 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.51 -28.19 67.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.212 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.0 mttt . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.166 179.34 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo . . . . . 0 N--CA 1.458 -0.581 0 N-CA-C 111.198 -0.347 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -68.77 -52.76 26.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.193 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -68.98 -40.95 78.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.204 -178.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.4 98.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.186 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.182 -0.463 . . . . 0.0 112.157 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.6 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 89.7 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.4 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.2 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 51.7 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.9 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.513 HG12 HG21 ' A' ' 100' ' ' ILE . 8.6 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 27.4 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 76.1 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.5 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.1 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.8 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.3 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 66.2 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.9 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.4 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 28.9 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.419 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.419 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.6 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 55.5 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.6 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.419 ' HB1' HG23 ' A' ' 103' ' ' VAL . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.4 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 85.7 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.531 HG21 ' HB3' ' A' ' 118' ' ' LEU . 85.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.4 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 85.0 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.513 HG21 HG12 ' A' ' 3' ' ' ILE . 96.5 mt -55.31 -38.76 49.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.796 0.331 . . . . 0.0 111.201 177.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . 0.743 HD22 ' C ' ' A' ' 101' ' ' ASN . 0.1 OUTLIER -69.93 -34.25 73.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.18 -179.453 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 94.3 mmm -76.3 -9.14 58.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.159 -177.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.419 HG23 ' HB1' ' A' ' 74' ' ' ALA . 35.5 m . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.252 175.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.786 0.327 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.531 ' HB3' HG21 ' A' ' 87' ' ' VAL . 85.4 mt -96.43 -47.88 5.8 Favored 'General case' 0 C--N 1.332 -0.173 0 O-C-N 120.789 -1.194 . . . . 0.0 111.212 -174.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -48.61 -40.26 26.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.177 -173.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.6 mmt -62.78 -42.7 99.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.216 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.2 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.393 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.5 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -66.94 -30.65 70.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.212 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 58.6 mt -76.0 -19.39 58.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.217 -177.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -80.31 -0.59 37.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.201 -177.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 97.9 mttt . . . . . 0 C--N 1.358 0.961 0 O-C-N 121.601 -0.687 . . . . 0.0 111.193 175.799 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo . . . . . 0 N--CA 1.458 -0.562 0 N-CA-C 111.187 -0.351 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -60.69 -37.41 81.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.203 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -90.25 -37.81 13.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.169 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -59.69 -41.28 90.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.215 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.185 -0.462 . . . . 0.0 112.157 -179.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 95.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.1 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 91.3 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 44.1 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 88.5 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.2 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.0 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.465 HD21 ' HA ' ' A' ' 101' ' ' ASN . 76.0 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.6 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.6 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.5 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.3 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.2 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.4 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.3 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.2 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 88.8 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 14.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.4 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.1 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.9 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.418 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.5 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.418 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 36.2 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.1 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.8 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.7 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 93.5 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.0 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.8 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.466 HG21 ' HB3' ' A' ' 118' ' ' LEU . 79.4 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 59.6 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.1 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 95.3 mt -63.14 -29.1 46.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.8 0.333 . . . . 0.0 111.209 177.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . 0.465 ' HA ' HD21 ' A' ' 7' ' ' LEU . 20.5 t-20 -64.31 -50.62 67.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.851 0.358 . . . . 0.0 111.213 174.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.41 ' HG3' HG11 ' A' ' 149' ' ' VAL . 96.5 mtp -72.26 -14.33 61.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.188 -177.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.595 ' O ' HG12 ' A' ' 103' ' ' VAL . 42.2 t . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.235 178.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 82.2 p . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.801 0.334 . . . . 0.0 111.205 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.466 ' HB3' HG21 ' A' ' 87' ' ' VAL . 69.0 mt -57.8 -38.27 75.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.207 -178.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -62.52 -56.38 18.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.237 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.408 ' HB3' ' HB2' ' A' ' 129' ' ' ALA . 36.6 mmt -58.8 -41.67 87.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.215 -179.492 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 80.6 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.393 -174.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.4 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.2 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.408 ' HB2' ' HB3' ' A' ' 120' ' ' MET . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -57.47 -36.04 70.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.224 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 77.9 mt -78.44 -33.13 48.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.217 177.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.34 -38.36 83.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.236 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.3 mttt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.181 -173.865 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo . . . . . 0 N--CA 1.458 -0.599 0 N-CA-C 111.175 -0.356 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.8 m-20 -65.54 -56.46 12.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.24 -174.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 44.0 ttm105 -67.06 -40.6 87.12 Favored 'General case' 0 C--N 1.283 -2.302 0 O-C-N 120.552 -1.342 . . . . 0.0 111.166 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.4 93.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.179 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.157 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.4 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . 0.41 HG11 ' HG3' ' A' ' 102' ' ' MET . 79.0 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 88.9 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 82.1 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 67.3 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 72.3 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.8 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.3 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 19.0 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.423 HD21 ' HA ' ' A' ' 101' ' ' ASN . 34.0 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.1 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 91.9 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.9 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.3 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.9 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 79.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.6 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.0 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.8 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.5 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.2 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.0 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.417 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.417 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 43.5 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 53.2 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.4 HD11 HD11 ' A' ' 50' ' ' ILE . 72.4 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 91.8 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.9 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.509 HG21 ' HB3' ' A' ' 118' ' ' LEU . 78.8 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.1 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.9 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 94.5 mt -61.36 -40.82 87.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.789 0.328 . . . . 0.0 111.213 177.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . 0.423 ' HA ' HD21 ' A' ' 7' ' ' LEU . 19.2 t-20 -58.37 -50.29 74.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.204 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 48.2 ttm -73.26 -22.48 60.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.197 -176.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.419 ' O ' ' CG1' ' A' ' 103' ' ' VAL . 20.3 t . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.179 178.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 67.5 m . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.779 0.323 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.509 ' HB3' HG21 ' A' ' 87' ' ' VAL . 71.3 mt -62.41 -35.32 78.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.183 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 78.9 ttt180 -59.51 -55.93 28.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.215 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.9 mmt -59.77 -39.84 86.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.218 -175.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.393 -177.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.0 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -62.6 -31.14 71.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.225 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 79.3 mt -78.51 -38.84 39.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.189 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.76 -27.39 68.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.203 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.1 mttt . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.188 179.76 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo . . . . . 0 N--CA 1.458 -0.591 0 N-CA-C 111.145 -0.367 . . . . 0.0 111.145 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -66.93 -40.82 87.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.231 -174.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -86.96 -40.29 14.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.194 179.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -57.68 -39.64 77.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.192 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.157 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 94.5 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 69.5 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 90.6 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.5 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.7 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 37.9 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.2 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 16.6 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 35.8 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.9 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.6 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.1 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.2 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.5 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.4 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.1 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 28.7 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.419 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.419 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.6 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.4 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.7 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 73.1 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 60.1 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 78.1 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.1 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.0 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.552 HG21 ' HB3' ' A' ' 118' ' ' LEU . 77.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 60.7 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.3 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 88.0 mt -60.47 -41.41 87.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.807 0.337 . . . . 0.0 111.206 177.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -73.65 -26.06 60.58 Favored 'General case' 1 C--N 1.237 -4.292 0 C-N-CA 127.061 2.145 . . . . 0.0 111.225 -177.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 4.4 tpt -84.25 -20.72 31.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.224 179.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 23.1 m . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.231 177.983 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 51.7 m . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.801 0.334 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.552 ' HB3' HG21 ' A' ' 87' ' ' VAL . 77.6 mt -68.32 -34.61 76.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.172 -176.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -62.24 -47.75 83.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.135 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.7 mmt -63.89 -40.94 97.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.218 -177.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.393 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.1 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -62.04 -35.96 80.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.226 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 75.3 mt -72.48 -39.56 67.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.246 -177.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -78.08 -16.35 58.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.217 -178.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 88.7 tttt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.219 -179.363 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 N--CA 1.458 -0.587 0 N-CA-C 111.197 -0.347 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -73.07 -51.05 19.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.181 -177.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 40.2 ttm105 -65.47 -42.27 92.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.165 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -67.64 -39.9 84.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.231 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.192 -0.458 . . . . 0.0 112.157 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.7 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 72.9 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 91.2 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 94.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 44.4 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.465 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 12.9 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 51.1 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.6 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.2 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.8 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.2 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.0 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.2 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.0 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.5 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.9 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.416 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.5 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.416 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 33.6 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 51.6 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.4 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.8 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.0 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.3 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.406 HG21 ' HB3' ' A' ' 118' ' ' LEU . 71.8 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.8 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.1 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.465 HG21 HG12 ' A' ' 3' ' ' ILE . 96.8 mt -56.7 -42.42 76.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 52.6 t-20 -70.2 -38.69 75.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.229 -178.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.4 tpp -62.32 -33.58 74.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.16 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 15.9 m . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.241 -177.317 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 30.7 m . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.779 0.323 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.406 ' HB3' HG21 ' A' ' 87' ' ' VAL . 74.0 mt -91.62 1.7 56.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.18 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -102.05 15.67 28.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.195 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 67.7 mtt -134.72 -38.12 0.82 Allowed 'General case' 0 C--N 1.339 0.136 0 CA-C-O 120.808 0.337 . . . . 0.0 111.24 176.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.9 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.393 -178.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -61.55 -37.7 84.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.222 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 55.2 mt -72.28 -33.02 67.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.182 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.86 -14.18 62.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.226 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.193 178.702 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo . . . . . 0 N--CA 1.457 -0.628 0 N-CA-C 111.218 -0.339 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -68.9 -55.85 9.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.209 -174.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 44.6 ttm105 -57.19 -46.37 82.92 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-O 120.839 0.352 . . . . 0.0 111.255 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.13 -37.98 89.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.207 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.157 175.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 77.2 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 86.7 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.4 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 80.8 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 33.1 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.44 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 13.1 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 60.4 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.6 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.6 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.7 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.1 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.2 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.8 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.421 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.421 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.8 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 54.0 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.4 HD11 HD11 ' A' ' 50' ' ' ILE . 72.7 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.4 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 88.6 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 97.0 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.488 HG21 ' HB3' ' A' ' 118' ' ' LEU . 79.4 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.8 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.8 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.44 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -58.08 -42.79 83.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.774 0.321 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 55.6 t-20 -67.36 -35.51 79.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.227 175.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 63.5 tpp -63.27 -28.51 70.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.169 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 33.0 m . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.182 -178.043 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 56.2 m . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.779 0.323 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.488 ' HB3' HG21 ' A' ' 87' ' ' VAL . 69.9 mt -57.22 -39.64 75.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.164 175.218 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -63.7 -51.96 62.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.22 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.6 mmt -60.65 -40.11 90.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.255 -178.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 81.4 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.393 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.0 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -63.71 -34.12 77.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.208 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.2 -38.61 69.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.245 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -75.76 -1.91 27.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.193 -174.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 C--N 1.385 2.133 0 O-C-N 120.38 -1.45 . . . . 0.0 111.184 175.41 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo . . . . . 0 N--CA 1.459 -0.55 0 N-CA-C 111.201 -0.346 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -68.27 -51.47 44.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.199 179.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 85.0 mtt85 -63.04 -45.42 92.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.206 -178.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -66.31 -41.75 89.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.219 -179.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.157 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 70.1 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 92.7 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 35.1 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.475 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.2 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.43 HD21 ' HA ' ' A' ' 101' ' ' ASN . 78.3 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.6 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.2 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.9 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.9 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.7 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.3 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.416 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.416 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.4 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.0 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 55.0 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.8 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.0 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 92.3 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.468 HG21 ' HB3' ' A' ' 118' ' ' LEU . 73.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.0 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.1 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.475 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -56.72 -38.44 58.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.849 0.357 . . . . 0.0 111.212 177.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . 0.43 ' HA ' HD21 ' A' ' 7' ' ' LEU . 49.5 t-20 -65.28 -46.79 79.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.164 178.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.0 mmm -61.73 -30.27 70.66 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 125.039 1.336 . . . . 0.0 111.2 -174.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 24.2 m -102.07 5.86 10.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.242 -179.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -79.68 83.41 5.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.21 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 52.41 51.5 16.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.201 172.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 26.6 mmt -100.22 162.24 13.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.225 177.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -59.63 179.97 1.88 Allowed Glycine 0 CA--C 1.524 0.614 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 168.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.72 -30.36 69.92 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.767 0.318 . . . . 0.0 111.143 173.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 68.1 p -65.19 -35.1 80.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.227 -174.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -68.68 -42.53 79.67 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 111.214 -0.755 . . . . 0.0 111.214 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 77.4 t -64.63 -43.92 96.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.808 0.337 . . . . 0.0 111.212 178.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -63.88 -47.51 80.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.203 -177.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -61.56 -44.17 98.33 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -70.29 -36.08 74.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.753 0.311 . . . . 0.0 111.191 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.459 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 57.7 m -66.0 -32.42 73.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.202 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -76.27 -19.03 58.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.227 178.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 94.5 p -91.29 -14.51 30.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.19 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.468 ' HB3' HG21 ' A' ' 87' ' ' VAL . 70.1 mt -52.32 -45.43 65.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.196 -173.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 78.2 ttt180 -60.33 -59.98 4.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.198 -177.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.4 mmt -59.87 -34.1 72.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.176 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 72.1 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.393 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.2 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.7 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -58.67 -42.07 87.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.207 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.467 ' O ' HD23 ' A' ' 133' ' ' LEU . 1.2 tt -76.21 -35.0 59.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.158 -178.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.48 -30.42 69.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.225 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -92.8 16.2 12.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.249 -175.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 65.6 p -84.41 177.37 8.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.208 -178.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -76.65 -31.83 57.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.158 172.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 60.8 t-105 -55.65 -50.69 69.53 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.165 176.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -60.38 -38.13 82.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.182 -178.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -58.68 -37.37 75.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.223 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -83.2 -40.22 19.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.192 -172.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 64.5 p -135.25 75.77 58.55 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.183 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -57.73 -37.1 97.85 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 121.707 1.605 . . . . 0.0 111.198 -177.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -69.16 -52.65 25.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.171 -175.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 43.7 ttm105 -65.88 -45.18 83.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.176 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -62.84 -40.93 98.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.246 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.157 177.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.5 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 72.6 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 92.2 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 40.5 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.9 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.418 HG12 HG21 ' A' ' 100' ' ' ILE . 8.9 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.41 ' HE1' ' HA ' ' A' ' 98' ' ' ALA . 27.3 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.432 HD21 ' HA ' ' A' ' 101' ' ' ASN . 58.8 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.5 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.2 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.4 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.7 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.7 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.5 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.7 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 15.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.3 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.2 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 45.5 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.422 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.422 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.4 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 28.9 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.9 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.4 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.8 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.568 HG21 ' HB3' ' A' ' 118' ' ' LEU . 78.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 60.7 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 85.0 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 90.1 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.41 ' HA ' ' HE1' ' A' ' 6' ' ' MET . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.418 HG21 HG12 ' A' ' 3' ' ' ILE . 96.5 mt -58.97 -38.49 73.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.821 0.344 . . . . 0.0 111.196 177.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . 0.432 ' HA ' HD21 ' A' ' 7' ' ' LEU . 14.6 t-20 -67.35 -43.0 82.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.191 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.5 tpp -64.55 -33.88 76.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.193 -175.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 20.0 m -93.12 3.05 8.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.185 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -79.5 73.23 6.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.211 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 48.16 58.64 4.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.206 178.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 25.1 mmt -109.34 174.1 6.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.165 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -48.87 136.44 19.37 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.74 -34.03 73.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.756 0.312 . . . . 0.0 111.203 176.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 80.9 p -69.18 -28.34 66.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.184 178.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -77.68 -39.18 25.84 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -176.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 79.1 t -63.23 -40.92 90.86 Favored 'Isoleucine or valine' 0 C--N 1.342 0.256 0 O-C-N 125.729 1.488 . . . . 0.0 111.188 169.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.45 -49.92 74.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.195 -178.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -64.83 -43.92 95.43 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 111.231 -0.747 . . . . 0.0 111.231 177.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -55.43 -40.06 71.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.781 0.324 . . . . 0.0 111.176 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.446 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 94.0 m -59.12 -35.96 74.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.196 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -70.81 -25.41 62.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.177 177.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.8 m -95.46 5.79 50.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.195 -178.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.568 ' HB3' HG21 ' A' ' 87' ' ' VAL . 76.6 mt -62.3 -36.87 83.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.244 173.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -65.3 -51.56 59.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.229 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.3 mmt -59.01 -41.91 88.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.192 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 79.6 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.393 -178.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.0 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -66.31 -28.27 68.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.209 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 57.5 mt -75.23 -19.58 59.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.181 -178.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -89.31 -2.78 58.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.228 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -86.7 -9.85 55.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.166 -179.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 89.1 p -72.91 135.56 45.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.189 175.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 6.3 tpm_? -45.49 -44.07 12.18 Favored 'General case' 0 C--N 1.367 1.339 0 O-C-N 121.464 -0.773 . . . . 0.0 111.164 173.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 74.6 t90 -58.31 -32.33 68.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.197 -171.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -55.66 -45.57 77.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.175 173.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -76.7 -20.86 56.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.2 -176.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -83.01 -40.51 19.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.23 -179.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 62.7 p -134.27 71.34 72.56 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.185 175.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -70.07 -26.17 26.39 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 121.72 1.614 . . . . 0.0 111.21 -173.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -64.66 -29.86 70.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.162 -179.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 42.2 ttm105 -93.48 -41.36 9.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.245 178.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -62.76 -44.0 97.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.243 -178.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.157 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 94.7 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.1 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 89.2 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.8 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 94.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 79.9 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 32.3 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 88.3 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.428 HG12 HG21 ' A' ' 100' ' ' ILE . 9.0 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.4 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.1 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.6 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.4 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.1 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.5 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.8 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.5 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 66.1 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.1 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 88.9 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.7 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.5 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.6 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.3 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 45.9 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.422 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.5 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.422 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.7 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.4 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 37.0 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.7 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.8 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 70.2 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 86.8 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.3 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.558 HG21 ' HB3' ' A' ' 118' ' ' LEU . 70.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 59.3 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.428 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -58.6 -29.16 38.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.796 0.331 . . . . 0.0 111.183 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -80.73 -33.19 35.36 Favored 'General case' 0 C--N 1.292 -1.896 0 C-N-CA 124.548 1.139 . . . . 0.0 111.246 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.8 mmm -72.13 -17.11 61.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.203 179.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 30.0 m -115.31 3.3 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.168 -176.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -75.95 91.71 3.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.203 176.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 58.64 31.6 21.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.197 178.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 57.0 tpp -76.38 143.02 40.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.202 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.61 154.36 50.71 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 178.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -58.01 -40.0 79.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.822 0.344 . . . . 0.0 111.197 -178.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 97.6 m -63.32 -44.43 94.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.149 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -64.69 -38.92 96.26 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.7 t -66.16 -37.95 80.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.753 0.311 . . . . 0.0 111.21 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.09 -45.23 93.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.256 174.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -61.16 -38.83 96.26 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 177.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -68.31 -39.37 82.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.806 0.336 . . . . 0.0 111.186 176.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.455 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 89.2 m -59.08 -39.22 81.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.204 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -66.55 -22.83 66.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.175 -178.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.6 m -99.0 11.77 38.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.245 -176.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.558 ' HB3' HG21 ' A' ' 87' ' ' VAL . 52.9 mt -73.4 -33.35 64.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.224 -177.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -65.86 -41.7 91.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.192 -176.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.8 mmt -68.45 -38.63 81.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.202 -179.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.0 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.393 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -64.86 -35.35 80.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.198 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 49.3 mt -70.1 -33.11 71.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.192 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.74 -13.3 62.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.23 -177.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -92.69 5.04 52.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.214 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 97.1 p -82.68 156.98 23.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.197 178.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -59.44 -33.53 71.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.225 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 54.7 t-105 -58.23 -38.88 77.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.218 -178.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -71.55 -38.86 70.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.225 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -67.22 -29.37 69.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.226 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -85.86 -54.97 4.19 Favored 'General case' 0 C--N 1.344 0.328 0 O-C-N 121.465 -0.772 . . . . 0.0 111.184 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 53.0 p -123.93 78.94 57.89 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.177 177.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -68.23 -24.95 37.29 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 121.675 1.583 . . . . 0.0 111.187 -176.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -67.9 -49.76 60.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.21 176.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.7 mtt85 -70.41 -41.43 72.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.233 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.7 -40.55 95.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.193 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.157 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 95.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 87.3 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 71.9 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 162' ' ' LYS . 28.5 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.463 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.0 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 69.3 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.8 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.5 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.7 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.8 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.7 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.6 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.5 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 28.7 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.421 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.421 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.6 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.1 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 62.0 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.5 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.9 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.8 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.498 HG21 ' HB3' ' A' ' 118' ' ' LEU . 70.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.6 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 91.5 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.463 HG21 HG12 ' A' ' 3' ' ' ILE . 96.3 mt -57.07 -36.35 50.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.847 0.356 . . . . 0.0 111.195 177.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 38.7 t-20 -68.16 -41.9 80.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.199 177.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 91.0 mmm -64.84 -20.13 66.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.149 -173.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 34.9 m -111.24 6.49 8.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.242 -176.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -87.45 107.43 18.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.166 175.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.59 ' O ' ' HG2' ' A' ' 105' ' ' GLN . 33.0 tt0 50.07 54.12 11.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.223 -175.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 63.5 tpp -107.45 136.43 47.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.203 -178.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -74.64 172.54 52.6 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 111.191 -0.763 . . . . 0.0 111.191 -178.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -61.07 -36.41 79.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.832 0.349 . . . . 0.0 111.221 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 98.0 m -68.26 -44.17 76.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.212 -177.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -61.39 -43.72 98.98 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 175.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 55.4 t -63.78 -41.42 92.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.803 0.335 . . . . 0.0 111.216 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -62.64 -46.68 87.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.24 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -61.14 -43.75 99.01 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -69.04 -39.69 79.05 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.801 0.334 . . . . 0.0 111.15 -178.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.461 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 80.0 m -62.58 -37.26 85.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.194 178.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -72.41 -12.18 61.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.202 178.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 69.2 m -108.88 14.98 23.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.199 -177.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.498 ' HB3' HG21 ' A' ' 87' ' ' VAL . 82.8 mt -76.78 -27.86 55.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.164 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -66.41 -29.44 69.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.189 -174.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.2 mmt -85.18 -34.99 21.96 Favored 'General case' 0 C--N 1.345 0.375 0 C-N-CA 119.261 -0.976 . . . . 0.0 111.253 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.5 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.393 -177.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.9 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -57.41 -37.05 72.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.202 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 87.8 mt -80.11 -33.11 38.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.218 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.51 -28.19 67.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.212 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -91.84 6.26 46.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.166 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 67.3 m -89.9 157.42 17.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.194 178.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -61.96 -29.43 70.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.226 -173.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 48.1 t-105 -62.92 -39.21 93.86 Favored 'General case' 0 C--N 1.368 1.392 0 O-C-N 120.178 -1.576 . . . . 0.0 111.183 -177.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -63.85 -43.81 95.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.196 172.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -66.15 -25.49 66.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.214 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 94.3 mm-40 -80.82 -59.93 2.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.246 178.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 40.0 m -125.7 88.9 53.45 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.203 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -76.97 -27.92 6.52 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 121.717 1.611 . . . . 0.0 111.198 -166.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -68.77 -52.76 26.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.193 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -68.98 -40.95 78.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.204 -178.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.4 98.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.186 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.182 -0.463 . . . . 0.0 112.157 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.6 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 89.7 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.4 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.2 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 51.7 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.9 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.513 HG12 HG21 ' A' ' 100' ' ' ILE . 8.6 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 27.4 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 76.1 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.5 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.1 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.8 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.3 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 66.2 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.9 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.4 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 28.9 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.419 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.419 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.6 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 55.5 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 72.8 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.6 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.419 ' HB1' HG23 ' A' ' 103' ' ' VAL . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.4 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 85.7 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.531 HG21 ' HB3' ' A' ' 118' ' ' LEU . 85.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.4 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 85.0 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.513 HG21 HG12 ' A' ' 3' ' ' ILE . 96.5 mt -55.31 -38.76 49.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.796 0.331 . . . . 0.0 111.201 177.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . 0.743 HD22 ' C ' ' A' ' 101' ' ' ASN . 0.1 OUTLIER -69.93 -34.25 73.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.18 -179.453 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 94.3 mmm -76.3 -9.14 58.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.159 -177.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.419 HG23 ' HB1' ' A' ' 74' ' ' ALA . 35.5 m -123.3 27.51 3.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.252 175.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -97.91 92.34 5.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.164 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 57.29 47.54 16.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.224 176.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 26.4 mmt -108.53 163.86 12.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.197 -173.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -72.87 162.3 54.69 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -62.35 -40.31 95.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.821 0.343 . . . . 0.0 111.208 176.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 95.9 m -66.32 -42.42 88.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.182 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -64.53 -43.98 95.8 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.8 t -65.12 -40.46 88.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.791 0.329 . . . . 0.0 111.23 177.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.33 -45.61 84.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.184 177.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -62.38 -37.3 94.4 Favored Glycine 0 CA--C 1.523 0.591 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -69.43 -40.2 77.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.77 0.319 . . . . 0.0 111.2 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 54.3 p -69.47 -18.03 63.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.158 178.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -74.14 -20.08 60.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.21 175.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 49.3 m -115.14 46.0 1.53 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.196 -174.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.531 ' HB3' HG21 ' A' ' 87' ' ' VAL . 85.4 mt -96.43 -47.88 5.8 Favored 'General case' 0 C--N 1.332 -0.173 0 O-C-N 120.789 -1.194 . . . . 0.0 111.212 -174.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -48.61 -40.26 26.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.177 -173.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.6 mmt -62.78 -42.7 99.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.216 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.2 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.393 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.5 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -66.94 -30.65 70.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.212 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 58.6 mt -76.0 -19.39 58.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.217 -177.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -80.31 -0.59 37.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.201 -177.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -106.61 6.66 30.13 Favored 'General case' 0 C--N 1.358 0.961 0 O-C-N 121.601 -0.687 . . . . 0.0 111.193 175.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 82.6 p -75.16 162.92 28.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.242 -177.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 32.7 tpt180 -65.17 -36.57 84.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.216 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 58.2 t-105 -57.0 -40.81 77.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.208 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -69.85 -39.88 76.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.227 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -61.22 -38.39 86.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.19 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -77.72 -56.49 4.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.241 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 51.3 p -129.56 81.0 70.79 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.171 -175.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -61.58 -30.39 85.93 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 121.652 1.568 . . . . 0.0 111.187 175.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -60.69 -37.41 81.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.203 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -90.25 -37.81 13.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.169 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -59.69 -41.28 90.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.215 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.185 -0.462 . . . . 0.0 112.157 -179.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 95.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 76.1 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 91.3 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 44.1 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 88.5 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.2 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.0 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.465 HD21 ' HA ' ' A' ' 101' ' ' ASN . 76.0 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.6 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.6 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.5 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.3 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.2 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.4 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.3 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.2 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 88.8 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 14.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.4 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.1 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.9 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.418 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.5 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.418 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 36.2 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.1 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.8 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.7 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 93.5 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.0 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.8 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.466 HG21 ' HB3' ' A' ' 118' ' ' LEU . 79.4 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 59.6 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.1 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 95.3 mt -63.14 -29.1 46.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.8 0.333 . . . . 0.0 111.209 177.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . 0.465 ' HA ' HD21 ' A' ' 7' ' ' LEU . 20.5 t-20 -64.31 -50.62 67.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.851 0.358 . . . . 0.0 111.213 174.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.41 ' HG3' HG11 ' A' ' 149' ' ' VAL . 96.5 mtp -72.26 -14.33 61.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.188 -177.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.595 ' O ' HG12 ' A' ' 103' ' ' VAL . 42.2 t -99.36 -4.12 9.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.235 178.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -82.21 70.76 9.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.24 -176.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 48.28 50.95 15.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.209 -176.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 62.1 tpp -79.35 -45.01 20.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.238 -178.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 138.77 159.88 8.2 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 -174.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -64.27 -32.82 74.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.815 0.34 . . . . 0.0 111.204 174.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 94.2 m -65.92 -40.77 91.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.221 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -65.81 -43.42 94.01 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 111.183 -0.767 . . . . 0.0 111.183 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 69.9 t -67.04 -40.69 86.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.799 0.333 . . . . 0.0 111.223 178.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.36 -48.63 80.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.196 176.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -67.4 -32.61 79.76 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 111.177 -0.769 . . . . 0.0 111.177 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -69.48 -35.94 76.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.85 0.357 . . . . 0.0 111.193 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 99.9 m -58.05 -36.95 73.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.184 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -71.99 -24.78 61.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.202 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 82.2 p -89.17 -12.09 41.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.205 -178.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.466 ' HB3' HG21 ' A' ' 87' ' ' VAL . 69.0 mt -57.8 -38.27 75.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.207 -178.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -62.52 -56.38 18.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.237 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.408 ' HB3' ' HB2' ' A' ' 129' ' ' ALA . 36.6 mmt -58.8 -41.67 87.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.215 -179.492 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 80.6 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.393 -174.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.4 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.2 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.408 ' HB2' ' HB3' ' A' ' 120' ' ' MET . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -57.47 -36.04 70.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.224 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 77.9 mt -78.44 -33.13 48.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.217 177.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.34 -38.36 83.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.236 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -82.35 -5.64 58.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.181 -173.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 68.0 m -80.68 157.26 25.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.22 -174.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -61.38 -31.24 71.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.181 173.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 47.3 t90 -53.25 -49.83 66.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.205 176.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -66.25 -40.9 90.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.188 176.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -54.87 -40.19 69.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.218 -176.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -73.78 -45.76 49.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.203 -172.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 56.1 p -132.21 76.7 72.44 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.213 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -55.6 -38.35 94.25 Favored 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 121.672 1.581 . . . . 0.0 111.175 -178.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.8 m-20 -65.54 -56.46 12.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.24 -174.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 44.0 ttm105 -67.06 -40.6 87.12 Favored 'General case' 0 C--N 1.283 -2.302 0 O-C-N 120.552 -1.342 . . . . 0.0 111.166 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.4 93.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.179 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.157 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.4 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . 0.41 HG11 ' HG3' ' A' ' 102' ' ' MET . 79.0 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 88.9 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 82.1 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 67.3 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 72.3 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.8 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.3 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 19.0 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.423 HD21 ' HA ' ' A' ' 101' ' ' ASN . 34.0 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.1 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 91.9 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.9 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.3 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.9 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 79.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.6 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.0 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.8 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.5 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.2 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.0 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.417 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.417 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 43.5 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 53.2 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.4 HD11 HD11 ' A' ' 50' ' ' ILE . 72.4 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 91.8 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 95.9 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.509 HG21 ' HB3' ' A' ' 118' ' ' LEU . 78.8 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 58.1 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.9 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 94.5 mt -61.36 -40.82 87.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.789 0.328 . . . . 0.0 111.213 177.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . 0.423 ' HA ' HD21 ' A' ' 7' ' ' LEU . 19.2 t-20 -58.37 -50.29 74.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.204 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 48.2 ttm -73.26 -22.48 60.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.197 -176.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.419 ' O ' ' CG1' ' A' ' 103' ' ' VAL . 20.3 t -89.84 -10.87 10.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.179 178.009 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -70.36 76.93 0.55 Allowed 'General case' 0 C--N 1.38 1.923 0 C-N-CA 124.614 1.166 . . . . 0.0 111.259 -173.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 54.8 39.42 31.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.191 174.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 25.2 mmt -92.64 169.82 10.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.163 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.26 150.01 51.7 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 111.251 -0.74 . . . . 0.0 111.251 -175.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -61.12 -34.99 75.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.834 0.349 . . . . 0.0 111.203 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 70.4 p -65.48 -31.39 72.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.208 -172.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -75.36 -37.83 40.56 Favored Glycine 0 CA--C 1.523 0.591 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 177.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 79.0 t -65.1 -35.54 75.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.808 0.337 . . . . 0.0 111.132 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.68 -48.0 80.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.226 178.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -65.77 -37.94 93.92 Favored Glycine 0 CA--C 1.524 0.598 0 N-CA-C 111.233 -0.747 . . . . 0.0 111.233 177.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -63.56 -37.52 87.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.832 0.348 . . . . 0.0 111.206 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.445 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 96.4 m -59.88 -37.88 80.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.205 178.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -73.14 -17.79 61.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.243 178.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 67.5 m -95.25 -3.31 47.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.162 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.509 ' HB3' HG21 ' A' ' 87' ' ' VAL . 71.3 mt -62.41 -35.32 78.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.183 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 78.9 ttt180 -59.51 -55.93 28.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.215 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.9 mmt -59.77 -39.84 86.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.218 -175.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.393 -177.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.0 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -62.6 -31.14 71.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.225 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 79.3 mt -78.51 -38.84 39.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.189 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.76 -27.39 68.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.203 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -87.67 -5.09 58.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.188 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 72.0 m -80.51 174.17 11.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.204 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -74.71 -33.25 62.37 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.188 -170.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 -56.25 -47.65 78.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.239 178.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -68.0 -41.12 82.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.225 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -63.46 -33.4 75.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.2 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 96.6 mm-40 -78.6 -47.52 16.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.179 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 27.9 m -136.01 83.49 33.83 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.191 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -69.66 -27.49 26.88 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 121.695 1.597 . . . . 0.0 111.145 -175.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -66.93 -40.82 87.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.231 -174.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -86.96 -40.29 14.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.194 179.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -57.68 -39.64 77.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.192 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.157 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 94.5 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 69.5 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 90.6 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.5 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.7 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 37.9 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.2 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 16.6 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 35.8 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.9 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.6 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.7 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.1 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.2 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.5 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.4 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.1 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 28.7 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 46.1 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.419 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.419 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.6 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.4 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.7 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD11 HD11 ' A' ' 50' ' ' ILE . 73.1 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 60.1 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 78.1 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.1 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.0 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.552 HG21 ' HB3' ' A' ' 118' ' ' LEU . 77.5 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 60.7 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.3 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.7 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 88.0 mt -60.47 -41.41 87.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.807 0.337 . . . . 0.0 111.206 177.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -73.65 -26.06 60.58 Favored 'General case' 1 C--N 1.237 -4.292 0 C-N-CA 127.061 2.145 . . . . 0.0 111.225 -177.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 4.4 tpt -84.25 -20.72 31.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.224 179.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 23.1 m -106.21 7.26 9.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.231 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -76.27 75.05 3.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.214 -178.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 57.87 44.47 19.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.193 176.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 26.0 mmt -91.56 161.0 15.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.205 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.91 160.15 26.43 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 176.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -63.86 -27.3 69.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.851 0.358 . . . . 0.0 111.202 -177.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 100.0 m -70.0 -42.91 72.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.165 -177.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -63.15 -43.35 98.79 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.149 -0.78 . . . . 0.0 111.149 173.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 62.0 t -65.03 -40.07 87.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.797 0.332 . . . . 0.0 111.185 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -62.9 -48.89 77.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.214 177.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.58 -37.57 92.41 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -69.83 -42.85 73.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.814 0.34 . . . . 0.0 111.197 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.504 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 39.4 p -68.79 -20.47 64.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.212 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -89.87 -2.71 58.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.229 -179.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 51.7 m -120.13 15.23 12.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.232 179.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.552 ' HB3' HG21 ' A' ' 87' ' ' VAL . 77.6 mt -68.32 -34.61 76.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.172 -176.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -62.24 -47.75 83.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.135 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.7 mmt -63.89 -40.94 97.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.218 -177.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.393 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.1 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -62.04 -35.96 80.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.226 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 75.3 mt -72.48 -39.56 67.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.246 -177.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -78.08 -16.35 58.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.217 -178.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -71.72 -25.72 62.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.219 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 83.7 p -69.51 163.18 25.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.163 -179.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -70.96 -29.11 65.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.191 -174.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 77.7 t-105 -51.92 -35.6 46.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.197 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -65.83 -34.05 77.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.186 -178.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -71.53 -32.09 67.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.196 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -78.94 -37.91 38.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.186 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 77.0 p -134.81 69.24 71.61 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.206 -178.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -71.72 -31.04 13.72 Favored 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 120.124 0.549 . . . . 0.0 111.197 -168.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -73.07 -51.05 19.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.181 -177.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 40.2 ttm105 -65.47 -42.27 92.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.165 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -67.64 -39.9 84.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.231 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.192 -0.458 . . . . 0.0 112.157 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.7 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 72.9 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 91.2 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 94.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 44.4 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.2 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.465 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 12.9 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 51.1 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.6 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.2 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.8 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.2 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 46' ' ' LEU . 14.0 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.2 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.0 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.5 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.3 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.9 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.416 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.5 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.416 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 33.6 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 51.6 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.4 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.0 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.8 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 90.0 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.3 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.406 HG21 ' HB3' ' A' ' 118' ' ' LEU . 71.8 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.8 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.1 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.465 HG21 HG12 ' A' ' 3' ' ' ILE . 96.8 mt -56.7 -42.42 76.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 52.6 t-20 -70.2 -38.69 75.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.229 -178.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.4 tpp -62.32 -33.58 74.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.16 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 15.9 m -98.27 -18.19 6.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.241 -177.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -53.31 109.47 0.44 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.209 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 46.5 43.04 11.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.154 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 62.5 tpp -100.44 140.99 33.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.188 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -76.24 -178.43 44.99 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 111.204 -0.758 . . . . 0.0 111.204 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -65.41 -30.68 71.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.789 0.328 . . . . 0.0 111.213 -178.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 95.9 m -65.59 -50.14 66.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.194 -177.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.37 -39.6 94.27 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 111.176 -0.77 . . . . 0.0 111.176 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 55.1 t -66.22 -37.46 79.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.836 0.351 . . . . 0.0 111.21 -179.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.36 -43.01 95.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.161 176.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.03 -41.32 97.92 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 111.168 -0.773 . . . . 0.0 111.168 177.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -71.03 -35.68 72.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.779 0.323 . . . . 0.0 111.196 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 97.8 m -65.19 -29.42 70.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.231 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -85.7 6.43 27.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.191 176.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 30.7 m -119.7 18.38 12.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.184 176.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.406 ' HB3' HG21 ' A' ' 87' ' ' VAL . 74.0 mt -91.62 1.7 56.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.18 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -102.05 15.67 28.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.195 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 67.7 mtt -134.72 -38.12 0.82 Allowed 'General case' 0 C--N 1.339 0.136 0 CA-C-O 120.808 0.337 . . . . 0.0 111.24 176.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.9 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.393 -178.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -61.55 -37.7 84.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.222 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 55.2 mt -72.28 -33.02 67.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.182 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.86 -14.18 62.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.226 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -103.33 16.78 25.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.193 178.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 80.7 p -88.92 168.86 12.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.214 172.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -71.12 -29.27 65.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.17 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 40.3 t-105 -62.47 -41.08 98.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.19 -178.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 83.8 t80 -67.1 -44.87 78.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.18 -178.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -64.91 -33.99 77.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.189 177.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -69.22 -48.15 62.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.175 179.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 55.3 p -134.45 82.04 47.17 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.207 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -62.58 -40.83 35.49 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 121.738 1.625 . . . . 0.0 111.218 -167.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -68.9 -55.85 9.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.209 -174.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 44.6 ttm105 -57.19 -46.37 82.92 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-O 120.839 0.352 . . . . 0.0 111.255 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.13 -37.98 89.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.207 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.157 175.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 77.2 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 86.7 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.4 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 80.8 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 33.1 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -159.61 177.78 10.54 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 175.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.44 HG12 HG21 ' A' ' 100' ' ' ILE . 8.8 tp -57.88 -37.11 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 O-C-N 123.352 0.407 . . . . 0.0 111.638 -175.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -65.53 -50.32 65.66 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.701 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -63.72 -37.86 88.94 Favored 'General case' 0 C--O 1.244 0.763 0 CA-C-O 121.146 0.498 . . . . 0.0 110.894 179.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 13.1 ttt -60.38 -53.94 51.64 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.554 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 60.4 mt -68.39 -31.61 71.09 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.033 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 tpt85 -60.57 -40.71 92.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.254 0.549 . . . . 0.0 110.419 175.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.98 -48.38 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.676 175.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -72.11 -30.92 65.55 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -174.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -104.07 -21.65 13.55 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.5 -172.0 48.74 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.7 tp -141.86 120.29 12.39 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 176.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -134.13 131.46 38.72 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 178.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.03 -3.13 48.87 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -172.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -117.28 146.01 43.59 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.137 0.898 . . . . 0.0 108.885 175.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.2 mt -49.28 130.29 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -137.58 170.82 15.42 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.35 132.75 46.75 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.08 0.467 . . . . 0.0 110.893 175.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -75.38 -173.27 2.03 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.767 -178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.6 p -63.53 -21.14 66.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -175.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -95.28 -0.23 53.13 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.61 62.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.753 0.661 . . . . 0.0 114.753 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -96.56 138.19 34.51 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -59.87 131.24 50.26 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 124.0 0.812 . . . . 0.0 111.394 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.6 m -147.16 159.83 43.16 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 -168.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.505 HG21 HD13 ' A' ' 46' ' ' LEU . 14.1 tt -147.55 162.41 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.67 174.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.72 -129.06 27.22 Favored Glycine 0 N--CA 1.461 0.308 0 O-C-N 123.396 0.435 . . . . 0.0 112.347 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.7 mt -101.49 72.53 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 -178.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.25 32.55 84.57 Favored Glycine 0 CA--C 1.525 0.686 0 CA-C-N 115.251 -0.886 . . . . 0.0 115.207 178.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -82.32 101.41 10.55 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 117.799 0.8 . . . . 0.0 111.181 174.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.1 tp -64.47 127.95 33.71 Favored 'General case' 0 C--O 1.247 0.954 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.061 178.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.6 mt -91.98 -45.29 8.41 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.2 t -170.55 155.44 4.98 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.757 0.661 . . . . 0.0 110.223 -174.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.14 -3.98 53.03 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.546 172.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.8 t -65.07 139.78 97.83 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.113 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.37 -3.87 14.52 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 120.758 0.972 . . . . 0.0 113.447 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 t -82.47 114.89 21.21 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.24 -36.9 76.27 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 173.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -60.26 -39.9 88.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 174.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.29 97.15 Favored 'General case' 0 C--O 1.245 0.825 0 O-C-N 123.379 0.424 . . . . 0.0 110.512 177.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.05 -45.18 93.69 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 124.011 0.819 . . . . 0.0 111.698 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -62.78 -40.48 97.44 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -59.05 -46.82 87.27 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.242 177.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -61.37 -41.41 97.05 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.388 179.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.505 HD13 HG21 ' A' ' 27' ' ' ILE . 45.8 tp -59.65 -50.46 73.77 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.965 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -57.89 -42.18 84.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.992 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -65.26 -38.63 90.91 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 120.982 0.42 . . . . 0.0 111.556 177.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.57 93.76 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 178.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.421 HG22 ' HG2' ' A' ' 52' ' ' ARG . 49.4 mm -92.83 -29.08 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.62 -171.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.78 25.45 38.27 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 116.228 -0.442 . . . . 0.0 113.785 -179.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.421 ' HG2' HG22 ' A' ' 50' ' ' ILE . 54.5 ptt85 -157.36 160.89 38.92 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -77.72 104.19 8.11 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.8 p -90.57 176.12 6.8 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -175.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -112.02 34.62 4.13 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.242 0.544 . . . . 0.0 110.024 171.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.56 12.09 80.35 Favored Glycine 0 N--CA 1.479 1.537 0 N-CA-C 108.234 -1.946 . . . . 0.0 108.234 -170.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 89.5 t -130.35 133.01 64.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 117.593 0.697 . . . . 0.0 110.219 -175.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 48.5 pt -123.8 168.34 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.159 177.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 54.0 p -86.59 166.38 15.44 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.456 177.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.06 -42.65 98.89 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.813 -0.355 . . . . 0.0 111.128 175.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -57.98 -43.03 86.3 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.27 -40.45 90.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.812 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.87 95.45 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 177.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -70.15 -32.96 71.19 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.817 -178.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -62.17 -49.26 76.52 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.09 0.472 . . . . 0.0 110.932 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.4 HD11 HD11 ' A' ' 50' ' ' ILE . 72.7 mt -58.51 -42.61 88.05 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.325 0.583 . . . . 0.0 110.438 176.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -59.33 -47.23 86.2 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.359 -177.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -60.22 -41.65 93.5 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.283 178.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -61.2 -43.26 99.16 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.19 176.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -67.13 -38.52 85.7 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.95 -46.12 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -54.09 -48.85 70.26 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.728 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.33 -47.49 73.35 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.075 0.464 . . . . 0.0 111.621 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 74.4 t -60.05 -46.23 94.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.246 176.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -54.9 -46.85 74.88 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 176.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.45 -41.38 98.58 Favored Glycine 0 C--O 1.243 0.689 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.373 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 88.6 mt -63.71 -50.49 77.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.2 mt -66.91 -26.1 66.7 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.2 mtp-105 -90.07 -5.4 56.61 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -98.58 125.61 43.89 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.07 69.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -176.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.05 -37.85 21.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.587 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 97.0 mt -82.51 -38.69 23.47 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -175.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -54.61 -52.18 72.17 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -174.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.67 -34.83 91.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 116.554 -1.831 . . . . 0.0 113.904 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.488 HG21 ' HB3' ' A' ' 118' ' ' LEU . 79.4 t -67.94 -48.96 72.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -54.02 -49.09 69.7 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.548 175.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -57.85 -32.3 67.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.8 p -77.82 -15.54 58.99 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -173.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.2 mt -90.51 153.83 20.08 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.89 165.45 24.12 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.742 0.817 . . . . 0.0 109.774 167.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.23 -33.02 72.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -174.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.8 t -68.26 -49.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -65.63 -31.76 72.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -56.29 -41.48 75.97 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.319 172.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.88 -42.92 85.61 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.011 0.819 . . . . 0.0 110.826 175.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.18 94.28 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.067 0.46 . . . . 0.0 111.284 178.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.98 92.37 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.012 0.434 . . . . 0.0 112.149 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.44 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -58.08 -42.79 83.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.774 0.321 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 55.6 t-20 -67.36 -35.51 79.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.227 175.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 63.5 tpp -63.27 -28.51 70.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.169 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 33.0 m -112.05 22.72 5.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.182 -178.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -85.7 86.52 7.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.181 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 66.71 20.58 10.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.175 178.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 61.0 tpp -70.88 133.8 46.76 Favored 'General case' 0 C--N 1.333 -0.113 0 O-C-N 118.309 -2.744 . . . . 0.0 111.178 -167.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -64.22 156.01 45.57 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -64.82 -25.16 67.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.823 0.344 . . . . 0.0 111.22 -174.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 72.7 p -66.05 -30.71 71.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.226 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -87.49 -34.01 10.89 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 179.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 77.1 t -66.08 -37.57 80.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.789 0.328 . . . . 0.0 111.198 177.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -58.79 -47.44 84.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.202 177.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -63.76 -43.3 97.94 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 111.184 -0.766 . . . . 0.0 111.184 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -61.37 -36.08 79.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.784 0.326 . . . . 0.0 111.189 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 81.3 m -65.12 -26.92 68.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.167 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -82.32 -10.17 59.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.212 178.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 56.2 m -108.45 -3.09 18.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.217 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.488 ' HB3' HG21 ' A' ' 87' ' ' VAL . 69.9 mt -57.22 -39.64 75.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.164 175.218 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -63.7 -51.96 62.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.22 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.6 mmt -60.65 -40.11 90.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.255 -178.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 81.4 mt -66.3 -43.84 85.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.393 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.873 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -77.54 -8.04 57.21 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 121.828 0.823 . . . . 0.0 113.159 176.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 93.3 mttt 61.27 35.54 18.15 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.168 -176.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -93.58 76.38 4.38 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 175.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 20.0 m95 -62.51 -46.9 86.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -165.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -65.41 -42.33 92.65 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.751 179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -63.66 -45.43 90.2 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.274 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.23 82.25 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 175.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.83 87.48 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.51 -45.19 97.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-O 121.123 0.487 . . . . 0.0 110.736 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -63.71 -34.12 77.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.208 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.2 -38.61 69.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.245 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -75.76 -1.91 27.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.193 -174.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -96.81 -0.47 47.91 Favored 'General case' 0 C--N 1.385 2.133 0 O-C-N 120.38 -1.45 . . . . 0.0 111.184 175.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 82.8 p -77.11 164.03 26.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.213 -177.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.47 -35.12 79.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.212 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 55.7 t-105 -57.27 -39.91 76.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.217 -178.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -65.35 -41.84 93.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.23 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -65.82 -35.44 80.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.224 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -77.61 -41.85 37.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.18 -176.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 54.9 p -133.25 79.58 61.08 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.18 176.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -62.02 -35.17 78.09 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 121.689 1.592 . . . . 0.0 111.201 -174.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -68.27 -51.47 44.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.199 179.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 85.0 mtt85 -63.04 -45.42 92.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.206 -178.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -66.31 -41.75 89.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.219 -179.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.157 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.1 mtm-85 -62.52 -46.56 87.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 70.1 t -66.57 -44.27 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -176.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 92.7 mt -61.57 -42.0 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 177.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 83.2 m -58.91 -37.61 77.03 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.066 0.46 . . . . 0.0 111.252 175.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 96.3 m -64.16 -44.25 92.68 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.422 176.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -65.5 -36.9 85.21 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.614 174.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.1 ttp85 -70.93 -39.61 72.56 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.666 -174.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.4 p -105.4 -24.74 12.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 66.27 22.32 70.9 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.61 -0.328 . . . . 0.0 112.295 -172.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 35.1 p -121.3 169.45 10.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 176.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -96.87 20.18 11.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.748 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -56.83 -33.53 66.84 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.82 -13.17 61.24 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.13 -5.33 13.06 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -73.05 -25.67 61.01 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 -174.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -82.44 -5.73 58.86 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.323 0.582 . . . . 0.0 111.586 175.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.239 0.51 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -165.829 . . . . . . . . 1 1 . 1 stop_ save_